FN Thomson Reuters Web of Science™ VR 1.0 PT J AU Matanovic, I Artyushkova, K Strand, MB Dzara, MJ Pylypenko, S Atanassov, P AF Matanovic, Ivana Artyushkova, Kateryna Strand, Matthew B. Dzara, Michael J. Pylypenko, Svitlana Atanassov, Plamen TI Core Level Shifts of Hydrogenated Pyridinic and Pyrrolic Nitrogen in the Nitrogen-Containing Graphene-Based Electrocatalysts: In-Plane vs Edge Defects SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID OXYGEN REDUCTION REACTION; DENSITY-FUNCTIONAL THEORY; INITIO MOLECULAR-DYNAMICS; TOTAL-ENERGY CALCULATIONS; NON-PGM ELECTROCATALYSTS; AUGMENTED-WAVE METHOD; DOPED GRAPHENE; REACTION CATALYSTS; CATHODE CATALYSTS; ACTIVE-SITES AB A combination of N 1s X-ray photoelectron spectroscopy (XPS) and first principles calculations of nitrogen-containing model electrocatalysts was used to elucidate the nature of the nitrogen defects that contribute to the binding energy (BE) range of the N 1s XPS spectra of these materials above similar to 400 eV. Experimental core level shifts were obtained for a set of model materials, namely N-doped carbon nanospheres, Fe-N-carbon nanospheres, polypyrrole, polypyridine, and pyridinium chloride, and were compared to the shifts calculated using density functional theory. The results confirm that the broad peak positioned at similar to 400.7 eV in the N is XPS spectra of N-containing catalysts, which is typically assigned to pyrrolic nitrogen, contains contributions from other hydrogenated nitrogen species such as hydrogenated pyridinic functionalities. Namely, N 1s BEs of hydrogenated pyridinic-N and pyrrolic-N were calculated as 400.6 and 400.7 eV, respectively, using the Perdew-Burke-Ernzerhof exchange-correlation functional. A special emphasis was placed on the study of the differences in the XPS imprint of N-containing defects that are situated in the plane and on the edges of the graphene sheet. Density functional theory calculations for BEs of the N 1s of in-plane and edge defects show that hydrogenated N defects are more sensitive to the change in the chemical environment in the carbon matrix than the non-hydrogenated N defects. Calculations also show that edge-hydrogenated pyridinic-N and pyrrolic-N defects only contribute to the N 1s XPS peak located at similar to 400.7 eV if the graphene edges are oxygenated or terminated with bare carbon atoms. C1 [Matanovic, Ivana; Artyushkova, Kateryna; Atanassov, Plamen] Univ New Mexico, CMEM, Dept Chem & Biol Engn, Albuquerque, NM 87131 USA. [Matanovic, Ivana] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. [Strand, Matthew B.; Dzara, Michael J.; Pylypenko, Svitlana] Colorado Sch Mines, Dept Chem, Golden, CO 80401 USA. RP Atanassov, P (reprint author), Univ New Mexico, CMEM, Dept Chem & Biol Engn, Albuquerque, NM 87131 USA. EM plamen@unm.edu OI Atanassov, Plamen/0000-0003-2996-472X; Strand, Matthew/0000-0001-8810-1743 FU Center for Microengineered Materials; Colorado School of Mines; Office of Science of the U.S. Department of Energy [DE-AC52-06NA25396]; Department of Energy's Office of Biological and Environmental Research FX This work was supported by Center for Microengineered Materials and start-up funds from Colorado School of Mines. VASP license was provided by Theoretical Division, LANL, which is supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC52-06NA25396. Computational work was performed using the computational resources of EMSL, a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory. This paper has been designated LA-UR-16-27267. NR 54 TC 1 Z9 1 U1 20 U2 20 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 29 PY 2016 VL 120 IS 51 BP 29225 EP 29232 DI 10.1021/acs.jpcc.6b09778 PG 8 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG6MK UT WOS:000391160400036 ER PT J AU Licht, RB Getsoian, A Bell, AT AF Licht, Rachel B. Getsoian, Andrew Bean Bell, Alexis T. TI Identifying the Unique Properties of alpha-Bi2Mo3O12 for the Activation of Propene SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID BISMUTH MOLYBDATE CATALYSTS; DENSITY-FUNCTIONAL THEORY; METAL OXIDE CATALYSTS; SELECTIVE OXIDATION; AMMOXIDATION CATALYSIS; CRYSTAL-STRUCTURE; MOLYBDENUM OXIDE; SCHEELITE STRUCTURE; VANADATE CATALYSTS; SURFACE-STRUCTURE AB In order to understand the remarkable activity of alpha-Bi2Mo3O12 for selective oxidation and ammoxidation of propene, the propene activation ability of four molybdenum-based mixed metal oxides-Bi2Mo3O12, PbMoO4, Bi2Pb5Mo8O32, and MoO3-was investigated using density functional theory. Propene activation is considered to occur via abstraction of a hydrogen atom from the methyl group of physisorbed propene by lattice oxygen. For each material, the activation energy was estimated by summing the heat of adsorption of propene, the C-H bond dissociation energy, and the hydrogen attachment energy (HAE) for hydrogen addition to lattice oxygen; this sum provides a lower bound for the apparent activation energy. It was found that two structural features of oxide surfaces are essential to achieve low activation barriers: under-coordinated surface cation sites enable strong propene adsorption, and Suitable 5- or 6-coordinate geometries at molybdenum result in favorable HAEs. The impact of molybdenum coordination on HAE was elucidated by carrying out a molecular orbital analysis using a cluster model of the molybdate unit. This effort revealed that, in 5- and 6-coordinate molybdates, oxygen donor atoms trans to molybdenyl oxo atoms destabilize the molybdate prior to H addition but stabilize the molybdate after H addition, thereby providing an HAE similar to 15 kcal/mol more favorable than that on 4-coordinate molybdate oxo atoms. Bi3+ cations in Bi2Mo3O12 thus promote catalytic activity by providing both strong adsorption for propene and forcing molybdate into 5-coordinate geometries that lead to particularly favorable values of the HAE. C1 [Bell, Alexis T.] Univ Calif Berkeley, Dept Chem & Biomol Engn, Berkeley, CA 94720 USA. Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. RP Bell, AT (reprint author), Univ Calif Berkeley, Dept Chem & Biomol Engn, Berkeley, CA 94720 USA. FU Office of Basic Science of the U.S. Department of Energy [DE-AC02-05CH11231]; NSF Grant [CHE-0840505]; Office of Science, Office of Basic Energy Sciences; Division of Chemical Sciences, Geosciences, and Biosciences of the U.S. Department of Energy at Lawrence Berkeley National Laboratory [DE-AC02-05CH11231] FX Calculations presented in this work were conducted at the National Energy Research Scientific Computing Center (NERSC), which is supported by the Office of Basic Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. Additional calculations were performed at the University of California, Berkeley Molecular Graphics and Computation Facility, which is supported by NSF Grant CHE-0840505. Funding for this work was provided by the Director, Office of Science, Office of Basic Energy Sciences, and by the Division of Chemical Sciences, Geosciences, and Biosciences of the U.S. Department of Energy at Lawrence Berkeley National Laboratory under Contract No. DE-AC02-05CH11231. NR 59 TC 0 Z9 0 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 29 PY 2016 VL 120 IS 51 BP 29233 EP 29247 DI 10.1021/acs.jpcc.6b09949 PG 15 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG6MK UT WOS:000391160400037 ER PT J AU Butorin, SM Modin, A Vegelius, JR Kvashnina, KO Shuh, DK AF Butorin, Sergei M. Modin, Anders Vegelius, Johan R. Kvashnina, Kristina O. Shuh, David K. TI Probing Chemical Bonding in Uranium Dioxide by Means of High- Resolution X-ray Absorption Spectroscopy SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID CORE-LEVEL SPECTROSCOPY; DENSITY-FUNCTIONAL THEORY; ELECTRONIC-STRUCTURE; CRYSTAL-FIELD; 5F STATES; SCATTERING; EXCITATIONS; SYSTEMS; METALS; OXIDES AB A systematic X-ray absorption study at the U 3d, 4d, and 4f edges of UO2 was performed, and the data were analyzed within framework of the Anderson impurity model. By applying the high-energy-resolution fluorescence-detection (HERFD) mode of X-ray absorption spectroscopy (XAS) at the U 3d(3/2) edge and conducting the XAS measurements at the shallower U 4f levels, fine details of the XAS spectra were resolved resulting from reduced core-hole lifetime broadening. This multiedge study enabled a far more effective analysis of the electronic structure at the U sites and characterization of the chemical bonding and degree of the 5f localization in UO2. The results support the covalent character of UO2 and do not agree with the suggestions of rather ionic bonding in this compound as expressed in some publications. C1 [Butorin, Sergei M.; Modin, Anders; Vegelius, Johan R.] Uppsala Univ, Dept Phys & Astron, POB 516, SE-75120 Uppsala, Sweden. [Kvashnina, Kristina O.] European Synchrotron, CS40220, F-38043 Grenoble 9, France. [Shuh, David K.] Lawrence Berkeley Natl Lab, Div Chem Sci, MS 70A1150,One Cyclotron Rd, Berkeley, CA 94720 USA. [Kvashnina, Kristina O.] HZDR, Inst Resource Ecol, POB 510119, D-01314 Dresden, Germany. RP Butorin, SM (reprint author), Uppsala Univ, Dept Phys & Astron, POB 516, SE-75120 Uppsala, Sweden. EM sergei.butorin@physics.uu.se FU Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences Heavy Element Chemistry program of the U.S. Department of Energy at Lawrence Berkeley National Laboratory [DE-AC02-05CH11231]; Office of Science, Basic Energy Sciences of the U.S. Department of Energy at Lawrence Berkeley National Laboratory [DE-AC02-05CH11231] FX This research was supported by the Director, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences Heavy Element Chemistry program (D.K.S), and the Advanced Light Source is supported by the Director, Office of Science, Basic Energy Sciences; both of the U.S. Department of Energy at Lawrence Berkeley National Laboratory under Contract DE-AC02-05CH11231. NR 43 TC 0 Z9 0 U1 5 U2 5 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 29 PY 2016 VL 120 IS 51 BP 29397 EP 29404 DI 10.1021/acs.jpcc.6b09335 PG 8 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG6MK UT WOS:000391160400052 ER PT J AU Cole, JM Lin, TC Ashcroft, CM Perez-Moreno, J Tan, YZ Venkatesan, P Higginbotham, AP Pattison, P Edwards, AJ Piltz, RO Clays, K Ilangovan, A AF Cole, Jacqueline M. Lin, Tze-Chia Ashcroft, Christopher M. Perez-Moreno, Javier Tan, Yizhou Venkatesan, Perumal Higginbotham, Andrew P. Pattison, Philip Edwards, Alison J. Piltz, Ross O. Clays, Koen Ilangovan, Andivelu TI Relating the Structure of Geminal Amido Esters to their Molecular Hyperpolarizability SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID NONLINEAR-OPTICAL PROPERTIES; 2ND-HARMONIC GENERATION; NEUTRON-DIFFRACTION; CHROMOPHORES; AGGREGATION; PERFORMANCE; DERIVATIVES; DENSITY AB Advanced organic nonlinear optical (NLO) materials have attracted increasing attention due to their multitude of applications in modern telecommunication devices. Arguably the most important advantage of organic NLO materials, relative to traditionally used inorganic NLO materials, is their short optical response time. Geminal amido esters with their donor-pi-acceptor (D-pi-A) architecture exhibit high levels of electron delocalization and substantial intramolecular charge transfer, which should endow these materials with short optical response times and large molecular (hyper)polarizabilities. In order to test this hypothesis, the linear and second-order nonlinear optical properties of five geminal amido esters, (E)-ethyl 3-(X-phenylamino)-2-(Y-phenylcarbamoyl)acrylate (1, X = 4-H, Y = 4-H; 2, X = 4-CH3, Y = 4-CH3; 3, X = 4-NO2, Y = 2,5OCH(3); 4, X = 2-Cl, Y = 2-Cl; 5, X = 4-Cl, Y = 4-Cl) were synthesized and characterized, whereby NLO structurefunction relationships were established including intramolecular charge transfer characteristics, crystal field effects, and molecular first hyperpolarizabilities (beta). Given the typically large errors (1030%) associated with the determination of beta coefficients, three independent methods were used: (i) density functional theory, (ii) hyper-Rayleigh scattering, and (iii) high-resolution X-ray diffraction data analysis based on multipolar modeling of electron densities at each atom. These three methods delivered consistent values of beta, and based on these results, 3 should hold the most promise for NLO applications. The correlation between the molecular structure of these geminal amido esters and their linear and nonlinear optical properties thus provide molecular design guidelines for organic NLO materials; this leads to the ultimate goal of generating bespoke organic molecules to suit a given NLO device application. C1 [Cole, Jacqueline M.; Lin, Tze-Chia; Ashcroft, Christopher M.; Tan, Yizhou; Higginbotham, Andrew P.] Univ Cambridge, Dept Phys, Cavendish Lab, JJ Thomson Ave, Cambridge CB3 0HE, England. [Cole, Jacqueline M.] Rutherford Appleton Lab, ISIS Neutron & Muon Source, Harwell Sci & Innovat Campus, Didcot OX11 0QX, Oxon, England. [Cole, Jacqueline M.] Univ Cambridge, Dept Chem Engn & Biotechnol, West Cambridge Site,Philippa Fawcett Dr, Cambridge CB3 0AS, England. [Cole, Jacqueline M.] Argonne Natl Lab, 9700 South Cass Ave, Argonne, IL 60439 USA. [Perez-Moreno, Javier; Clays, Koen] Univ Leuven, Dept Chem, Celestijnenlaan 200D, B-3001 Leuven, Belgium. [Perez-Moreno, Javier] Skidmore Coll, Dept Phys, 815 North Broadway, Saratoga Springs, NY 12866 USA. [Venkatesan, Perumal; Ilangovan, Andivelu] Bharathidasan Univ, Sch Chem, Tiruchchirappalli 620024, Tamil Nadu, India. [Pattison, Philip] Swiss Norwegian Beamlines, European Synchrotron Radiat Facil, F-38000 Grenoble, France. [Edwards, Alison J.; Piltz, Ross O.] Australian Ctr Neutron Scattering, Australian Nucl Sci & Technol Org, New Illawarra Rd, Lucas Heights, NSW 2234, Australia. RP Cole, JM (reprint author), Univ Cambridge, Dept Phys, Cavendish Lab, JJ Thomson Ave, Cambridge CB3 0HE, England.; Cole, JM (reprint author), Rutherford Appleton Lab, ISIS Neutron & Muon Source, Harwell Sci & Innovat Campus, Didcot OX11 0QX, Oxon, England.; Cole, JM (reprint author), Univ Cambridge, Dept Chem Engn & Biotechnol, West Cambridge Site,Philippa Fawcett Dr, Cambridge CB3 0AS, England.; Cole, JM (reprint author), Argonne Natl Lab, 9700 South Cass Ave, Argonne, IL 60439 USA. EM jmc61@cam.ac.uk RI Cole, Jacqueline/C-5991-2008; Venkatesan, Perumal/F-7996-2012 OI Venkatesan, Perumal/0000-0001-9197-1248 FU DOE Office of Science, Office of Basic Energy Sciences [DE-AC02-06CH11357]; Taiwanese Government; EPSRC UK [EP/J500380/1, EP/L504920/1]; Cavendish-NUDT Scholarship; OPAL reactor, ANSTO, Australia [1236]; Skidmore College FX J.M.C. thanks the 1851 Royal Commission of the Great Exhibition for a Design Fellowship, hosted by Argonne National Laboratory where work done was supported by the DOE Office of Science, Office of Basic Energy Sciences, under Contract No. DE-AC02-06CH11357. T.-C.L acknowledges the Taiwanese Government for a Studying Abroad Scholarship. C.M.A is indebted to the EPSRC UK for a DTA Ph.D. studentship (Grants EP/J500380/1 and EP/L504920/1). Y.T. is grateful for a Cavendish-NUDT Scholarship. The Swiss Norwegian Collaborative Research Group at the ESRF, Grenoble, France, is thanked for access to synchrotron facilities. The OPAL reactor, ANSTO, Australia, is acknowledged for access to neutron scattering facilities via a program proposal, ID 1236. J.P-M. is grateful to Skidmore College for supporting this work via a full-year sabbatical with enhancement. All authors thank the EPSRC UK National Service for Computational Chemistry Software (NSCCS) and acknowledge contributions from its staff in supporting this work. NR 43 TC 0 Z9 0 U1 8 U2 8 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 29 PY 2016 VL 120 IS 51 BP 29439 EP 29448 DI 10.1021/acs.jpcc.6b10724 PG 10 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG6MK UT WOS:000391160400057 ER PT J AU Gruenke, NL McAnally, MO Schatz, GC Van Duyne, RP AF Gruenke, Natalie L. McAnally, Michael O. Schatz, George C. Van Duyne, Richard P. TI Balancing the Effects of Extinction and Enhancement for Optimal Signal in Surface-Enhanced Femtosecond Stimulated Raman Spectroscopy SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID NANOSTRUCTURES; NANOPARTICLES; LIGHT AB The field of ultrafast surface-enhanced Raman spectroscopy (SERS) is rapidly expanding; however, few applications for these new techniques have been demonstrated. One obstacle for the widespread application of ultrafast SERS is the addition of highly enhancing and scattering plasmonic substrates to already complex nonlinear spectroscopies. The competition between extinction and enhancement in ultrafast SERS techniques complicates the optimization of a number of experimental parameters. Here we study the concentration and path length dependences of signal quality in surface-enhanced femtosecond stimulated Raman spectroscopy (SE-FSRS). We find that in contrast to previous studies of spontaneous SERS which use signal magnitudes to define optimal experimental parameters, signal-to-noise ratios (SNRs) are the best measure of ideal experimental parameters in SE-FSRS. We report ideal concentrations and path lengths to use in transmissive geometry SE-FSRS experiments with colloidal nanoparticle substrates. Our results indicate that despite competing effects from SERS and FSRS mechanisms, similarly performed SE-FSRS and SERS experiments yield maximum SNRs using the same concentration and path length due to the overwhelming effects of extinction. By understanding how to optimize SE-FSRS experimental parameters, ultrafast SERS, and SE-FSRS in particular, can be more readily applied to future plasmonically enhanced spectroscopic studies. C1 [Gruenke, Natalie L.; McAnally, Michael O.; Schatz, George C.; Van Duyne, Richard P.] Northwestern Univ, Dept Chem, 2145 Sheridan Rd, Evanston, IL 60208 USA. [Gruenke, Natalie L.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Gruenke, Natalie L.] Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Biol Div, Berkeley, CA 94720 USA. RP Van Duyne, RP (reprint author), Northwestern Univ, Dept Chem, 2145 Sheridan Rd, Evanston, IL 60208 USA. EM vanduyne@northwestern.edu OI McAnally, Michael/0000-0002-8681-2952; Schatz, George/0000-0001-5837-4740 FU NSF Center for Chemistry at the Space-Time Limit (CaSTL) [CHE-1414466]; National Science Foundation Graduate Fellowship Research Program [DGE-0824162]; NSF [CHE-1506683] FX This research was made possible through the NSF Center for Chemistry at the Space-Time Limit (CaSTL), through Grant CHE-1414466. N.L.G. and M.O.M. acknowledge support from the National Science Foundation Graduate Fellowship Research Program under Grant DGE-0824162, while N.L.G., M.O.M., and R.P.V.D. acknowledge funding from NSF CHE-1506683. NR 23 TC 0 Z9 0 U1 8 U2 8 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 29 PY 2016 VL 120 IS 51 BP 29449 EP 29454 DI 10.1021/acs.jpcc.6b10727 PG 6 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG6MK UT WOS:000391160400058 ER PT J AU Bae, YJ Gibson, NA Ding, TNX Alivisatos, AP Leone, SR AF Bae, Youn Jue Gibson, Natalie A. Ding, Tina X. Alivisatos, A. Paul Leone, Stephen R. TI Understanding the Bias Introduced in Quantum Dot Blinking Using Change Point Analysis SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID CORE-SHELL NANOCRYSTALS; SEMICONDUCTOR NANOCRYSTALS; FLUORESCENCE BLINKING; EMISSION; TRANSITIONS; BEHAVIOR AB The fluorescence intermittency of single CdSe/CdS quantum dots (QDs) with different shell sizes is studied using the conventional bin and threshold method and the statistically more rigorous method, change point analysis (CPA). The on-state truncation time (tau(c)) is a critical value used to interpret the dynamics of charge trapping in single QDs; however, changing the bin size and threshold in blink traces significantly modifies tau(c). Herein, we use the CPA method to minimize the bias that binning and thresholding introduces and find that a widely used assumption that there is only one on and one off state is questionable. We observe that 12 out of 17 QDs exhibit more than two intensity levels and find that the 2, values of individual levels differ from the values obtained when the levels are combined, i.e., when one assumes there is only one on and one off state as in the conventional bin and threshold method. For instance, one QD has tau(c) values of 0.5 (0.1) and 2.0 (0.2) s from two different intensity levels, whereas when the levels are combined into only one on state, tau(c) is found to be 7 (1) s. The CPA method is found to be more suitable for studying multilevel emission in QDs than the conventional bin and threshold method. C1 [Bae, Youn Jue; Gibson, Natalie A.; Ding, Tina X.; Alivisatos, A. Paul; Leone, Stephen R.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Leone, Stephen R.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Ding, Tina X.; Alivisatos, A. Paul] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Gibson, Natalie A.; Leone, Stephen R.] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Alivisatos, A. Paul] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Ding, Tina X.; Alivisatos, A. Paul] Kavli Energy NanoSci Inst, Berkeley, CA 94720 USA. [Bae, Youn Jue] Northwestern Univ, Dept Chem, Evanston, IL 60208 USA. RP Leone, SR (reprint author), Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA.; Leone, SR (reprint author), Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA.; Leone, SR (reprint author), Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. EM srl@berkeley.edu RI Alivisatos , Paul /N-8863-2015 OI Alivisatos , Paul /0000-0001-6895-9048 FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division within the PChem program [DE-AC02-05CH11231, KC3103]; National Science Foundation [NSF-CHE-1361226]; Air Force Office of Scientific Research [AFOSR-FA9550-14-1-0154]; ARO-MURI [1-W911NF-14-1-0383]; National Science Foundation Graduate Research Fellowship [DGE 1106400] FX This work was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division under Award # DE-AC02-05CH11231 within the PChem program (KC3103). Y.B. acknowledges support provided by the National Science Foundation under Grant NSF-CHE-1361226, the Air Force Office of Scientific Research (AFOSR-FA9550-14-1-0154), and ARO-MURI#1-W911NF-14-1-0383. T.X.D. acknowledges the National Science Foundation Graduate Research Fellowship under Grant DGE 1106400. NR 25 TC 0 Z9 0 U1 6 U2 6 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 29 PY 2016 VL 120 IS 51 BP 29484 EP 29490 DI 10.1021/acs.jpcc.6b09780 PG 7 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG6MK UT WOS:000391160400062 ER PT J AU Zhang, Y Nelson, R Siddiqui, E Tam, KM Yu, U Berlijn, T Ku, W Vidhyadhiraja, NS Moreno, J Jarrell, M AF Zhang, Yi Nelson, R. Siddiqui, Elisha Tam, K. -M. Yu, U. Berlijn, T. Ku, W. Vidhyadhiraja, N. S. Moreno, J. Jarrell, M. TI Generalized multiband typical medium dynamical cluster approximation: Application to (Ga, Mn)N SO PHYSICAL REVIEW B LA English DT Article ID DILUTE MAGNETIC SEMICONDUCTORS; MOLECULAR-BEAM-EPITAXY; PHASE-CHANGE MATERIALS; CURIE-TEMPERATURE; BINARY-ALLOYS; FERROMAGNETISM; GAN; LOCALIZATION; COHERENT; GAMNN AB We generalize the multiband typical medium dynamical cluster approximation and the formalism introduced by Blackman, Esterling, and Berk so that it can deal with localization in multiband disordered systems with both diagonal and off-diagonal disorder with complicated potentials. We also introduce an ansatz for the momentum-resolved typical density of states that greatly improves the numerical stability of the method while preserving the independence of scattering events at different frequencies. Starting from the first-principles effective Hamiltonian, we apply this method to the diluted magnetic semiconductor Ga1-x MnxN, and find the impurity band is completely localized for Mn concentrations x < 0.03, while for 0.03 < x < 0.10 the impurity band has delocalized states but the chemical potential resides at or above the mobility edge. So, the system is always insulating within the experimental compositional limit ( x approximate to 0.10) due to Anderson localization. However, for 0.03 < x < 0.10 hole doping could make the system metallic, allowing double-exchange mediated, or enhanced, ferromagnetism. The developed method is expected to have a large impact on first-principles studies of Anderson localization. C1 [Zhang, Yi; Siddiqui, Elisha; Tam, K. -M.; Moreno, J.; Jarrell, M.] Louisiana State Univ, Dept Phys & Astron, Baton Rouge, LA 70803 USA. [Zhang, Yi; Tam, K. -M.; Moreno, J.; Jarrell, M.] Louisiana State Univ, Ctr Computat & Technol, Baton Rouge, LA 70803 USA. [Nelson, R.] Rhein Westfal TH Aachen, Inst Inorgan Chem, Landoltweg 1, D-52056 Aachen, Germany. [Yu, U.] GIST, Dept Phys & Photon Sci, Gwangju 61005, South Korea. [Berlijn, T.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Berlijn, T.] Oak Ridge Natl Lab, Comp Sci & Math Div, Oak Ridge, TN 37831 USA. [Ku, W.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Vidhyadhiraja, N. S.] Jawaharlal Nehru Ctr Adv Sci Res, Theoret Sci Unit, Bangalore 560064, Karnataka, India. RP Zhang, Y (reprint author), Louisiana State Univ, Dept Phys & Astron, Baton Rouge, LA 70803 USA.; Zhang, Y (reprint author), Louisiana State Univ, Ctr Computat & Technol, Baton Rouge, LA 70803 USA. EM zhangyiphys@gmail.com FU National Science Foundation [EPS-1003897]; Louisiana Board of Regents; U.S. Department of Energy [DE-AC05-00OR22725]; DOE [DEAC02-98CH10886] FX We thank D. Young for useful discussion on the results. This material is based upon work supported by the National Science Foundation under the Cooperative Agreement No. EPS-1003897 with additional support from the Louisiana Board of Regents. Work by T.B. was performed at the Center for Nanophase Materials Sciences, a DOE Office of Science user facility. This paper has been authored by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. W.K. was supported by DOE Contract No. DEAC02-98CH10886. This work used the high-performance computational resources provided by the Louisiana Optical Network Initiative (http://www.loni.org), and HPC@LSU computing. NR 51 TC 1 Z9 1 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 29 PY 2016 VL 94 IS 22 AR 224208 DI 10.1103/PhysRevB.94.224208 PG 9 WC Physics, Condensed Matter SC Physics GA EG4JG UT WOS:000391009300001 ER PT J AU Lunderberg, E Gade, A Bader, V Baugher, T Bazin, D Berryman, JS Brown, BA Hartley, DJ Recchia, F Stroberg, SR Weisshaar, D Wimmer, K AF Lunderberg, E. Gade, A. Bader, V. Baugher, T. Bazin, D. Berryman, J. S. Brown, B. A. Hartley, D. J. Recchia, F. Stroberg, S. R. Weisshaar, D. Wimmer, K. TI In-beam gamma-ray spectroscopy of S38-42 SO PHYSICAL REVIEW C LA English DT Article ID COULOMB-EXCITATION; SHELL NUCLEI; REGION; LEVEL AB The low-energy excitation level schemes of the neutron-rich S38-42 isotopes are investigated via in-beam gamma-ray spectroscopy following the fragmentation of Ca-48 and Ar-46 projectiles on a C-12 target at intermediate beam energies. Information on gamma gamma coincidences complemented by comparisons to shell-model calculations were used to construct level schemes for these neutron-rich nuclei. The experimental data are discussed in the context of large-scale shell-model calculations with the SDPF-MU effective interaction in the sd-pf shell. For the even-mass S isotopes, the evolution of the yrast sequence is explored as well as a peculiar change in decay pattern of the second 2(+) states at N = 26. For the odd-mass S-41, a level scheme is presented that seems complete below 2.2 MeV and consistent with the predictions by the SDPF-MU shell-model Hamiltonian; this is a remarkable benchmark given the rapid shell and shape evolution at play in the S isotopes as the broken-down N = 28 magic number is approached. Furthermore, the population of excited final states in projectile fragmentation is discussed. C1 [Lunderberg, E.; Gade, A.; Bader, V.; Baugher, T.; Bazin, D.; Berryman, J. S.; Brown, B. A.; Recchia, F.; Stroberg, S. R.; Weisshaar, D.; Wimmer, K.] Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA. [Lunderberg, E.; Gade, A.; Bader, V.; Baugher, T.; Brown, B. A.; Stroberg, S. R.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Hartley, D. J.] US Naval Acad, Dept Phys, Annapolis, MD 21402 USA. [Wimmer, K.] Cent Michigan Univ, Dept Phys, Mt Pleasant, MI 48859 USA. [Baugher, T.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Recchia, F.] Univ Padua, Dipartimento Fis & Astron Galileo Galilei, I-35131 Padua, Italy. [Recchia, F.] INFN Padova, I-35131 Padua, Italy. [Stroberg, S. R.] TRIUMF, Vancouver, BC V6T 2A3, Canada. [Wimmer, K.] Univ Tokyo, Dept Phys, Bunkyo Ku, Tokyo 1130033, Japan. RP Lunderberg, E (reprint author), Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA.; Lunderberg, E (reprint author), Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. RI Gade, Alexandra/A-6850-2008 OI Gade, Alexandra/0000-0001-8825-0976 FU National Science Foundation (NSF) [PHY-1102511]; US Department of Energy (DOE), Office of Nuclear Physics [DE-FG02-08ER41556]; DOE, National Nuclear Security Administration [DE-NA0000979]; DOE, Office of Science; NSF [PHY-1102511, PHY-1404442]; DOE [DE-AC02-05CH11231] FX This work was supported in part by the National Science Foundation (NSF) under Contract No. PHY-1102511, by the US Department of Energy (DOE), Office of Nuclear Physics, under Grant No. DE-FG02-08ER41556, and by the DOE, National Nuclear Security Administration, under Award No. DE-NA0000979. GRETINA was funded by the DOE, Office of Science. Operation of the array at NSCL was supported by the NSF under Cooperative Agreement No. PHY-1102511 (NSCL) and DOE under Grant No. DE-AC02-05CH11231 (LBNL). B.A.B. acknowledges support from NSF Grant No. PHY-1404442. Figures 4, 7, 10, 14, 18 were created using the SciDraw scientific figure preparation system [42]. NR 40 TC 0 Z9 0 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 29 PY 2016 VL 94 IS 6 AR 064327 DI 10.1103/PhysRevC.94.064327 PG 14 WC Physics, Nuclear SC Physics GA EG4LN UT WOS:000391015800001 ER PT J AU Foucart, F O'Connor, E Roberts, L Kidder, LE Pfeiffer, HP Scheel, MA AF Foucart, Francois O'Connor, Evan Roberts, Luke Kidder, Lawrence E. Pfeiffer, Harald P. Scheel, Mark A. TI Impact of an improved neutrino energy estimate on outflows in neutron star merger simulations SO PHYSICAL REVIEW D LA English DT Article ID GAMMA-RAY BURSTS; COMPACT BINARY MERGERS; BLACK-HOLE MERGERS; EQUATION-OF-STATE; R-PROCESS; DYNAMICAL EJECTA; NUMERICAL RELATIVITY; GRAVITATIONAL-WAVES; GENERAL-RELATIVITY; RADIATIVE-TRANSFER AB Binary neutron star mergers are promising sources of gravitational waves for ground-based detectors such as Advanced LIGO. Neutron-rich material ejected by these mergers may also be the main source of r-process elements in the Universe, while radioactive decays in the ejecta can power bright electromagnetic postmerger signals. Neutrino-matter interactions play a critical role in the evolution of the composition of the ejected material, which significantly impacts the outcome of nucleosynthesis and the properties of the associated electromagnetic signal. In this work, we present a simulation of a binary neutron star merger using an improved method for estimating the average neutrino energies in our energy-integrated neutrino transport scheme. These energy estimates are obtained by evolving the neutrino number density in addition to the neutrino energy and flux densities. We show that significant changes are observed in the composition of the polar ejecta when comparing our new results with earlier simulations in which the neutrino spectrum was assumed to be the same everywhere in optically thin regions. In particular, we find that material ejected in the polar regions is less neutron rich than previously estimated. Our new estimates of the composition of the polar ejecta make it more likely that the color and time scale of the electromagnetic signal depend on the orientation of the binary with respect to an observer's line of sight. These results also indicate that important observable properties of neutron star mergers are sensitive to the neutrino energy spectrum, and may need to be studied through simulations including a more accurate, energy-dependent neutrino transport scheme. C1 [Foucart, Francois] Lawrence Berkeley Natl Lab, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [O'Connor, Evan] North Carolina State Univ, Dept Phys, Raleigh, NC 27695 USA. [Roberts, Luke; Scheel, Mark A.] CALTECH, Walter Burke Inst Theoret Phys, TAPIR, MC 350-17, Pasadena, CA 91125 USA. [Kidder, Lawrence E.] Cornell Univ, Ctr Radiophys & Space Res, Ithaca, NY 14853 USA. [Pfeiffer, Harald P.] Univ Toronto, Canadian Inst Theoret Astrophys, Toronto, ON M5S 3H8, Canada. RP Foucart, F (reprint author), Lawrence Berkeley Natl Lab, 1 Cyclotron Rd, Berkeley, CA 94720 USA. FU National Aeronautics and Space Administration (NASA) through Einstein Postdoctoral Fellowship [PF4-150122, PF3-140114]; Chandra X-ray Center; NASA [NAS8-03060, NAS 5-26555]; Hubble Fellowship by Space Telescope Science Institute [51344.001]; Natural Sciences and Engineering Research Council of Canada (NSERC); National Science Foundation (NSF) at Cornell [PHY-1306125, AST-1333129]; NSF [PHY-1404569, AST-1333520, NSF-1440083, PHY-0960291, ACI-1053575]; NSF CAREER Grant [PHY-1151197]; Sherman Fairchild Foundation; Canada Foundation for Innovation (CFI); NanoQuebec; Reseau de medecine genetique appliquee (RMGA); Fonds de recherche du Quebec-Nature et Technologie (FRQ-NT) FX The authors thank Matthew Duez, Dan Hemberger, and the members of the SxS Collaboration for their input and support during this project; Dan Kasen and Rodrigo Fernandez for regular discussions on binary mergers and outflows; and Brett Deaton for his comments on an earlier version of this manuscript. Support for this work was provided by National Aeronautics and Space Administration (NASA) through Einstein Postdoctoral Fellowship Grants No. PF4-150122 (F. F.) and No. PF3-140114 (L. R.) awarded by the Chandra X-ray Center, which is operated by the Smithsonian Astrophysical Observatory for NASA under Contract No. NAS8-03060; and through Hubble Fellowship Grant No. 51344.001 awarded by the Space Telescope Science Institute, which is operated by the Association of Universities for Research in Astronomy, Inc., for NASA, under Contract No. NAS 5-26555. The authors at the Canadian Institute for Theoretical Astrophysics (CITA) gratefully acknowledge support from the Natural Sciences and Engineering Research Council of Canada (NSERC). L. K. acknowledges support from National Science Foundation (NSF) Grants No. PHY-1306125 and No. AST-1333129 at Cornell, while the authors at Caltech acknowledge support from NSF Grants No. PHY-1404569, No. AST-1333520, No. NSF-1440083, and NSF CAREER Grant No. PHY-1151197. Authors at both Cornell and Caltech also thank the Sherman Fairchild Foundation for their support. Computations were performed on the supercomputer Briaree from the Universite de Montreal, and Guillimin from McGill University, both managed by Calcul Quebec and Compute Canada. The operation of these supercomputers is funded by the Canada Foundation for Innovation (CFI), NanoQuebec, Reseau de medecine genetique appliquee (RMGA) and the Fonds de recherche du Quebec-Nature et Technologie (FRQ-NT). Computations were also performed on the Zwicky cluster at Caltech, supported by the Sherman Fairchild Foundation and by NSF Grant No. PHY-0960291. This work also used the Extreme Science and Engineering Discovery Environment (XSEDE) through allocation No. TGPHY990007N, supported by NSF Grant No. ACI-1053575. NR 79 TC 2 Z9 2 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 29 PY 2016 VL 94 IS 12 AR 123016 DI 10.1103/PhysRevD.94.123016 PG 20 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EG4MB UT WOS:000391017300001 ER PT J AU Voylov, DN Griffin, PJ Mercado, B Keum, JK Nakanishi, M Novikov, VN Sokolov, AP AF Voylov, D. N. Griffin, P. J. Mercado, B. Keum, J. K. Nakanishi, M. Novikov, V. N. Sokolov, A. P. TI Correlation between temperature variations of static and dynamic properties in glass-forming liquids SO PHYSICAL REVIEW E LA English DT Article ID MEDIUM-RANGE ORDER; NEUTRON-DIFFRACTION; STRUCTURAL EVOLUTION; MOLECULAR-WEIGHT; AMORPHOUS ORDER; NETWORK GLASS; TRANSITION; SCATTERING; FRAGILITY; DEPENDENCE AB Detailed analysis of the static structure factor S(Q) in several glass-forming liquids reveals that the temperature variations of the width of the main diffraction peak Delta Q(T) correlate with the fragility of these liquids. This observation suggests a direct connection between rather subtle structural changes and sharp slowing down of structural relaxation in glass-forming liquids. We show that this observation can be rationalized using the Adam-Gibbs approach, through a connection between temperature variations of structural correlation length, l(c) similar to 2 pi/Delta Q, and the size of cooperatively rearranging regions. C1 [Voylov, D. N.; Novikov, V. N.; Sokolov, A. P.] Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. [Griffin, P. J.] Univ Penn, Dept Mat Sci & Engn, 3231 Walnut St, Philadelphia, PA 19104 USA. [Mercado, B.] Yale Univ, Dept Chem, 225 Prospect St, New Haven, CT 06511 USA. [Keum, J. K.] Oak Ridge Natl Lab, Spallat Neutron Source, Oak Ridge, TN 37831 USA. [Nakanishi, M.] Fukuoka Inst Technol, Dept Elect Engn, Fukuoka 8110295, Japan. [Sokolov, A. P.] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. RP Voylov, DN (reprint author), Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. RI Keum, Jong/N-4412-2015; OI Keum, Jong/0000-0002-5529-1373; Voylov, Dmitry/0000-0001-5552-6024; Nakanishi, Masahiro/0000-0003-0844-8363 FU NSF (USA) [DMR-1408811] FX The UTK team acknowledges support from the NSF (USA), DMR-1408811. NR 46 TC 0 Z9 0 U1 8 U2 8 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0045 EI 2470-0053 J9 PHYS REV E JI Phys. Rev. E PD DEC 29 PY 2016 VL 94 IS 6 AR 060603 DI 10.1103/PhysRevE.94.060603 PG 6 WC Physics, Fluids & Plasmas; Physics, Mathematical SC Physics GA EG4ON UT WOS:000391023700002 PM 28085393 ER PT J AU Chan, MK Tang, Y Dorow, CJ Jeong, J Mangin-Thro, L Veit, MJ Ge, Y Abernathy, DL Sidis, Y Bourges, P Greven, M AF Chan, M. K. Tang, Y. Dorow, C. J. Jeong, J. Mangin-Thro, L. Veit, M. J. Ge, Y. Abernathy, D. L. Sidis, Y. Bourges, P. Greven, M. TI Hourglass Dispersion and Resonance of Magnetic Excitations in the Superconducting State of the Single-Layer Cuprate HgBa2CuO4+delta Near Optimal Doping SO PHYSICAL REVIEW LETTERS LA English DT Article ID HIGH-TEMPERATURE SUPERCONDUCTORS; COPPER-OXIDE SUPERCONDUCTORS; T-C SUPERCONDUCTORS; NEUTRON-SCATTERING; PSEUDOGAP STATE; UNCONVENTIONAL SUPERCONDUCTORS; PHASE; ORDER; SUSCEPTIBILITY; YBA2CU3O6+X AB We use neutron scattering to study magnetic excitations near the antiferromagnetic wave vector in the underdoped single-layer cuprate HgBa2CuO4+delta (superconducting transition temperature T-c approximate to 88 K, pseudogap temperature T* approximate to 220 K). The response is distinctly enhanced below T* and exhibits a Y-shaped dispersion in the pseudogap state, whereas the superconducting state features an X-shaped (hourglass) dispersion and a further resonancelike enhancement. A large spin gap of about 40 meV is observed in both states. This phenomenology is reminiscent of that exhibited by bilayer cuprates. The resonance spectral weight, irrespective of doping and compound, scales linearly with the putative binding energy of a spin exciton described by an itinerant-spin formalism. C1 [Chan, M. K.; Tang, Y.; Dorow, C. J.; Veit, M. J.; Ge, Y.; Greven, M.] Univ Minnesota, Sch Phys & Astron, Minneapolis, MN 55455 USA. [Chan, M. K.] Los Alamos Natl Lab, Natl High Magnet Field Lab, Pulsed Field Facil, Los Alamos, NM 87545 USA. [Jeong, J.; Mangin-Thro, L.; Sidis, Y.; Bourges, P.] CEA Saclay, CEA, CNRS, Lab Leon Brillouin, F-91191 Gif Sur Yvette, France. [Abernathy, D. L.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. RP Chan, MK (reprint author), Univ Minnesota, Sch Phys & Astron, Minneapolis, MN 55455 USA.; Chan, MK (reprint author), Los Alamos Natl Lab, Natl High Magnet Field Lab, Pulsed Field Facil, Los Alamos, NM 87545 USA. EM mkchan@lanl.gov; greven@umn.edu RI Abernathy, Douglas/A-3038-2012; OI Abernathy, Douglas/0000-0002-3533-003X; Chan, Mun/0000-0002-8808-9040 FU Department of Energy through the University of Minnesota Center for Quantum Materials [DE-FG02-06ER46275, DE-SC-0006858, LANLF100]; UNESCOS [ANR-14-CE05-0007]; NirvAna of the ANR [ANR-14-OHRI-0010]; Scientific User Facilities Division, Office of Basic Energy Sciences, US Department of Energy FX We thank Andrey Chubukov, Yuan Li and Guichuan Yu for comments on the manuscript. This work was funded by the Department of Energy through the University of Minnesota Center for Quantum Materials, under DE-FG02-06ER46275 and DE-SC-0006858, and through Award No. LANLF100. LLB is supported by UNESCOS (Contract No. ANR-14-CE05-0007) and NirvAna (Contract No. ANR-14-OHRI-0010) of the ANR. ORNL's SNS is sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, US Department of Energy. NR 54 TC 2 Z9 2 U1 9 U2 9 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 29 PY 2016 VL 117 IS 27 AR 277002 DI 10.1103/PhysRevLett.117.277002 PG 6 WC Physics, Multidisciplinary SC Physics GA EG4SO UT WOS:000391034200013 PM 28084762 ER PT J AU Leefer, N Gerhardus, A Budker, D Flambaum, VV Stadnik, YV AF Leefer, N. Gerhardus, A. Budker, D. Flambaum, V. V. Stadnik, Y. V. TI Search for the Effect of Massive Bodies on Atomic Spectra and Constraints on Yukawa-Type Interactions of Scalar Particles SO PHYSICAL REVIEW LETTERS LA English DT Article ID SPACE-TIME VARIATION; EQUIVALENCE; CONSTANTS; ENERGY; CLOCK; LEVEL AB We propose a new method to search for hypothetical scalar particles that have feeble interactions with standard-model particles. In the presence of massive bodies, these interactions produce a nonzero Yukawa-type scalar-field magnitude. Using radio-frequency spectroscopy data of atomic dysprosium, as well as atomic clock spectroscopy data, we constrain the Yukawa-type interactions of a scalar field with the photon, electron, and nucleons for a range of scalar-particle masses corresponding to length scales > 10 cm. In the limit as the scalar-particle mass m(phi) -> 0, our derived limits on the Yukawa-type interaction parameters are Lambda(gamma) greater than or similar to 8 x 10(19) GeV, Lambda(e) greater than or similar to 1.3 x 10(19) GeV, and Lambda(N) greater than or similar to 6 x 10(20) GeV. Our measurements also constrain combinations of interaction parameters, which cannot otherwise be probed with traditional anomalous-force measurements. We suggest further measurements to improve on the current level of sensitivity. C1 [Leefer, N.; Budker, D.; Flambaum, V. V.] Johannes Gutenberg Univ Mainz, Helmholtz Inst Mainz, D-55128 Mainz, Germany. [Gerhardus, A.] Univ Bonn, Inst Phys, Bethe Ctr Theoret Phys, D-53115 Bonn, Germany. [Budker, D.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Budker, D.] Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA 94720 USA. [Flambaum, V. V.; Stadnik, Y. V.] Univ New South Wales, Sch Phys, Sydney, NSW 2052, Australia. RP Leefer, N (reprint author), Johannes Gutenberg Univ Mainz, Helmholtz Inst Mainz, D-55128 Mainz, Germany. FU Australian Research Council (ARC); DFG Reinhart Koselleck project; ERC (Dark-OST Advanced Project); Marie Curie International Incoming Fellowship within the 7th European Community Framework Programme FX This work is supported by the Australian Research Council (ARC), the DFG Reinhart Koselleck project, and the ERC (Dark-OST Advanced Project). N. L. was supported by a Marie Curie International Incoming Fellowship within the 7th European Community Framework Programme. The authors acknowledge the kind patience and many helpful discussions with Peter Graham and Michael Hohensee in the initial stages of this work. N. L. acknowledges Holger Muller for asking the qualifying exam question that ultimately inspired this work. NR 57 TC 0 Z9 0 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 29 PY 2016 VL 117 IS 27 AR 271601 DI 10.1103/PhysRevLett.117.271601 PG 7 WC Physics, Multidisciplinary SC Physics GA EG4SO UT WOS:000391034200004 PM 28084774 ER PT J AU Chen, K Hu, Q Liu, TH Zhao, LC Luo, DY Wu, J Zhang, YF Zhang, W Liu, F Russell, TP Zhu, R Gong, QH AF Chen, Ke Hu, Qin Liu, Tanghao Zhao, Lichen Luo, Deying Wu, Jiang Zhang, Yifei Zhang, Wei Liu, Feng Russell, Thomas P. Zhu, Rui Gong, Qihuang TI Charge-Carrier Balance for Highly Efficient Inverted Planar Heterojunction Perovskite Solar Cells SO ADVANCED MATERIALS LA English DT Article ID POWER CONVERSION EFFICIENCY; TRANSPORT; CH3NH3PBI3; LENGTHS; CRYSTALLIZATION; HYSTERESIS; LAYERS AB The charge-carrier balance strategy by interface engineering is employed to optimize the charge-carrier transport in inverted planar heterojunction perovskite solar cells. N, N-Dimethylformamide-treated poly(3,4-ethylenedioxythiophene): poly(styrenesulfonate) and poly(methyl-methacrylate)-modified PCBM are utilized as the hole and electron selective contacts, respectively, leading to a high power conversion efficiency of 18.72%. C1 [Chen, Ke; Hu, Qin; Liu, Tanghao; Zhao, Lichen; Luo, Deying; Wu, Jiang; Zhang, Yifei; Zhu, Rui; Gong, Qihuang] Peking Univ, Dept Phys, State Key Lab Artificial Microstruct & Mesoscop P, Beijing 100871, Peoples R China. [Hu, Qin; Zhu, Rui; Gong, Qihuang] Collaborat Innovat Ctr Quantum Matter, Beijing 100871, Peoples R China. [Hu, Qin; Liu, Feng; Russell, Thomas P.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Zhang, Wei] Lincoln Univ, Joseph Banks Labs, Sch Chem, Beevor St, Lincoln LN6 7DL, England. [Liu, Feng] Shanghai Jiao Tong Univ, Dept Phys, Shanghai 200240, Peoples R China. [Russell, Thomas P.] Univ Massachusetts, Dept Polymer Sci & Engn, Amherst, MA 01002 USA. [Zhu, Rui; Gong, Qihuang] Shanxi Univ, Collaborat Innovat Ctr Extreme Opt, Taiyuan 030006, Shanxi, Peoples R China. RP Zhu, R (reprint author), Peking Univ, Dept Phys, State Key Lab Artificial Microstruct & Mesoscop P, Beijing 100871, Peoples R China.; Zhu, R (reprint author), Collaborat Innovat Ctr Quantum Matter, Beijing 100871, Peoples R China.; Zhu, R (reprint author), Shanxi Univ, Collaborat Innovat Ctr Extreme Opt, Taiyuan 030006, Shanxi, Peoples R China. EM iamzhurui@pku.edu.cn RI Hu, Qin/N-3493-2014; Zhu, Rui/E-7572-2010; Zhu, Rui/F-5244-2011; Liu, Feng/J-4361-2014; OI Hu, Qin/0000-0003-3089-1070; Zhu, Rui/0000-0001-7631-3589; Zhu, Rui/0000-0001-7631-3589; Liu, Feng/0000-0002-5572-8512; ZHANG, WEI/0000-0002-2678-8372 FU 973 Program of China [2015CB932203]; National Natural Science Foundation of China [61377025, 91433203]; Young 1000 Talents Global Recruitment Program of China; U.S. Office of Naval Research [N00014-15-1-2244]; Advanced Light Source Doctoral Fellowship in Residence at the Lawrence Berkeley National Laboratory; Supergen Supersolar project; U.S. Department of Energy (DOE), Office of Science, and Office of Basic Energy Sciences; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX K.C., Q.H., and T.L. contributed equally to this work. This work was financially supported by the 973 Program of China (2015CB932203), the National Natural Science Foundation of China (61377025 and 91433203), and the Young 1000 Talents Global Recruitment Program of China. F.L. and T.P.R. were supported by the U.S. Office of Naval Research under contract N00014-15-1-2244. Q.H. also received support from the Advanced Light Source Doctoral Fellowship in Residence at the Lawrence Berkeley National Laboratory. W.Z. thanks the Supergen Supersolar project for support. GIWAXS were performed at beamline 7.3.3 at Advanced Light Source, Lawrence Berkeley National Laboratory, which was supported by the U.S. Department of Energy (DOE), Office of Science, and Office of Basic Energy Sciences. Work at the Molecular Foundry (Lawrence Berkeley National Laboratory) was supported by the Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. NR 41 TC 1 Z9 1 U1 26 U2 26 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0935-9648 EI 1521-4095 J9 ADV MATER JI Adv. Mater. PD DEC 28 PY 2016 VL 28 IS 48 BP 10718 EP + DI 10.1002/adma.201604048 PG 8 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EI8BB UT WOS:000392728200016 PM 27748987 ER PT J AU Saremi, S Xu, RJ Dedon, LR Mundy, JA Hsu, SL Chen, ZH Damodaran, AR Chapman, SP Evans, JT Martin, LW AF Saremi, Sahar Xu, Ruijuan Dedon, Liv R. Mundy, Julia A. Hsu, Shang-Lin Chen, Zuhuang Damodaran, Anoop R. Chapman, Scott P. Evans, Joseph T. Martin, Lane W. TI Enhanced Electrical Resistivity and Properties via Ion Bombardment of Ferroelectric Thin Films SO ADVANCED MATERIALS LA English DT Article ID LEVEL TRANSIENT SPECTROSCOPY; PULSED-LASER DEPOSITION; DEFECT STRUCTURE; CONDUCTIVITY; CERAMICS; STRAIN; GROWTH; IMPLANTATION; ORIENTATION; TEMPERATURE AB A novel approach to on-demand improvement of electronic properties in complex-oxide ferroelectrics is demonstrated whereby ion bombardment - commonly used in classic semiconductor materials is applied to the PbTiO3 system. The result is deterministic reduction in leakage currents by 5 orders of magnitude, improved ferroelectric switching, and unprecedented insights into the nature of defects and intergap state evolution in these materials. C1 [Saremi, Sahar; Xu, Ruijuan; Dedon, Liv R.; Mundy, Julia A.; Hsu, Shang-Lin; Chen, Zuhuang; Damodaran, Anoop R.; Martin, Lane W.] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Mundy, Julia A.; Hsu, Shang-Lin; Chen, Zuhuang; Martin, Lane W.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Chapman, Scott P.; Evans, Joseph T.] Radiant Technologies Inc, 2835 Pan Amer Fwy,Ste B-C, Albuquerque, NM 87107 USA. RP Martin, LW (reprint author), Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA.; Martin, LW (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. EM lwmartin@berkeley.edu RI Chen, Zuhuang/E-7131-2011 OI Chen, Zuhuang/0000-0003-1912-6490 FU National Science Foundation [CMMI-1434147, DMR-1451219, OISE-1545907]; U.S. Department of Energy, Office of Basic Sciences [DE-SC0012375]; Air Force Office of Scientific Research [FA9550-12-1-0471]; Laboratory Directed Research and Development Program of Lawrence Berkeley National Laboratory under U.S. Department of Energy [DE-AC02-05CH11231]; Army Research Office [W911NF-14-1-0104]; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX S.S. acknowledges support from the National Science Foundation under grant CMMI-1434147. R.X. acknowledges support from the National Science Foundation under grant DMR-1451219. L.R.D. acknowledges support from the U.S. Department of Energy, Office of Basic Sciences under grant no. DE-SC0012375 for chemical analysis of the films. Z.C. acknowledges support from the Air Force Office of Scientific Research under grant FA9550-12-1-0471 and from the Laboratory Directed Research and Development Program of Lawrence Berkeley National Laboratory under U.S. Department of Energy Contract No. DE-AC02-05CH11231 for the development of advanced synthesis methods. A.R.D. acknowledges support from the Army Research Office under grant W911NF-14-1-0104. L.W.M. acknowledges support from the National Science Foundation under grant OISE-1545907. Work at the Molecular Foundry and the National Center for Electron Microscopy was supported by the Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. NR 46 TC 0 Z9 0 U1 14 U2 14 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0935-9648 EI 1521-4095 J9 ADV MATER JI Adv. Mater. PD DEC 28 PY 2016 VL 28 IS 48 BP 10750 EP + DI 10.1002/adma.201603968 PG 8 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EI8BB UT WOS:000392728200021 PM 27723127 ER PT J AU Doleans, M AF Doleans, Marc TI Ignition and monitoring technique for plasma processing of multicell superconducting radio-frequency cavities SO JOURNAL OF APPLIED PHYSICS LA English DT Article AB An in-situ plasma processing technique has been developed at the Spallation Neutron Source (SNS) to improve the performance of the superconducting radio-frequency (SRF) cavities in operation. The technique uses a low-density reactive neon-oxygen plasma at room-temperature to improve the surface work function, to help remove adsorbed gases on the RF surface, and to reduce its secondary emission yield. SNS SRF cavities have six accelerating cells and the plasma typically ignites in the cell where the electric field is the highest. This article details the technique to ignite and monitor the plasma in each cell of the SNS cavities. Published by AIP Publishing. C1 [Doleans, Marc] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA. RP Doleans, M (reprint author), Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA. EM doleansmm@ornl.gov OI doleans, marc/0000-0003-4542-8724 FU U.S. Department of Energy [DE-AC05-00OR22725] FX Many thanks to my colleagues from the superconducting linac systems and accelerator physics groups at the SNS for useful discussions and suggestions during the redaction of this manuscript. This manuscript has been authored by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. NR 7 TC 0 Z9 0 U1 2 U2 2 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-8979 EI 1089-7550 J9 J APPL PHYS JI J. Appl. Phys. PD DEC 28 PY 2016 VL 120 IS 24 AR 243301 DI 10.1063/1.4972838 PG 11 WC Physics, Applied SC Physics GA EI0OO UT WOS:000392174000004 ER PT J AU Jackson, K Jellinek, J AF Jackson, Koblar Jellinek, Julius TI Si clusters are more metallic than bulk Si SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID SIZED SILICON CLUSTERS; DENSITY-FUNCTIONAL THEORY; INTERMEDIATE-SIZE; SEMICONDUCTOR CLUSTERS; POLARIZABILITIES; APPROXIMATION; OPTIMIZATION; TRANSITION; STABILITY; EVOLUTION AB Dipole polarizabilities were computed using density functional theory for silicon clusters over a broad range of sizes up to N = 147 atoms. The calculated total effective polarizabilities, which include contributions from permanent dipole moments of the clusters, are in very good agreement with recently measured values. We show that the permanent dipole contributions are most important for clusters in the intermediate size range and that the measured polarizabilities can be used to distinguish between energetically nearly degenerate cluster isomers at these sizes. We decompose the computed total polarizabilities alpha into the so-called dipole and charge transfer contributions, alpha(p) and alpha(q), using a site-specific analysis. When the per-atom values of these quantities are plotted against N-1/3, clear linear trends emerge that can be extrapolated to the large size limit (N-1/3 -> 0), resulting in a value for alpha/N of 30.5 bohrs(3)/atom that is significantly larger than the per-atom polarizability of semiconducting bulk Si, 25.04 bohrs(3)/atom. This indicates that Si clusters possess a higher degree of metallicity than bulk Si, a conclusion that is consistent with the strong electrostatic screening of the cluster interiors made evident by the analysis of the calculated atomic polarizabilities. Published by AIP Publishing. C1 [Jackson, Koblar] Cent Michigan Univ, Dept Phys, Mt Pleasant, MI 48859 USA. [Jackson, Koblar] Cent Michigan Univ, Sci Adv Mat Program, Mt Pleasant, MI 48859 USA. [Jellinek, Julius] Argonne Natl Lab, Chem Sci & Engn Div, Argonne, IL 60439 USA. RP Jackson, K (reprint author), Cent Michigan Univ, Dept Phys, Mt Pleasant, MI 48859 USA.; Jackson, K (reprint author), Cent Michigan Univ, Sci Adv Mat Program, Mt Pleasant, MI 48859 USA.; Jellinek, J (reprint author), Argonne Natl Lab, Chem Sci & Engn Div, Argonne, IL 60439 USA. EM jacks1ka@cmich.edu; jellinek@anl.gov OI Jackson, Koblar/0000-0002-5342-7978 FU U.S. Department of Energy [DE-SC0001330]; Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences, U.S. Department of Energy [DE-AC02-06CH11357] FX The authors are grateful to Professor X.-C. Zeng for providing cluster coordinates and to D. Gotz and Professor Dr. R. Schafer for discussions of their experimental data. K.A.J. was supported by the U.S. Department of Energy, Grant No. DE-SC0001330. J.J. was supported by the Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences, U.S. Department of Energy under Contract No. DE-AC02-06CH11357. NR 45 TC 0 Z9 0 U1 4 U2 4 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 28 PY 2016 VL 145 IS 24 AR 244302 DI 10.1063/1.4972813 PG 7 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EI0OW UT WOS:000392174800019 PM 28010068 ER PT J AU Fu, SF Zhu, CZ Song, JH Engelhard, MH Xia, HB Du, D Lin, YH AF Fu, Shaofang Zhu, Chengzhou Song, Junhua Engelhard, Mark H. Xia, Haibing Du, Dan Lin, Yuehe TI Kinetically Controlled Synthesis of Pt-Based One-Dimensional Hierarchically Porous Nanostructures with Large Mesopores as Highly Efficient ORR Catalysts SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE porous nanostructures; one-dimensional nanomaterials; kinetically controlled synthesis; Pt alloys; oxygen reduction reaction ID OXYGEN REDUCTION REACTION; ENHANCED ELECTROCATALYTIC ACTIVITY; ELECTROCHEMICAL SYNTHESIS; PLATINUM NANOPARTICLES; FACILE SYNTHESIS; FUEL-CELLS; PD; PERFORMANCE; NANOWIRES; FILMS AB Rational design and construction of Pt-based porous nanostructures with large mesopores have triggered significant considerations because of their high surface area and more efficient mass transport. Hydrochloric acid-induced kinetically controlled reduction of metal precursors in the presence of soft template F-127 and hard template tellurium nanowires has been successfully demonstrated to construct one-dimensional hierarchical porous PtCu alloy nanostructures with large mesopores. Moreover, the electrochemical experiments demonstrated that the PtCu hierarchically porous nanostructures synthesized under optimized conditions exhibit enhanced electrocatalytic performance for oxygen reduction reaction in acid media. C1 [Fu, Shaofang; Zhu, Chengzhou; Song, Junhua; Du, Dan; Lin, Yuehe] Washington State Univ, Sch Mech & Mat Engn, Pullman, WA 99164 USA. [Engelhard, Mark H.; Lin, Yuehe] Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA 99354 USA. [Xia, Haibing] Shandong Univ, State Key Lab Crystal Mat, Jinan 250100, Peoples R China. RP Zhu, CZ; Lin, YH (reprint author), Washington State Univ, Sch Mech & Mat Engn, Pullman, WA 99164 USA.; Lin, YH (reprint author), Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA 99354 USA. EM chengzhou.zhu@wsu.edu; yuehe.lin@wsu.edu RI Xia, Haibing/A-8711-2008; FU, SHAOFANG/D-2328-2016 OI Xia, Haibing/0000-0003-2262-7958; FU, SHAOFANG/0000-0002-7871-6573 FU Washington State University, USA; Department of Energy's Office of Biological and Environmental Research; Pacific Northwest National Laboratory FX This work was supported by a start-up fund of Washington State University, USA. The XPS analysis was performed using EMSL, a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory. We thank Franceschi Microscopy & Image Center at Washington State University for TEM and SEM measurements. NR 43 TC 0 Z9 0 U1 29 U2 29 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 28 PY 2016 VL 8 IS 51 BP 35213 EP 35218 DI 10.1021/acsami.6b11537 PG 6 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG5KC UT WOS:000391081700029 PM 27977120 ER PT J AU Raja, SN Bekenstein, Y Koc, MA Fischer, S Zhang, D Lin, L Ritchie, RO Yang, P Alivisatos, AP AF Raja, Shilpa N. Bekenstein, Yehonadav Koc, Matthew A. Fischer, Stefan Zhang, Dandan Lin, Liwei Ritchie, Robert O. Yang, Peidong Alivisatos, A. Paul TI Encapsulation of Perovskite Nanocrystals into Macroscale Polymer Matrices: Enhanced Stability and Polarization SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE perovskite quantum dot nanocrystals; hydrophobic polymer; nanocomposite polarization; light and water stability; photon budget; nanowires and nanoplates ID CESIUM LEAD HALIDE; LIGHT-EMITTING-DIODES; WIDE COLOR GAMUT; QUANTUM DOTS; SOLAR-CELLS; TETRAPOD NANOCRYSTALS; SOLID-STATE; EMISSION; NANOCOMPOSITES; CSPBX3 AB Lead halide perovskites hold promise for photonic devices, due to their superior optoelectronic properties. However, their use is limited by poor stability and toxicity. We demonstrate enhanced water and light stability of high-surface-area colloidal perovskite nanocrystals by encapsulation of colloidal CsPbBr3 quantum dots into matched hydrophobic macroscale polymeric matrices. This is achieved by mixing the quantum dots with presynthesized high molecular-weight polymers. We monitor the photoluminescence quantum yield of the perovskite-polymer nanocomposite films under water-soaking for the first time, finding no change even after >4 months of continuous immersion in water. Furthermore, photo stability is greatly enhanced in the macroscale polymer-encapsulated nanocrystal perovskites, which sustain >10(10) absorption events per quantum dot prior to photodegradation, a significant threshold for potential device use. Control of the quantum dot shape in these thin-film polymer composite enables color tunability via strong quantum-confinement in nanoplates and significant room temperature polarized emission from perovskite nanowires. Not only does the high-molecular-weight polymer protect the perovskites from the environment but also no escaped lead was detected in water that was in contact with the encapsulated perovskites for months. Our ligand-passivated perovskite-macroscale polymer composites provide a robust platform for diverse photonic applications. C1 [Raja, Shilpa N.; Ritchie, Robert O.; Yang, Peidong; Alivisatos, A. Paul] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Bekenstein, Yehonadav; Koc, Matthew A.; Fischer, Stefan; Zhang, Dandan; Yang, Peidong; Alivisatos, A. Paul] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Lin, Liwei; Ritchie, Robert O.] Univ Calif Berkeley, Dept Mech Engn, Berkeley, CA 94720 USA. [Raja, Shilpa N.; Bekenstein, Yehonadav; Koc, Matthew A.; Fischer, Stefan; Zhang, Dandan; Ritchie, Robert O.; Yang, Peidong; Alivisatos, A. Paul] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Bekenstein, Yehonadav; Yang, Peidong; Alivisatos, A. Paul] Kavli Energy NanoSci Inst, Berkeley, CA 94720 USA. RP Alivisatos, AP (reprint author), Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA.; Alivisatos, AP (reprint author), Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA.; Alivisatos, AP (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA.; Alivisatos, AP (reprint author), Kavli Energy NanoSci Inst, Berkeley, CA 94720 USA. EM paul.alivisatos@berkeley.edu RI Ritchie, Robert/A-8066-2008; Alivisatos , Paul /N-8863-2015 OI Ritchie, Robert/0000-0002-0501-6998; Alivisatos , Paul /0000-0001-6895-9048 FU Physical Chemistry of Inorganic Nanostructures Program [KC3103]; Inorganic/Organic Nanocomposites Nanoscale Science, Engineering, and Technology Program; Office of Basic Energy Sciences of the U.S. Department of Energy [DE-AC02-05CH11231]; Suzhou Industrial Park; German Research Foundation (DFG) [FI 2042/1-1]; National Science Foundation NSF [ECCS-0901864] FX This work is supported by the Physical Chemistry of Inorganic Nanostructures Program, KC3103 (for Y.B., P.Y., and A.P.A) and by the Inorganic/Organic Nanocomposites Nanoscale Science, Engineering, and Technology Program (for S.N.R, M.A.K., and R.O.R), Office of Basic Energy Sciences of the U.S. Department of Energy, under contract number DE-AC02-05CH11231 for both programs. D.Z. is grateful for fellowship support from Suzhou Industrial Park. S.F. acknowledges scholarship support from the German Research Foundation (DFG, agreement FI 2042/1-1). L.L. was supported by National Science Foundation NSF Grant ECCS-0901864 for mechanical characterization support. We thank Noah Bronstein, Steven Hawks, Wojciech Osowiecki, and Matthew Jones for helpful discussions and Elena Kreimer, Nicholas J. Borys, Andrew Wong, Natalie Gibson, Samuel Eaton, Zeke Liu, Brent Koscher, and Joseph Swabeck for experimental assistance. NR 55 TC 0 Z9 0 U1 60 U2 60 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 28 PY 2016 VL 8 IS 51 BP 35523 EP 35533 DI 10.1021/acsami.6b09443 PG 11 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG5KC UT WOS:000391081700064 PM 27991752 ER PT J AU Krishnan, NMA Wang, B Falzone, G Le Pape, Y Neithalath, N Pilon, L Bauchy, M Sant, G AF Krishnan, N. M. Anoop Wang, Bu Falzone, Gabriel Le Pape, Yann Neithalath, Narayanan Pilon, Laurent Bauchy, Mathieu Sant, Gaurav TI Confined Water in Layered Silicates: The Origin of Anomalous Thermal Expansion Behavior in Calcium-Silicate-Hydrates SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE silicates; thermal expansion; atomistic simulation; topology; confinement ID C-S-H; NANOCONFINED WATER; PORTLAND-CEMENT; MODEL; MECHANISMS; TOPOLOGY; CONCRETE; PASTE; GLASS AB Water, under conditions of nanoscale confinement, exhibits anomalous dynamics, and enhanced thermal deformations, which may be further enhanced when such water is in contact with hydrophilic surfaces. Such heightened thermal deformations of water could control the volume stability of hydrated materials containing nanoconfined structural water. Understanding and predicting the thermal deformation coefficient (TDC, often referred to as the CTE, coefficient of thermal expansion), which represents volume changes induced in materials under conditions of changing temperature, is of critical importance for hydrated solids including: hydrogels, biological tissues, and calcium silicate hydrates, as changes in their volume can result in stress development, and cracking. By pioneering atomistic examine the physical origin of thermal expansion in calcium-silicate-hydrates (C-S-H), the binding agent in formed by the reaction of cement with water. We report that the TDC of C-S-H shows a sudden increase when the CaO/SiO2 (molar ratio; abbreviated as Ca/Si) exceeds 1.5. This anomalous behavior arises from a notable increase in the confinement of water contained in the C-S-H's nanostructure. We identify that confinement is dictated by the topology of the C-S-H's atomic network. Taken together, the results suggest that thermal deformations of hydrated silicates can be altered by inducing compositional changes, which in turn alter the atomic topology and the resultant volume stability of the solids. C1 [Krishnan, N. M. Anoop; Wang, Bu; Falzone, Gabriel; Sant, Gaurav] Univ Calif Los Angeles, Dept Civil & Environm Engn, Lab Chem Construct Mat LC2, Los Angeles, CA 90095 USA. [Krishnan, N. M. Anoop; Wang, Bu; Bauchy, Mathieu] Univ Calif Los Angeles, Dept Civil & Environm Engn, Lab Phys Amorphous & Inorgan Solids PARISlab, Los Angeles, CA 90095 USA. [Le Pape, Yann] Oak Ridge Natl Lab, POB 2008, Oak Ridge, TN 37831 USA. [Neithalath, Narayanan] Arizona State Univ, Sch Sustainable Engn & Built Environm, Tempe, AZ 85281 USA. [Pilon, Laurent] Univ Calif Los Angeles, Dept Mech & Aerosp Engn, Los Angeles, CA 90095 USA. [Sant, Gaurav] Univ Calif Los Angeles, Calif Nanosyst Inst CNSI, Los Angeles, CA 90095 USA. RP Sant, G (reprint author), Univ Calif Los Angeles, Dept Civil & Environm Engn, Lab Chem Construct Mat LC2, Los Angeles, CA 90095 USA.; Bauchy, M (reprint author), Univ Calif Los Angeles, Dept Civil & Environm Engn, Lab Phys Amorphous & Inorgan Solids PARISlab, Los Angeles, CA 90095 USA.; Sant, G (reprint author), Univ Calif Los Angeles, Calif Nanosyst Inst CNSI, Los Angeles, CA 90095 USA. EM mbauchy@uda.edu; gsant@ucla.edu FU Infravation ERA-NET Plus Grant [31109806.0001]; U.S. Department of Transportation via the Federal Highway Administration [DTFH61-13-H-00011]; U.S. National Science Foundation [1253269, CMMI 1562066]; California Energy Commission [PIR 12-032]; Oak Ridge National Laboratory in the form of Laboratory Directed Research and Development (LDRD) support; U.S. Department of Energy [DE-AC05-00OR22725] FX The authors acknowledge financial support for this research provisioned by: Infravation ERA-NET Plus Grant (31109806.0001), the U.S. Department of Transportation via the Federal Highway Administration (DTFH61-13-H-00011), U.S. National Science Foundation (CAREER 1253269 and CMMI 1562066), California Energy Commission (Contract PIR 12-032) and Oak Ridge National Laboratory in the form of Laboratory Directed Research and Development (LDRD) support. The contents of this paper reflect the views and opinions of the authors, who are responsible for the accuracy of the datasets presented herein, and do not reflect the views and/or policies of the funding agencies, nor do the contents constitute a specification, a standard or regulation. This research was conducted in the Laboratory for the Chemistry of Construction Materials (LC2) and the Laboratory for the Physics of Amorphous and Inorganic Solids (PARISlab) at UCLA. As such, the authors gratefully acknowledge the support that has made these laboratories and their operations possible. This manuscript has been coauthored by ORNL, managed by UT-Battelle LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. The publisher, by accepting the article for publication, acknowledges that the U.S. Government retains a nonexclusive, paid-up, irrevocable, worldwide license to publish or reproduce the published form of this manuscript, or allow others to do so, for U.S. Government purposes. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan (http://energy.gov/downloads/doe-public-access-plan). NR 51 TC 0 Z9 0 U1 7 U2 7 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 28 PY 2016 VL 8 IS 51 BP 35621 EP 35627 DI 10.1021/acsami.6b11587 PG 7 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG5KC UT WOS:000391081700074 PM 27977137 ER PT J AU Bhattacharya, P Ramasamy, US Krueger, S Robinson, JW Tarasevich, BJ Martini, A Cosimbescu, L AF Bhattacharya, Priyanka Ramasamy, Uma Shantini Krueger, Susan Robinson, Joshua W. Tarasevich, Barbara J. Martini, Ashlie Cosimbescu, Lelia TI Trends in Thermoresponsive Behavior of Lipophilic Polymers SO INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH LA English DT Article ID ANGLE NEUTRON-SCATTERING; TEMPERATURE-DEPENDENCE; LIGHT-SCATTERING; INTRINSIC-VISCOSITY; MOLECULAR-WEIGHT AB In an effort to find correlations between size changes with temperature of lipophilic polymers in solution and viscosity index trends, the determination of the size of thermoresponsive polymers of various architectures (linear, comb-like, star, and hyperbranched) using two experimental techniques under infinite dilution conditions (0.5% w/w) - dynamic light scattering and small angle neutron scattering, and predictive molecular dynamics simulations is described herein. Viscosity index is an important parameter for lubricants and other rheological applications. The aim of this work was to predict polymer behavior as viscosity index improvers (VIIs) using tools which require minimal amounts of material, as opposed to measuring kinematic viscosities, which require multigram quantities. There were no significant correlations between changes in polymer size with temperature and viscosity index (VI). The polymers with the highest VI (polyalkyl methacrylate - PAMA and Star PAMA) had polar backbones in contrast to the nonpolar backbones of the and hyperbranched (OCP and HBPE, respectively), so the disparity in solubility of the backbone and solvent medium appears to correlate with the observed VIs. It was concluded that none of the aforementioned techniques can entirely predict the polymer behavior as VIIs, at least in the temperature range studied (40-100 degrees C). C1 [Bhattacharya, Priyanka; Robinson, Joshua W.; Tarasevich, Barbara J.; Cosimbescu, Lelia] Pacific Northwest Natl Lab, Energy & Environm Directorate, 902 Battelle Blvd, Richland, WA 99354 USA. [Ramasamy, Uma Shantini; Martini, Ashlie] Univ Calif Merced, Sch Engn, Merced, CA 95343 USA. [Krueger, Susan] NIST, Ctr Neutron Res, 100 Bur Dr,Stop 8562, Gaithersburg, MD 20899 USA. [Bhattacharya, Priyanka] Univ Dayton, Res Inst, Energy Technol & Mat Div, 300 Coll Pk, Dayton, OH 45469 USA. [Robinson, Joshua W.] Agr Int Serv, USDA, 4700 River Rd, Riverdale, MD 20737 USA. RP Cosimbescu, L (reprint author), Pacific Northwest Natl Lab, Energy & Environm Directorate, 902 Battelle Blvd, Richland, WA 99354 USA. EM lelia.cosimbescu@pnnl.gov FU Linus Pauling Distinguished Postdoctoral Fellowship at PNNL; National Science Foundation [DMR-0944772, ACI-1053575]; U.S. Department of Energy's (DOE) Office of Vehicle Technology [27029]; DOE [DEAC05-76RL01830]; American Chemical Society Petroleum Research Fund [55026-ND6] FX P.B. is grateful for support from a Linus Pauling Distinguished Postdoctoral Fellowship at PNNL. This work utilized facilities supported in part by the National Science Foundation under Agreements DMR-0944772. U.S.R. and A.M. were supported by the U.S. Department of Energy's (DOE) Office of Vehicle Technology (under Contract No. 27029) of the PNNL AOP project. PNNL is a multiprogram national laboratory operated by Battelle for DOE under Contract DEAC05-76RL01830. U.S.R. and A.M. also acknowledge the American Chemical Society Petroleum Research Fund (# 55026-ND6) for partial support of this research. The computational aspects of this work used the Extreme Science and Engineering Discovery Environment (XSEDE), which was supported by National Science Foundation Grant No. ACI-1053575. The authors cordially acknowledge helpful discussions with Sona Slocum on similar work performed at Lubrizol. We thank Afton Chemical for generously donating base oils for screening purposes and both Lubrizol and Evonik for donating benchmark polymers (OCP and PAMA). NR 32 TC 0 Z9 0 U1 1 U2 1 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0888-5885 J9 IND ENG CHEM RES JI Ind. Eng. Chem. Res. PD DEC 28 PY 2016 VL 55 IS 51 BP 12983 EP 12990 DI 10.1021/acs.iecr.6b03812 PG 8 WC Engineering, Chemical SC Engineering GA EG5KG UT WOS:000391082100002 ER PT J AU Baldwin, AG Bridges, NJ Braley, JC AF Baldwin, Anna G. Bridges, Nicholas J. Braley, Jenifer C. TI Distribution of Fission Products into Tributyl Phosphate under Applied Nuclear Fuel Recycling Conditions SO INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH LA English DT Article ID NORMAL-BUTYL PHOSPHATE; EXTRACTING SOLVENT; INORGANIC NITRATES; ZIRCONIUM NITRATE; 3RD PHASE; TBP; CHEMISTRY; SYSTEM; DILUENT; THORIUM AB Tributyl phosphate (TBP) is an important industrial extractant used in the Plutonium Uranium Redox Extraction (PUREX) process for recovering uranium and plutonium from used nuclear fuel. Distribution data have been assessed for a variety of fission and corrosion product trace metals at varying uranium concentrations under representative PUREX extraction (3 M HNO3) and stripping (0.1 M HNO3) conditions. As might have been anticipated, the extraction of most trace metals was found to decrease or remain constant with increasing uranium concentration. In contrast, the extraction of some low valence transition metals was found to increase with increasing uranium concentration. The increase in extraction of low valence transition metals may be related to TBP forming reverse micelles instead of recovering uranium as a classical UO2(NO3)(2)(TBP)(2) coordination complex. The low valence transition metals may be being recovered into the cores of the reverse micelles. Also unanticipated was the lack of impact the TBP degradation product, dibutyl phosphate (DBP), had on the recovery of metals in batch distribution studies. This is possibly related to the batch contacts completed in these experiments not adequately recreating the multistage aspects of industrial-scale uranium extraction done using mixer settlers or centrifugal contactors. C1 [Baldwin, Anna G.; Braley, Jenifer C.] Colorado Sch Mines, Golden, CO 80401 USA. [Bridges, Nicholas J.] Savannah River Natl Lab, Aiken, SC 29808 USA. RP Braley, JC (reprint author), Colorado Sch Mines, Golden, CO 80401 USA. EM jbraley@mines.edu OI Baldwin, Anna/0000-0001-5114-4870; Braley, Jenifer/0000-0001-9702-1534 FU U.S. Department of Homeland Security [2012-DN-130-NF0001] FX This invited contribution is part of the I&EC Research special issue for the 2017 Class of Influential Researchers. This material is based upon work supported by the U.S. Department of Homeland Security under Grant Award Number, 2012-DN-130-NF0001. The views and conclusions contained in this document are those of the authors and should not be interpreted as representing the official policies, either expressed or implied, of the U.S. Department of Homeland Security. NR 39 TC 0 Z9 0 U1 8 U2 8 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0888-5885 J9 IND ENG CHEM RES JI Ind. Eng. Chem. Res. PD DEC 28 PY 2016 VL 55 IS 51 BP 13114 EP 13119 DI 10.1021/acs.iecr.6b04056 PG 6 WC Engineering, Chemical SC Engineering GA EG5KG UT WOS:000391082100014 ER PT J AU Li, GQ Zhang, D Qiao, Q Yu, YF Peterson, D Zafar, A Kumar, R Curtarolo, S Hunte, F Shannon, S Zhu, YM Yang, WT Cao, LY AF Li, Guoqing Zhang, Du Qiao, Qiao Yu, Yifei Peterson, David Zafar, Abdullah Kumar, Raj Curtarolo, Stefano Hunte, Frank Shannon, Steve Zhu, Yimei Yang, Weitao Cao, Linyou TI All The Catalytic Active Sites of MoS2 for Hydrogen Evolution SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID LAYER MOS2; EDGE SITES; MOLYBDENUM-DISULFIDE; SULFUR VACANCIES; MONOLAYER MOS2; MONO LAYER; NANOSHEETS; FILMS; EFFICIENT; MOLECULES AB MoS2 presents a promising low-cost catalyst for the hydrogen evolution reaction (HER), but the understanding about its active sites has remained limited. Here we present an unambiguous study of the catalytic activities of all possible reaction sites of MoS2, including edge sites, sulfur vacancies, and grain boundaries. We demonstrate that, in addition to the well-known catalytically active edge sites, sulfur vacancies provide another major active site for the HER, while the catalytic activity of grain boundaries is much weaker. The intrinsic turnover frequencies (Tafel slopes) of the edge sites, sulfur vacancies, and grain boundaries are estimated to be 7.5 s(-1) (65-75 mV/dec), 3.2 s(-1) (65-85 mV/dec), and 0.1 s(-1) (120-160 mV/dec), respectively. We also demonstrate that the catalytic activity of sulfur vacancies strongly depends on the density of the vacancies and the local crystalline structure in proximity to the vacancies. Unlike edge sites, whose catalytic activity linearly depends on the length, sulfur vacancies show optimal catalytic activities when the vacancy density is in the range of 7-10%, and the number of sulfur vacancies in high crystalline quality MoS2 is higher than that in low crystalline quality MoS2, which may be related with the proximity of different local crystalline structures to the vacancies. C1 [Li, Guoqing; Yu, Yifei; Kumar, Raj; Hunte, Frank; Cao, Linyou] North Carolina State Univ, Dept Mat Sci & Engn, Raleigh, NC 27695 USA. [Li, Guoqing] North Carolina State Univ, Coll Text, Raleigh, NC 27695 USA. [Peterson, David; Zafar, Abdullah; Shannon, Steve] North Carolina State Univ, Dept Nucl Engn, Raleigh, NC 27695 USA. [Cao, Linyou] North Carolina State Univ, Dept Phys, Raleigh, NC 27695 USA. [Zhang, Du; Yang, Weitao] Duke Univ, Dept Chem, Durham, NC 27708 USA. [Curtarolo, Stefano] Duke Univ, Dept Mech Engn & Mat Sci, Durham, NC 27708 USA. [Qiao, Qiao; Zhu, Yimei] Brookhaven Natl Lab, Dept Condensed Matter Phys & Mat Sci, Upton, NY 11973 USA. RP Cao, LY (reprint author), North Carolina State Univ, Dept Mat Sci & Engn, Raleigh, NC 27695 USA.; Cao, LY (reprint author), North Carolina State Univ, Dept Phys, Raleigh, NC 27695 USA. EM lcao2@ncsu.edu OI Qiao, Qiao/0000-0002-0229-4407; Kumar, Raj/0000-0003-4001-0011 FU CCDM, EFRC - U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences (BES) [DE-SC0012575]; DOE, Office of Science, BES, Materials Sciences and Engineering Division [DE-SC0012704]; NSF/DOE [NSF PHY1338917]; State of North Carolina; National Science Foundation FX This work was supported by CCDM, an EFRC funded by U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences (BES), under award #DE-SC0012575 (the majority of the experiments, data analysis, and manuscript writing). Y.Z. acknowledges the support by DOE, Office of Science, BES, Materials Sciences and Engineering Division, under contract #DE-SC0012704 (part of the STEM characterization and data analysis). S.S. acknowledges the support of a NSF/DOE partnership in basic plasma science under grant NSF PHY1338917 (the plasma treatment). The authors also acknowledge the use of the Analytical Instrumentation Facility (AIF) at North Carolina State University, which is supported by the State of North Carolina and the National Science Foundation. NR 42 TC 0 Z9 0 U1 51 U2 51 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 28 PY 2016 VL 138 IS 51 BP 16632 EP 16638 DI 10.1021/jacs.6b05940 PG 7 WC Chemistry, Multidisciplinary SC Chemistry GA EG5KD UT WOS:000391081800015 PM 27977198 ER PT J AU Bosak, T Schubotz, F de Santiago-Torio, A Kuehl, JV Carlson, HK Watson, N Daye, M Summons, RE Arkin, AP Deutschbauer, AM AF Bosak, Tanja Schubotz, Florence de Santiago-Torio, Ana Kuehl, Jennifer V. Carlson, Hans K. Watson, Nicki Daye, Mirna Summons, Roger E. Arkin, Adam P. Deutschbauer, Adam M. TI System-Wide Adaptations of Desulfovibrio alaskensis G20 to Phosphate-Limited Conditions SO PLOS ONE LA English DT Article ID GLOBAL TRANSCRIPTIONAL ANALYSIS; SULFUR ISOTOPE FRACTIONATION; VULGARIS HILDENBOROUGH; ESCHERICHIA-COLI; BLACK-SEA; SINORHIZOBIUM-MELILOTI; STARVATION RESPONSE; REGULATORY NETWORK; SULFATE REDUCTION; MICROBIAL ECOLOGY AB The prevalence of lipids devoid of phosphorus suggests that the availability of phosphorus limits microbial growth and activity in many anoxic, stratified environments. To better understand the response of anaerobic bacteria to phosphate limitation and starvation, this study combines microscopic and lipid analyses with the measurements of fitness of pooled bar-coded transposon mutants of the model sulfate reducing bacterium Desulfovibrio alaskensis G20. Phosphate-limited G20 has lower growth rates and replaces more than 90% of its membrane phospholipids by a mixture of monoglycosyl diacylglycerol (MGDG), glycuronic acid diacylglycerol (GADG) and ornithine lipids, lacks polyphosphate granules, and synthesizes other cellular inclusions. Analyses of pooled and individual mutants reveal the importance of the high-affinity phosphate transport system (the Pst system), PhoR, and glycolipid and ornithine lipid synthases during phosphate limitation. The phosphate-dependent synthesis of MGDG in G20 and the widespread occurrence of the MGDG/GADG synthase among sulfate reducing partial derivative-Proteobacteria implicate these microbes in the production of abundant MGDG in anaerobic environments where the concentrations of phosphate are lower than 10 mu M. Numerous predicted changes in the composition of the cell envelope and systems involved in transport, maintenance of cytoplasmic redox potential, central metabolism and regulatory pathways also suggest an impact of phosphate limitation on the susceptibility of sulfate reducing bacteria to other anthropogenic or environmental stresses. C1 [Bosak, Tanja; de Santiago-Torio, Ana; Daye, Mirna; Summons, Roger E.] MIT, Dept Earth & Planetary Sci, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Schubotz, Florence] Univ Bremen, Bremen, Germany. [Schubotz, Florence] MARUM, Bremen, Germany. [Kuehl, Jennifer V.; Carlson, Hans K.; Arkin, Adam P.; Deutschbauer, Adam M.] Lawrence Berkeley Natl Lab, Environm Genom & Syst Biol Div, Berkeley, CA USA. [Watson, Nicki] Whitehead Inst, WM Keck Microscopy Facil, Cambridge, MA 02142 USA. [Arkin, Adam P.] Univ Calif Berkeley, Dept Bioengn, Berkeley, CA 94720 USA. RP Bosak, T (reprint author), MIT, Dept Earth & Planetary Sci, 77 Massachusetts Ave, Cambridge, MA 02139 USA. EM tbosak@mit.edu OI Bosak, Tanja/0000-0001-5179-5323 FU Simons Foundation Collaboration on the Origins of Life [327126]; Early Career Investigator in Marine Microbiology and Evolution [344707]; Office of Science, Office of Biological and Environmental Research, of the U.S. Department of Energy [DE-AC02-05CH11231] FX TB received grants from the Simons Foundation Collaboration on the Origins of Life #327126 and Early Career Investigator in Marine Microbiology and Evolution #344707; https:https://www.simonsfoundation.org/life-sciences/simons-collaboratio n-on-the-origins-of-life/simons-investigators/, https://www.simonsfoundation.org/funding/funding-opportunities/life-scie nces/simons-early-career-investigator-in-marine-microbial-ecology-and-ev olution-awards/. RES received a grant from the Simons Foundation Collaboration on the Origins of Life. This work conducted by ENIGMA was supported by the Office of Science, Office of Biological and Environmental Research, of the U.S. Department of Energy under contract no. DE-AC02-05CH11231 (to AMD and APA). NR 85 TC 0 Z9 0 U1 3 U2 3 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 28 PY 2016 VL 11 IS 12 AR e0168719 DI 10.1371/journal.pone.0168719 PG 29 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG7JB UT WOS:000391222000067 PM 28030630 ER PT J AU Li, N Hennelly, SP Stubben, CJ Micheva-Viteva, S Hu, B Shou, YL Vuyisich, M Tung, CS Chain, PS Sanbonmatsu, KY Hong-Geller, E AF Li, Nan Hennelly, Scott P. Stubben, Chris J. Micheva-Viteva, Sofiya Hu, Bin Shou, Yulin Vuyisich, Momchilo Tung, Chang-Shung Chain, Patrick S. Sanbonmatsu, Karissa Y. Hong-Geller, Elizabeth TI Functional and Structural Analysis of a Highly-Expressed Yersinia pestis Small RNA following Infection of Cultured Macrophages SO PLOS ONE LA English DT Article ID 30S RIBOSOMAL-SUBUNIT; III SECRETION SYSTEM; NONCODING RNAS; ESCHERICHIA-COLI; AMINOGLYCOSIDE ANTIBIOTICS; TERTIARY STRUCTURE; IMMUNE-RESPONSE; HFQ; PSEUDOTUBERCULOSIS; ACCURATE AB Non-coding small RNAs (sRNAs) are found in practically all bacterial genomes and play important roles in regulating gene expression to impact bacterial metabolism, growth, and virulence. We performed transcriptomics analysis to identify sRNAs that are differentially expressed in Yersinia pestis that invaded the human macrophage cell line THP-1, compared to pathogens that remained extracellular in the presence of host. Using ultra high-throughput sequencing, we identified 37 novel and 143 previously known sRNAs in Y. pestis. In particular, the sRNA Ysr170 was highly expressed in intracellular Yersinia and exhibited a log2 fold change similar to 3.6 higher levels compared to extracellular bacteria. We found that knock-down of Ysr170 expression attenuated infection efficiency in cell culture and growth rate in response to different stressors. In addition, we applied selective 2'-hydroxyl acylation analyzed by primer extension (SHAPE) analysis to determine the secondary structure of Ysr170 and observed structural changes resulting from interactions with the aminoglycoside antibiotic gentamycin and the RNA chaperone Hfq. Interestingly, gentamicin stabilized helix 4 of Ysr170, which structurally resembles the native gentamicin 16S ribosomal binding site. Finally, we modeled the tertiary structure of Ysr170 binding to gentamycin using RNA motif modeling. Integration of these experimental and structural methods can provide further insight into the design of small molecules that can inhibit function of sRNAs required for pathogen virulence. C1 [Li, Nan; Stubben, Chris J.; Micheva-Viteva, Sofiya; Hu, Bin; Shou, Yulin; Vuyisich, Momchilo; Chain, Patrick S.; Hong-Geller, Elizabeth] Los Alamos Natl Lab, Biosci Div, Los Alamos, NM 87544 USA. [Hennelly, Scott P.; Tung, Chang-Shung; Sanbonmatsu, Karissa Y.] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM USA. [Li, Nan] Sichuan Univ, Chengdu, Peoples R China. [Stubben, Chris J.] Univ Utah, Salt Lake City, UT USA. [Hu, Bin] SRA Int, Atlanta, GA USA. [Vuyisich, Momchilo] Viome Inc, Los Alamos, NM USA. RP Hong-Geller, E (reprint author), Los Alamos Natl Lab, Biosci Div, Los Alamos, NM 87544 USA. EM ehong@lanl.gov FU Laboratory Directed Research and Development Directed Research (LDRD-DR) [20110051] FX This work was funded by Laboratory Directed Research and Development Directed Research (LDRD-DR) #20110051. The funders had no role in study design, data collection and analysis, decision to publish, or preparation of the manuscript. NR 43 TC 0 Z9 0 U1 2 U2 2 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 28 PY 2016 VL 11 IS 12 AR e0168915 DI 10.1371/journal.pone.0168915 PG 22 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG7JB UT WOS:000391222000084 PM 28030576 ER PT J AU Kadlec, EA Jarecki, RL Starbuck, A Peters, DW Davids, PS AF Kadlec, Emil A. Jarecki, Robert L. Starbuck, Andrew Peters, David W. Davids, Paul S. TI Photon-Phonon-Enhanced Infrared Rectification in a Two-Dimensional Nanoantenna-Coupled Tunnel Diode SO PHYSICAL REVIEW APPLIED LA English DT Article ID FREQUENCIES; RADIATION; MICROWAVE; FIELDS; FILMS AB The interplay of strong infrared photon-phonon coupling with electromagnetic confinement in nanoscale devices is demonstrated to have a large impact on ultrafast photon-assisted tunneling in metal-oxide-semiconductor (MOS) structures. Infrared active optical phonon modes in polar oxides lead to strong dispersion and enhanced electric fields at material interfaces. We find that the infrared dispersion of SiO2 near a longitudinal optical phonon mode can effectively impedance match a photonic surface mode into a nanoscale tunnel gap that results in large transverse-field confinement. An integrated 2D nanoantenna structure on a distributed large-area MOS tunnel-diode rectifier is designed and built to resonantly excite infrared surface modes and is shown to efficiently channel infrared radiation into nanometer-scale gaps in these MOS devices. This enhanced-gap transverse-electric field is converted to a rectified tunneling displacement current resulting in a dc photocurrent. We examine the angular and polarization-dependent spectral photocurrent response of these 2D nanoantenna-coupled tunnel diodes in the photon-enhanced tunneling spectral region. Our 2D nanoantenna-coupled infrared tunnel-diode rectifier promises to impact large-area thermal energy harvesting and infrared direct detectors. C1 [Kadlec, Emil A.; Jarecki, Robert L.; Starbuck, Andrew; Peters, David W.; Davids, Paul S.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. RP Davids, PS (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. EM pdavids@sandia.gov FU Sandia's Laboratory Directed Research and Development (LDRD) program; United States Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX Funding for this work was provided by Sandia's Laboratory Directed Research and Development (LDRD) program. Sandia is a multimission laboratory operated by Sandia Corporation, a Lockheed Martin Company, for the United States Department of Energy's National Nuclear Security Administration under Contract No. DE-AC04-94AL85000. NR 21 TC 0 Z9 0 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2331-7019 J9 PHYS REV APPL JI Phys. Rev. Appl. PD DEC 28 PY 2016 VL 6 IS 6 AR 064019 DI 10.1103/PhysRevApplied.6.064019 PG 7 WC Physics, Applied SC Physics GA EG4TW UT WOS:000391037600004 ER PT J AU Liu, CP Foo, Y Kamruzzaman, M Ho, CY Zapien, JA Zhu, W Li, YJ Walukiewicz, W Yu, KM AF Liu, Chao Ping Foo, Yishu Kamruzzaman, M. Ho, Chun Yuen Zapien, J. A. Zhu, Wei Li, Y. J. Walukiewicz, Wladek Yu, Kin Man TI Effects of Free Carriers on the Optical Properties of Doped CdO for Full-Spectrum Photovoltaics SO PHYSICAL REVIEW APPLIED LA English DT Article ID TRANSPARENT CONDUCTING OXIDES; STOKES VECTOR SPECTROSCOPY; INDIUM-TIN-OXIDE; THIN-FILMS; IN2O3 FILMS; ELECTRONIC-STRUCTURE; REFRACTIVE-INDEX; BAND; ELLIPSOMETRY; SEMICONDUCTORS AB CdO-based transparent-conducting oxide thin films have great potential applications in optoelectronic devices due their high mobility, low resistivity, and high transparency over a wide spectral range. In this paper, we report the results of a comprehensive study of optical properties of CdO thin films doped with different donors (In, Ga, V, Ti) with a carrier concentration in the range of 10(20) to > 10(21)/cm(3). Variable angle spectroscopic ellipsometry (SE) studies reveal that the complex dielectric function of CdO thin films drastically depends on the carrier concentration. Specifically, with increasing carrier concentration, (1) the net effect of Burstein-Moss shift and band-gap renormalization gives rise to an increase in the optical band gap from 2.6 to 3.2 eV; (2) the free-carrier absorption coefficient at a wavelength of 1200 nm increases from 10(2) to 1 x 10(4) cm(-1); (3) the refractive index decreases from 2.4 to 2.05 at 600 nm; (4) the high-frequency dielectric constant reduces from 5.5 to 4.8. The SE results are analyzed with results from Hall measurements to obtain information on the electron effective mass and optical mobility of CdO thin films. The significantly higher effective mass of V- and Ti-doped CdO thin film is attributed to the modification of the conduction band due to an anticrossing interaction between the localized d levels of V and Ti atoms and the CdO conduction-band extended states. The effective mass of In-and Ga-doped CdO increases with the electron concentration, consistent with the prediction from the nonparabolic conductionband model. We also find that the optical mobility mu(opt) is close to the Hall mobility mu(Hall) when the mu(Hall) < 60 cm(2)/Vs, while mu(opt) < mu(Hall) for materials with higher mu(Hall). C1 [Liu, Chao Ping; Foo, Yishu; Kamruzzaman, M.; Ho, Chun Yuen; Zapien, J. A.; Yu, Kin Man] City Univ Hong Kong, Dept Phys & Mat Sci, 83 Tat Chee Ave, Kowloon, Hong Kong, Peoples R China. [Zhu, Wei; Li, Y. J.; Walukiewicz, Wladek] Lawrence Berkeley Natl Lab, Mat Sci Div, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Zhu, Wei] Univ Sci & Technol China, Dept Phys, Hefei 230026, Anhui, Peoples R China. [Zhu, Wei] Univ Sci & Technol China, Ctr Phys Expt, Hefei 230026, Anhui, Peoples R China. [Li, Y. J.] South China Univ Technol, State Key Lab Luminescent Mat & Devices, Guangzhou 510641, Guangdong, Peoples R China. [Li, Y. J.] South China Univ Technol, Inst Opt Commun Mat, Guangzhou 510641, Guangdong, Peoples R China. RP Yu, KM (reprint author), City Univ Hong Kong, Dept Phys & Mat Sci, 83 Tat Chee Ave, Kowloon, Hong Kong, Peoples R China. EM kinmanyu@cityu.edu.hk FU City University of Hong Kong [9380076]; Electronic Materials Program at the Lawrence Berkeley National Laboratory; Research Grants Council, University Grants Committee, Hong Kong [CityU 122812]; Hong Kong Ph.D. Fellowship, Research Grants Council, University Grants Committee, Hong Kong [PF-15139] FX This work was supported by the City University of Hong Kong (Project No. 9380076). Material synthesis and RBS analysis performed at LBNL were supported by the Electronic Materials Program at the Lawrence Berkeley National Laboratory. J. A. Z. acknowledges support by the Research Grants Council, University Grants Committee, Hong Kong (Project No. CityU 122812). Y. F. was supported by the Hong Kong Ph.D. Fellowship No. PF-15139, Research Grants Council, University Grants Committee, Hong Kong. NR 61 TC 0 Z9 0 U1 9 U2 9 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2331-7019 J9 PHYS REV APPL JI Phys. Rev. Appl. PD DEC 28 PY 2016 VL 6 IS 6 AR 064018 DI 10.1103/PhysRevApplied.6.064018 PG 12 WC Physics, Applied SC Physics GA EG4TW UT WOS:000391037600003 ER PT J AU Calder, S Kim, JW Taylor, AE Upton, MH Casa, D Cao, GX Mandrus, D Lumsden, MD Christianson, AD AF Calder, S. Kim, J. W. Taylor, A. E. Upton, M. H. Casa, D. Cao, Guixin Mandrus, D. Lumsden, M. D. Christianson, A. D. TI Strong anisotropy within a Heisenberg model in the J(eff)=1/2 insulating state of Sr2Ir0.8Ru0.2O4 SO PHYSICAL REVIEW B LA English DT Article AB The dispersive magnetic excitations in Sr2IrO4 have previously been well described within an isospin-1/2 Heisenberg model on a square lattice that revealed parallels with La2CuO4. Here we investigate the inelastic spectra of Sr2Ir0.8Ru0.2O4 with resonant inelastic x-ray scattering (RIXS) at the Ir L-3 edge. The results are well described using linear spin-wave theory within a similar Heisenberg model applicable to Sr2IrO4; however, the disorder induced by the substitution of 20% Ir4+ ions for Ru4+ removes longer range exchange interactions. A large spin gap (40 meV) is measured indicating strong anisotropy from spin-orbit coupling that is manifest due to the altered magnetic structure in Sr2Ir0.8Ru0.2O4 with c-axis aligned moments compared to the basal plane moments in the parent. Collectively the results indicate the robustness of a Heisenberg model description even when the magnetic structure is altered and the J(eff) = 1/2 moments are diluted. C1 [Calder, S.; Taylor, A. E.; Lumsden, M. D.; Christianson, A. D.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Kim, J. W.; Upton, M. H.; Casa, D.] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA. [Cao, Guixin; Mandrus, D.] Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USA. [Cao, Guixin; Mandrus, D.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. RP Calder, S (reprint author), Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. EM caldersa@ornl.gov RI Lumsden, Mark/F-5366-2012 OI Lumsden, Mark/0000-0002-5472-9660 FU DOE Office of Science [DE-AC02-06CH11357]; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division FX This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. A portion of this research used resources at the High Flux Isotope Reactor and Spallation Neutron Source, a DOE Office of Science User Facility operated by the Oak Ridge National Laboratory. D.M. acknowledges support from the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. NR 22 TC 0 Z9 0 U1 9 U2 9 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 28 PY 2016 VL 94 IS 22 AR 220407 DI 10.1103/PhysRevB.94.220407 PG 5 WC Physics, Condensed Matter SC Physics GA EG4IS UT WOS:000391007800001 ER PT J AU Cao, Y Kalinin, SV AF Cao, Ye Kalinin, Sergei V. TI Phase-field modeling of chemical control of polarization stability and switching dynamics in ferroelectric thin films SO PHYSICAL REVIEW B LA English DT Article ID SOLID-SOLUTION SYSTEM; THERMODYNAMIC THEORY; DOMAIN-STRUCTURES; PEROVSKITE FILMS; OXIDE SURFACES; EVOLUTION AB Phase-field simulation (PFS) has revolutionized the understanding of domain structure and switching behavior in ferroelectric thin films and ceramics. Generally, PFS is based on the solution of (a set of) Landau-Ginzburg-Devonshire equations for a defined order parameter field(s) under physical boundary conditions (BCs) of fixed potential or charge. While well matched to the interfaces in bulk materials and devices, these BCs are generally not applicable to free ferroelectric surfaces. Here, we developed a self-consistent phase-field model with BCs based on electrochemical equilibria. We chose Pb(Zr0.2Ti0.8)O-3 ultrathin film consisting of (001) oriented single tetragonal domain (P-z) as a model system and systematically studied the effects of oxygen partial pressure, temperature, and surface ions on the ferroelectric state and compared it with the case of complete screening. We have further explored the polarization switching induced by the oxygen partial pressure and observed pronounced size effect induced by chemical screening. Our paper thus helps to understand the emergent phenomena in ferroelectric thin films brought about by the electrochemical ionic surface compensations. C1 [Cao, Ye; Kalinin, Sergei V.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. RP Cao, Y (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. EM caoy@ornl.gov; sergei2@ornl.gov FU US Department of Energy (DOE), Office of Basic Energy Sciences (BES), Materials Sciences and Engineering Division (MSED) under FWP Grant [ERKCZ07] FX This paper was supported by the US Department of Energy (DOE), Office of Basic Energy Sciences (BES), Materials Sciences and Engineering Division (MSED) under FWP Grant No. ERKCZ07 (Y.C., S.V.K.). A portion of this research was conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility. NR 37 TC 0 Z9 0 U1 12 U2 12 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 28 PY 2016 VL 94 IS 23 AR 235444 DI 10.1103/PhysRevB.94.235444 PG 11 WC Physics, Condensed Matter SC Physics GA EG4JX UT WOS:000391011000005 ER PT J AU Feng, HL Calder, S Ghimire, MP Yuan, YH Shirako, Y Tsujimoto, Y Matsushita, Y Hu, ZW Kuo, CY Tjeng, LH Pi, TW Soo, YL He, JF Tanaka, M Katsuya, Y Richter, M Yamaura, K AF Feng, Hai L. Calder, Stuart Ghimire, Madhav Prasad Yuan, Ya-Hua Shirako, Yuichi Tsujimoto, Yoshihiro Matsushita, Yoshitaka Hu, Zhiwei Kuo, Chang-Yang Tjeng, Liu Hao Pi, Tun-Wen Soo, Yun-Liang He, Jianfeng Tanaka, Masahiko Katsuya, Yoshio Richter, Manuel Yamaura, Kazunari TI Ba2NiOsO6: A Dirac-Mott insulator with ferromagnetism near 100 K SO PHYSICAL REVIEW B LA English DT Article ID ROOM-TEMPERATURE FERROMAGNETISM; HIGH-PRESSURE SYNTHESIS; MAGNETIC-PROPERTIES; DOUBLE PEROVSKITES; CRYSTAL-STRUCTURE; PHYSICAL-PROPERTIES; POWDER DIFFRACTION; SEMICONDUCTORS; TRANSITION; OXIDES AB The ferromagnetic semiconductor Ba2NiOsO6 (T-mag similar to 100 K) was synthesized at 6 GPa and 1500 degrees C. It crystallizes into a double perovskite structure [Fm-3m; a = 8.0428(1) angstrom], where the Ni2+ and Os6+ ions are perfectly ordered at the perovskite B site. We show that the spin-orbit coupling of Os6+ plays an essential role in opening the charge gap. The magnetic state was investigated by density functional theory calculations and powder neutron diffraction. The latter revealed a collinear ferromagnetic order in a > 21 kOe magnetic field at 5 K. The ferromagnetic gapped state is fundamentally different from that of known dilute magnetic semiconductors such as (Ga, Mn) As and (Cd, Mn) Te (T-mag < 180 K), the spin-gapless semiconductor Mn2CoAl (T-mag similar to 720 K), and the ferromagnetic insulators EuO (T-mag similar to 70 K) and Bi3Cr3O11 (T-mag similar to 220 K). It is also qualitatively different from known ferrimagnetic insulators and semiconductors, which are characterized by an antiparallel spin arrangement. Our finding of the ferromagnetic semiconductivity of Ba2NiOsO6 should increase interest in the platinum group oxides, because this alternative class of materials should be useful in the development of spintronic, quantum magnetic, and related devices. C1 [Feng, Hai L.; Yuan, Ya-Hua; Tsujimoto, Yoshihiro; He, Jianfeng; Yamaura, Kazunari] Natl Inst Mat Sci, Res Ctr Funct Mat, 1-1 Namiki, Tsukuba, Ibaraki 3050044, Japan. [Feng, Hai L.; Hu, Zhiwei; Kuo, Chang-Yang; Tjeng, Liu Hao] Max Planck Inst Chem Phys Solids, Nothnitzer Str 40, D-01187 Dresden, Germany. [Calder, Stuart] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Ghimire, Madhav Prasad; Richter, Manuel] IFW Dresden, Leibniz Inst Solid State & Mat Res, POB 270116, D-01171 Dresden, Germany. [Ghimire, Madhav Prasad] Condensed Matter Phys Res Ctr, Butwal 13, Rupandehi, Lumbini, Nepal. [Yuan, Ya-Hua; He, Jianfeng; Yamaura, Kazunari] Hokkaido Univ, Grad Sch Chem Sci & Engn, Kita Ku, North 10 West 8, Sapporo, Hokkaido 0600810, Japan. [Shirako, Yuichi] Gakushuin Univ, Dept Chem, 1-5-1 Mejiro, Tokyo 1718588, Japan. [Matsushita, Yoshitaka] Natl Inst Mat Sci, Mat Anal Stn, 1-2-1 Sengen, Tsukuba, Ibaraki 3050047, Japan. [Pi, Tun-Wen; Soo, Yun-Liang] Natl Synchrotron Radiat Res Ctr, Hsinchu 30076, Taiwan. [Soo, Yun-Liang] Natl Tsing Hua Univ, Dept Phys, Hsinchu 30013, Taiwan. [Tanaka, Masahiko; Katsuya, Yoshio] Natl Inst Mat Sci, Synchrotron Xray Stn SPring 8, Kouto 1-1-1, Sayo, Hyogo 6795148, Japan. [Richter, Manuel] Tech Univ Dresden, DCMS, Dresden Ctr Computat Mat Sci, D-01069 Dresden, Germany. RP Feng, HL (reprint author), Natl Inst Mat Sci, Res Ctr Funct Mat, 1-1 Namiki, Tsukuba, Ibaraki 3050044, Japan.; Feng, HL (reprint author), Max Planck Inst Chem Phys Solids, Nothnitzer Str 40, D-01187 Dresden, Germany. EM Hai.FENG_nims@hotmail.com; ghimire.mpg@gmail.com RI Feng, Hai/J-4189-2013; Richter, Manuel/F-2485-2016 OI Feng, Hai/0000-0002-2699-3958; Richter, Manuel/0000-0002-9999-8290 FU Alexander von Humboldt Foundation; World Premier International Research Center of the Ministry of Education, Culture, Sports, Science and Technology (MEXT) of Japan; Japan Society for the Promotion of Science (JSPS) [25289233, 15K14133, 16H04501]; Scientific User Facilities Division, Office of Basic Energy Sciences, US Department of Energy FX The authors would like to thank the staff of BL15XU, NIMS, and SPring-8 for their help at the beamline. The SXRD measurements were performed under the approval of the NIMS Beamline Station (Proposals No. 2014A4504, NO. 2014B4501, No. 2015A4502, and No. 2016B4504). The XAS measurements were supported by Chin-Wen Pao. M.P.G thanks the Alexander von Humboldt Foundation for financial support through the Georg Forster Research Fellowship Program. M.P.G. thanks K. Koepernik and R. Laskowski for helpful discussion, and M.R. thanks M. Knupfer, U. Rossler, and H. Rosner for helpful discussion. M.P.G. and M.R. thank U. Nitzsche for technical assistance. This research was supported in part by the World Premier International Research Center of the Ministry of Education, Culture, Sports, Science and Technology (MEXT) of Japan and the Japan Society for the Promotion of Science (JSPS) through a Grant-in-Aid for Scientific Research (Grants No. 25289233, No. 15K14133, and No. 16H04501). The research conducted at ORNL's High Flux Isotope Reactor was sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, US Department of Energy. NR 67 TC 0 Z9 0 U1 9 U2 9 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 28 PY 2016 VL 94 IS 23 AR 235158 DI 10.1103/PhysRevB.94.235158 PG 9 WC Physics, Condensed Matter SC Physics GA EG4JX UT WOS:000391011000003 ER PT J AU Bauer, M Carena, M Gemmler, K AF Bauer, Martin Carena, Marcela Gemmler, Katrin TI Creating the fermion mass hierarchies with multiple Higgs bosons SO PHYSICAL REVIEW D LA English DT Article ID MATRIX MODELS; SEARCH AB After the Higgs boson discovery, it was established that the Higgs mechanism explains electroweak symmetry breaking and generates the masses of all particles in the Standard Model, with the possible exception of neutrino masses. The hierarchies among fermion masses and mixing angles, however, remain unexplained. We propose a new class of two Higgs doublet models in which a flavor symmetry broken at the electroweak scale addresses this problem. The models are strongly constrained by electroweak precision tests and the fact that they produce modifications to Higgs couplings and flavor-changing neutral currents; they are also constrained by collider searches for extra scalar bosons. The surviving models are very predictive, implying unavoidable new physics signals at the CERN Large Hadron Collider, e.g., extra Higgs bosons with masses M < 700 GeV. C1 [Bauer, Martin] Heidelberg Univ, Inst Theoret Phys, Philosophenweg 16, D-69120 Heidelberg, Germany. [Carena, Marcela; Gemmler, Katrin] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Carena, Marcela] Univ Chicago, Enrico Fermi Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA. [Carena, Marcela] Univ Chicago, Kavli Inst Cosmol Phys, Chicago, IL 60637 USA. [Gemmler, Katrin] Tech Univ Munich, TUM Inst Adv Study, Arcisstr 21, D-80333 Munich, Germany. RP Bauer, M (reprint author), Heidelberg Univ, Inst Theoret Phys, Philosophenweg 16, D-69120 Heidelberg, Germany. FU Alexander von Humboldt Foundation; United States Department of Energy [DE-AC02-07CH11359]; Deutsche Forschungsgemeinschaft (DFG) [GE 2541/2-1] FX We thank Adrian Carmona, Lawrence Hall and Alexey Petrov for interesting discussions. M. B. acknowledges the support of the Alexander von Humboldt Foundation. Fermilab is operated by Fermi Research Alliance, LLC under Contract No. DE-AC02-07CH11359 with the United States Department of Energy. K. G. acknowledges support by the Deutsche Forschungsgemeinschaft (DFG), Grant No. GE 2541/2-1. NR 27 TC 1 Z9 1 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 28 PY 2016 VL 94 IS 11 AR 115030 DI 10.1103/PhysRevD.94.115030 PG 6 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EG4LT UT WOS:000391016500002 ER PT J AU Mou, DX Kong, T Meier, WR Lochner, F Wang, LL Lin, QS Wu, Y Bud'ko, SL Eremin, I Johnson, DD Canfield, PC Kaminski, A AF Mou, Daixiang Kong, Tai Meier, William R. Lochner, Felix Wang, Lin-Lin Lin, Qisheng Wu, Yun Bud'ko, S. L. Eremin, Ilya Johnson, D. D. Canfield, P. C. Kaminski, Adam TI Enhancement of the Superconducting Gap by Nesting in CaKFe4As4: A New High Temperature Superconductor SO PHYSICAL REVIEW LETTERS LA English DT Article ID PAIRING SYMMETRY; IRON PNICTIDES; FERMI-SURFACE; CS; RB AB We use high resolution angle resolved photoemission spectroscopy and density functional theory with measured crystal structure parameters to study the electronic properties of CaKFe4As4. In contrast to the related CaFe2As2 compounds, CaKFe4As4 has a high T-c of 35 K at stochiometric composition. This presents a unique opportunity to study the properties of high temperature superconductivity in the iron arsenides in the absence of doping or substitution. The Fermi surface consists of several hole and electron pockets that have a range of diameters. We find that the values of the superconducting gap are nearly isotropic (within the explored portions of the Brillouin zone), but are significantly different for each of the Fermi surface (FS) sheets. Most importantly, we find that the momentum dependence of the gap magnitude plotted across the entire Brillouin zone displays a strong deviation from the simple cos(k(x)) cos(k(y))functional form of the gap function, proposed by the scenario of Cooper pairing driven by a short range antiferromagnetic exchange interaction. Instead, the maximum value of the gap is observed on FS sheets that are closest to the ideal nesting condition, in contrast to previous observations in other ferropnictides. These results provide strong support for the multiband character of superconductivity in CaKFe4As4, in which Cooper pairing forms on the electron and the hole bands interacting via a dominant interband repulsive interaction, enhanced by band nesting. C1 [Mou, Daixiang; Kong, Tai; Meier, William R.; Wang, Lin-Lin; Lin, Qisheng; Wu, Yun; Bud'ko, S. L.; Johnson, D. D.; Canfield, P. C.; Kaminski, Adam] Ames Lab, Div Mat Sci & Engn, Ames, IA 50011 USA. [Mou, Daixiang; Kong, Tai; Meier, William R.; Wu, Yun; Bud'ko, S. L.; Johnson, D. D.; Canfield, P. C.; Kaminski, Adam] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [Lochner, Felix; Eremin, Ilya] Ruhr Univ Bochum, Inst Theoret Phys 3, D-44801 Bochum, Germany. [Johnson, D. D.] Iowa State Univ, Dept Mat Sci & Engn, Ames, IA 50011 USA. RP Mou, DX (reprint author), Ames Lab, Div Mat Sci & Engn, Ames, IA 50011 USA.; Mou, DX (reprint author), Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. RI Eremin, Ilya /M-2079-2016 OI Eremin, Ilya /0000-0003-0557-8015 FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Science and Engineering Division; U.S. Department of Energy by Iowa State University [DE-AC02-07CH11358]; Agence Nationale de la Recherche (ANR) [ER463/8-1]; Deutsche Forschungsgemeinschaft (DFG) [ER463/8-1]; German Academic Exchange Service (DAAD PPP USA) [57316180]; Gordon and Betty Moore Foundation EPiQS Initiative [GBMF4411] FX We would like to thank Rafael Fernandes and Peter Orth for very useful discussions. This work was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Science and Engineering Division (sample growth, characterization and ARPES measurements). Ames Laboratory is operated for the U.S. Department of Energy by Iowa State University under Contract No. DE-AC02-07CH11358. I.E. was supported by the joint Agence Nationale de la Recherche (ANR) and the Deutsche Forschungsgemeinschaft (DFG) Grant No. ER463/8-1 and by the German Academic Exchange Service (DAAD PPP USA, Grant. No. 57316180). W.R.M. was supported by is supported by the Gordon and Betty Moore Foundation EPiQS Initiative (Grant No. GBMF4411) NR 42 TC 1 Z9 1 U1 16 U2 16 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 28 PY 2016 VL 117 IS 27 AR 277001 DI 10.1103/PhysRevLett.117.277001 PG 6 WC Physics, Multidisciplinary SC Physics GA EG4RX UT WOS:000391032500009 PM 28084772 ER PT J AU Kumar, H Detsi, E Abraham, DP Shenoy, VB AF Kumar, Hemant Detsi, Eric Abraham, Daniel P. Shenoy, Vivek B. TI Fundamental Mechanisms of Solvent Decomposition Involved in Solid-Electrolyte Interphase Formation in Sodium Ion Batteries SO CHEMISTRY OF MATERIALS LA English DT Article ID UNDERSTAND SURFACE-CHEMISTRY; VINYLENE CARBONATE; ETHYLENE CARBONATE; ELECTROCHEMICAL PERFORMANCE; MOLECULAR-DYNAMICS; INTERFACE SEI; AB-INITIO; LI; ANODES; REDUCTION AB Prolonged decomposition of electrolytes forming a thick and unstable solid-electrolyte interphase (SEI) continues to be a major bottleneck in designing sodium-ion batteries (SIBs). We have carried out quantum chemistry simulations to investigate the fundamental mechanisms of reduction-induced decomposition of electrolyte solvents in the vicinity of a sodium ion. Kinetics and thermodynamics of several reaction pathways for one- and two-electron reduction of ethylene carbonate (EC) have been examined. Our calculations indicate that the high reduction potential and low barrier for the ring opening of EC is the main cause for the continuous growth of SEI observed in SIBs. The impact of two well-known electrolyte additives, vinyl carbonate (VC) and fluoroethylene carbonate (FEC), on SEI composition was evaluated by studying decomposition pathways of (1) VC and FEC molecules in the bulk EC solvent and (2) an EC molecule in a supermolecular cluster comprising an EC and the additive molecule. The additive molecules have significantly low barriers for decomposition and therefore decompose first. Additionally, the presence of an additive molecule was also shown to increase the barrier for decomposition of EC. Another observation suggests that the preferred reduction state of an EC molecule changes when it forms a dimer with additive molecules, and these reduction states have different decomposition pathways which leads to formation of different SEI compounds. On the basis of these observations, we predict that not only do the additive molecules protect solvent molecules from reductive decomposition but also they can promote alternate pathways for the decomposition, leading to qualitatively different and potentially stable SEI products. C1 [Kumar, Hemant; Detsi, Eric; Shenoy, Vivek B.] Univ Penn, Dept Mat Sci & Engn, 3231 Walnut St, Philadelphia, PA 19104 USA. [Abraham, Daniel P.] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Shenoy, VB (reprint author), Univ Penn, Dept Mat Sci & Engn, 3231 Walnut St, Philadelphia, PA 19104 USA. FU US National Science Foundation [EFMA-542879, CMMI-1363203, CBET-1235870] FX This work is supported by the Grants EFMA-542879, CMMI-1363203, and CBET-1235870 from the US National Science Foundation. NR 45 TC 0 Z9 0 U1 22 U2 22 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0897-4756 EI 1520-5002 J9 CHEM MATER JI Chem. Mat. PD DEC 27 PY 2016 VL 28 IS 24 BP 8930 EP 8941 DI 10.1021/acs.chemmater.6b03403 PG 12 WC Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EG5JU UT WOS:000391080900011 ER PT J AU Linares, N Sachse, A Serrano, E Grau-Atienza, A Jardim, ED Silvestre-Albero, J Cordeiro, MAL Fauth, F Beobide, G Castillo, O Garcia-Martinez, J AF Linares, Noemi Sachse, Alexander Serrano, Elena Grau-Atienza, Aida De Oliveira Jardim, Erika Silvestre-Albero, Joaquin Cordeiro, Marco Aurelio Liutheviciene Fauth, Francois Beobide, Garikoitz Castillo, Oscar Garcia-Martinez, Javier TI In Situ Time-Resolved Observation of the Development of Intracrystalline Mesoporosity in USY Zeolite SO CHEMISTRY OF MATERIALS LA English DT Article ID SILICATE PHASE-BEHAVIOR; RAY-DIFFRACTION; CRYSTALLIZATION; SYNCHROTRON; MICROSCOPY; NANOSHEETS; CATALYSTS; KINETICS; IMPACT; GROWTH AB The development of intracrystalline mesoporosity within zeolites has been a long-standing goal in catalysis as it greatly contributes to alleviating the diffusion limitations of these widely used microporous materials. The combination of in situ synchrotron X-ray diffraction and liquid-cell transmission electron microscopy enabled the first in situ observation of the development of intracrystalline mesoporosity in zeolites and provided structural and kinetic information on the changes produced in zeolites to accommodate the mesoporosity. The interpretation of the time-resolved diffractograms together with computational simulations evidenced the formation of short-range hexagonally ordered mesoporosity within the zeolite framework, and the in situ electron microscopy studies allowed the direct observation of structural changes in the zeolite during the process. The evidence for the templating and protective role of the surfactant and the rearrangement of the zeolite crystal to accommodate intracrystalline mesoporosity opens new and exciting opportunities for the production of tailored hierarchical zeolites. C1 [Linares, Noemi; Sachse, Alexander; Serrano, Elena; Grau-Atienza, Aida; De Oliveira Jardim, Erika; Garcia-Martinez, Javier] Univ Alicante, Lab Nanotecnol Mol, Dept Quim Inorgan, Ctra San Vicente Alicante S-N, E-03960 San Vicente Del Raspeig, Spain. [Silvestre-Albero, Joaquin] Univ Alicante, Lab Mat Avanzados, Dept Quim Inorgan, Inst Univ Mat, Ctra San Vicente Alicante S-N, E-03960 San Vicente Del Raspeig, Spain. [Cordeiro, Marco Aurelio Liutheviciene] Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. [Fauth, Francois] ALBA Light Source, Barcelona 08290, Spain. [Beobide, Garikoitz; Castillo, Oscar] Univ Pais Vasco UPV EHU, Dept Quim Inorgan, Fac Ciencia & Tecnol, Apartado 644, E-48080 Bilbao, Spain. [Garcia-Martinez, Javier] Rive Technol Inc, 1 Deer Pk Dr, Monmouth Jct, NJ 08852 USA. RP Garcia-Martinez, J (reprint author), Univ Alicante, Lab Nanotecnol Mol, Dept Quim Inorgan, Ctra San Vicente Alicante S-N, E-03960 San Vicente Del Raspeig, Spain.; Garcia-Martinez, J (reprint author), Rive Technol Inc, 1 Deer Pk Dr, Monmouth Jct, NJ 08852 USA. EM j.garcia@ua.es OI Beobide, Garikoitz/0000-0002-6262-6506; Serrano, Elena/0000-0003-3340-6675; Sachse, Alexander/0000-0001-5273-1313 FU ALBA [2015021271]; CAPITA Project WAVES [EP7-NMP-266543] FX We acknowledge the ALBA synchrotron for beamtime availability (Project ID: 2015021271) and the Center for Functional Nanomaterials at the Brookhaven National Laboratory for the Liq-TEM availability. The authors further acknowledge the CAPITA Project WAVES (EP7-NMP-266543) for financial support. NR 38 TC 1 Z9 1 U1 14 U2 14 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0897-4756 EI 1520-5002 J9 CHEM MATER JI Chem. Mat. PD DEC 27 PY 2016 VL 28 IS 24 BP 8971 EP 8979 DI 10.1021/acs.chemmater.6b03688 PG 9 WC Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EG5JU UT WOS:000391080900015 ER PT J AU Yin, YY Liu, M Dai, JH Wang, X Zhou, L Cao, HB dela Cruz, C Chen, CT Xu, YJ Shen, X Yu, RC Alonso, JA Munoz, A Yang, YF Jin, CQ Hu, ZW Long, YW AF Yin, Yun-Yu Liu, Min Dai, Jian-Hong Wang, Xiao Zhou, Long Cao, Huibo dela Cruz, Clarina Chen, Chien-Te Xu, Yuanji Shen, Xi Yu, Richeng Antonio Alonso, Jose Munoz, Angel Yang, Yi-Feng Jin, Changqing Hu, Zhiwei Long, Youwen TI LaMn3Ni2Mn2O12: An A- and B-Site Ordered Quadruple Perovskite with A-Site Tuning Orthogonal Spin Ordering SO CHEMISTRY OF MATERIALS LA English DT Article ID HIGH-PRESSURE SYNTHESIS; BOND-VALENCE PARAMETERS; MAGNETIC-PROPERTIES; CRYSTAL-STRUCTURE; CHARGE-TRANSFER; MAGNETORESISTANCE; TEMPERATURE; OXIDE; DIFFRACTION; TRANSITION AB A new oxide, LaMn3Ni2Mn2O12, was prepared by high-pressure and high-temperature synthesis methods. The compound crystallizes in an AA'3B2Bi2O12-tYPe Ai siteand B site ordered quadruple perovskite structure. The charge combination is confirmed to be LaMn33+Ni2 2Mn24+O12, where La and Mn3+ are 1:3 ordered at the A and A' sites and the Ni2+ and Mn4+ are also distributed at the B and B' sites in an orderly fashion in a rocksalt-type manner, respectively. A G-type antiferromagnetic ordering originating from the A'-site Mn3+-sublattice is found to occur at T-N approximate to C-Z% 46 K. Subsequently, the spin coupling between the B-site Ni' and B+-site Mn4+ sublattices leads to an orthogonally ordered spin alignment with a net ferromagnetic component near T-C approximate to 34 K First-principles calculations demonstrate that the A'-site Mn" spins play a crucial role in determining the spin structure of the B and B' sites. This LaMn3Ni2Mn2O12 provides a rare example that shows orthogonal spin ordering in the B and B' sites assisted by ordered A-site magnetic ions in perovskite systems. C1 [Yin, Yun-Yu; Liu, Min; Dai, Jian-Hong; Wang, Xiao; Zhou, Long; Xu, Yuanji; Shen, Xi; Yu, Richeng; Yang, Yi-Feng; Jin, Changqing; Long, Youwen] Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Inst Phys, Beijing 100190, Peoples R China. [Cao, Huibo; dela Cruz, Clarina] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Neutron Scattering Sci Directorate, POB 2008, Oak Ridge, TN 37831 USA. [Chen, Chien-Te] Natl Synchrotron Radiat Res Ctr, Hsinchu 30076, Taiwan. [Antonio Alonso, Jose] CSIC, Inst Ciencia Mat Madrid, E-28049 Madrid, Spain. [Munoz, Angel] Univ Carlos III, Ave Univ 30, E-28911 Leganes, Spain. [Yang, Yi-Feng; Jin, Changqing; Long, Youwen] Collaborat Innovat Ctr Quantum Matter, Beijing 100190, Peoples R China. [Hu, Zhiwei] Max Planck Inst Chem Phys Solids, D-01187 Dresden, Germany. RP Yang, YF; Long, YW (reprint author), Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Inst Phys, Beijing 100190, Peoples R China.; Yang, YF; Long, YW (reprint author), Collaborat Innovat Ctr Quantum Matter, Beijing 100190, Peoples R China. EM yifeng@iphy.ac.cn; ywlong@iphy.ac.cn NR 54 TC 1 Z9 1 U1 14 U2 14 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0897-4756 EI 1520-5002 J9 CHEM MATER JI Chem. Mat. PD DEC 27 PY 2016 VL 28 IS 24 BP 8988 EP 8996 DI 10.1021/acs.chemmater.6b03785 PG 9 WC Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EG5JU UT WOS:000391080900017 ER PT J AU Lu, W Huang, CL Hong, KL Kang, NG Mays, JW AF Lu, Wei Huang, Caili Hong, Kunlun Kang, Nam-Goo Mays, Jimmy W. TI Poly(1-adamantyl acrylate): Living Anionic Polymerization, Block Copolymerization, and Thermal Properties SO MACROMOLECULES LA English DT Article ID GLASS-TRANSITION TEMPERATURE; HOST-GUEST INCLUSION; TERT-BUTYL ACRYLATE; METHYL-METHACRYLATE; POLY(METHYL METHACRYLATE); RADICAL POLYMERIZATION; (METH)ACRYLIC MONOMERS; LITHIUM-CHLORIDE; MOLECULAR-WEIGHT; ADAMANTYL GROUP AB Living anionic polymerization of acrylates is challenging due to intrinsic side reactions including backbiting reactions of propagating enolate anions and aggregation of active chain ends. In this study, the controlled synthesis of poly(1-adamatyl acrylate) (PAdA) was performed successfully for the first time via living anionic polymerization through investigation of the initiation systems of sec-butyllithium/diphenyl-ethylene/lithium chloride (sec-BuLi/DPE/LiCl), diphenylmethyl-potassium/diethylzinc (DPMK/Et2Zn), and sodium naphthalenide/dipenylethylene/diethylzinc (Na-Naph/DPE/Et2Zn) in tetrahydrofuran at -78 degrees C using custom glass-blowing and high-vacuum techniques. PAdA synthesized via anionic polymerization using DPMK with a large excess (more than 40-fold to DPMK) of Et2Zn as the ligand exhibited predicted molecular weights from 4.3 to 71.8 kg/mol and polydispersity indices of around 1.10. In addition, the produced PAdAs exhibit a low level of isotactic content (mm triads of 2.1%). The block copolymers of AdA and methyl methacrylate (MMA) were obtained by sequential anionic polymerization, and the distinct living property of PAdA over other acrylates was demonstrated based on the observation that the resulting PAdA-b-PMMA block copolymers were formed with no residual PAdA homopolymer. The PAdA homopolymers exhibit a very high glass transition temperature (133 degrees C) and outstanding thermal stability (T-d: 376 degrees C) as compared to other acrylic polymers such as poly(tert-butyl acrylate) and poly(methyl acrylate). These merits make PAdA a promising candidate for acrylic-based thermoplastic elastomers with high upper service temperature and enhanced mechanical strength. C1 [Lu, Wei; Kang, Nam-Goo; Mays, Jimmy W.] Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. [Huang, Caili; Hong, Kunlun] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. RP Kang, NG (reprint author), Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA.; Hong, KL (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. EM hongkq@ornl.gov; nkang1@utk.edu RI Hong, Kunlun/E-9787-2015; OI Hong, Kunlun/0000-0002-2852-5111; Lu, Wei/0000-0001-7460-098X FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division FX This work was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. Part of the synthesis and characterization were conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility. NR 56 TC 0 Z9 0 U1 15 U2 15 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0024-9297 EI 1520-5835 J9 MACROMOLECULES JI Macromolecules PD DEC 27 PY 2016 VL 49 IS 24 BP 9406 EP 9414 DI 10.1021/acs.macromol.6b01732 PG 9 WC Polymer Science SC Polymer Science GA EG5JN UT WOS:000391080200012 ER PT J AU Kreisel, A Nelson, R Berlijn, T Ku, W Aluru, R Chi, S Zhou, HB Singh, UR Wahl, P Liang, RX Hardy, WN Bonn, DA Hirschfeld, PJ Andersen, BM AF Kreisel, A. Nelson, R. Berlijn, T. Ku, W. Aluru, Ramakrishna Chi, Shun Zhou, Haibiao Singh, Udai Raj Wahl, Peter Liang, Ruixing Hardy, Walter N. Bonn, D. A. Hirschfeld, P. J. Andersen, Brian M. TI Towards a quantitative description of tunneling conductance of superconductors: Application to LiFeAs SO PHYSICAL REVIEW B LA English DT Article ID IRON-BASED SUPERCONDUCTORS; PNICTIDES; SYMMETRY AB Since the discovery of iron-based superconductors, a number of theories have been put forward to explain the qualitative origin of pairing, but there have been few attempts to make quantitative, material-specific comparisons to experimental results. The spin-fluctuation theory of electronic pairing, based on first-principles electronic structure calculations, makes predictions for the superconducting gap. Within the same framework, the surface wave functions may also be calculated, allowing, e.g., for detailed comparisons between theoretical results and measured scanning tunneling topographs and spectra. Here we present such a comparison between theory and experiment on the Fe-based superconductor LiFeAs. Results for the homogeneous surface as well as impurity states are presented as a benchmark test of the theory. For the homogeneous system, we argue that the maxima of topographic image intensity may be located at positions above either the As or Li atoms, depending on tip height and the setpoint current of the measurement. We further report the experimental observation of transitions between As-and Li-registered lattices as functions of both tip height and setpoint bias, in agreement with this prediction. Next, we give a detailed comparison between the simulated scanning tunneling microscopy images of transition-metal defects with experiment. Finally, we discuss possible extensions of the current framework to obtain a theory with true predictive power for scanning tunneling microscopy in Fe-based systems. C1 [Kreisel, A.; Andersen, Brian M.] Univ Copenhagen, Niels Bohr Inst, Univ Pk 5, DK-2100 Copenhagen, Denmark. [Kreisel, A.] Univ Leipzig, Inst Theoret Phys, D-04103 Leipzig, Germany. [Nelson, R.] Rhein Westfal TH Aachen, Inst Inorgan Chem, Landoltweg 1, D-52056 Aachen, Germany. [Berlijn, T.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Berlijn, T.] Oak Ridge Natl Lab, Comp Sci & Math Div, Oak Ridge, TN 37831 USA. [Ku, W.] Shanghai Jiao Tong Univ, TD Lee Inst, Shanghai 200240, Peoples R China. [Ku, W.] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. [Aluru, Ramakrishna; Singh, Udai Raj; Wahl, Peter] Max Planck Inst Festkorperforsch, Heisenbergstr 1, D-70569 Stuttgart, Germany. [Aluru, Ramakrishna; Zhou, Haibiao; Wahl, Peter] Univ St Andrews, Sch Phys & Astron, SUPA, St Andrews KY16 9SS, Fife, Scotland. [Chi, Shun; Liang, Ruixing; Hardy, Walter N.; Bonn, D. A.] Univ British Columbia, Dept Phys & Astron, Vancouver, BC V6T 1Z1, Canada. [Chi, Shun; Liang, Ruixing; Hardy, Walter N.; Bonn, D. A.] Univ British Columbia, Quantum Matter Inst, Vancouver, BC V6T 1Z4, Canada. [Hirschfeld, P. J.] Univ Florida, Dept Phys, Gainesville, FL 32611 USA. RP Kreisel, A (reprint author), Univ Copenhagen, Niels Bohr Inst, Univ Pk 5, DK-2100 Copenhagen, Denmark.; Kreisel, A (reprint author), Univ Leipzig, Inst Theoret Phys, D-04103 Leipzig, Germany. RI Zhou, Haibiao/C-1390-2017; Wahl, Peter/F-9337-2014; Andersen, Brian /M-4671-2014 OI Zhou, Haibiao/0000-0001-9773-7719; Wahl, Peter/0000-0002-8635-1519; Andersen, Brian /0000-0002-9786-7553 FU Lundbeckfond fellowship [A9318]; MPG-UBC center; EPSRC [EP/I031014/1]; NSF-DMR Grant [1407502]; U.S. Department of Energy [DE-AC05-00OR22725]; National Natural Science Foundation of China [11674220, 11447601]; Ministry of Science and Technology [2016YFA0300500, 2016YFA0300501] FX The authors acknowledge useful discussions with C. Hess, Y. Wang, and D. Guterding. A.K. and B.M.A. acknowledge support from a Lundbeckfond fellowship (Grant No. A9318). S.C., D.B.,and P.W. acknowledge funding from the MPG-UBC center. P.W. acknowledges financial support from EPSRC (Grant No. EP/I031014/1). P.J.H. was supported by NSF-DMR Grant No. 1407502. A portion of this research was conducted at the Center for Nanophase Materials Sciences, which is a U.S. Department of Energy Office of Science User Facility. This paper has been authored by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. W.K. acknowledges support from National Natural Science Foundation of China, No. 11674220 and 11447601, and Ministry of Science and Technology, No. 2016YFA0300500 and No. 2016YFA0300501. Underpinning data can be obtained at http://dx.doi.org/10.17630/ced13c7fc9b6-479c-9668-e3d6c86775bc. NR 46 TC 1 Z9 1 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 27 PY 2016 VL 94 IS 22 AR 224518 DI 10.1103/PhysRevB.94.224518 PG 13 WC Physics, Condensed Matter SC Physics GA EG4IH UT WOS:000391006700006 ER PT J AU Li, C Shen, X Yang, YR Bai, YH Yuan, ZS Su, D Li, AD Zhang, ST Wang, P Bellaiche, L Wu, D AF Li, Chen Shen, Xuan Yang, Yurong Bai, Yuhang Yuan, Zhoushen Su, Dong Li, Aidong Zhang, Shantao Wang, Peng Bellaiche, Laurent Wu, Di TI Chemical strain-dependent two-dimensional transport at RAlO3/SrTiO3 interfaces (R = La, Nd, Sm, and Gd) SO PHYSICAL REVIEW B LA English DT Article ID ELECTRON-GAS; LAALO3/SRTIO3 HETEROINTERFACE; OXIDE INTERFACES; SURFACE; SUPERCONDUCTIVITY; HETEROSTRUCTURES; FERROMAGNETISM; COEXISTENCE; MODULATION; CREATION AB Perovskite RAlO3 (R = La, Nd, Sm, and Gd) films have been deposited epitaxially on (001) TiO2-terminated SrTiO3 substrates. It is observed that the two-dimensional transport characteristics at the RAlO3/SrTiO3 interfaces are very sensitive to the species of rare-earth element, that is to chemical strain. Although electron energy loss spectroscopy measurements show that electron transfer occurs in all the four polar/nonpolar heterostructures, the amount of electrons transferred across SmAlO3/SrTiO3 and GdAlO3/SrTiO3 interfaces are much less than those across LaAlO3/SrTiO3 and NdAlO3/SrTiO3 interfaces. First-principles calculations reveal the competition between ionic polarization and electronic polarization in the polar layers in compensating the build-in polarization due to the polar discontinuity at the interface. In particular, a large ionic polarization is found in SmAlO3/SrTiO3 and GdAlO3/SrTiO3 systems (which experience the largest tensile epitaxial strain), hence reducing the amount of electrons transferred. C1 [Li, Chen; Shen, Xuan; Bai, Yuhang; Yuan, Zhoushen; Li, Aidong; Zhang, Shantao; Wang, Peng; Wu, Di] Nanjing Univ, Coll Engn & Appl Sci, Dept Mat Sci & Engn, Natl Lab Solid State Microstruct, Nanjing 210093, Jiangsu, Peoples R China. [Li, Chen; Shen, Xuan; Bai, Yuhang; Yuan, Zhoushen; Li, Aidong; Zhang, Shantao; Wang, Peng; Wu, Di] Nanjing Univ, Collaborat Innovat Ctr Adv Microstruct, Nanjing 210093, Jiangsu, Peoples R China. [Yang, Yurong; Bellaiche, Laurent] Univ Arkansas, Dept Phys, Fayetteville, AR 72701 USA. [Yang, Yurong; Bellaiche, Laurent] Univ Arkansas, Inst Nanosci & Engn, Fayetteville, AR 72701 USA. [Su, Dong] Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. RP Yang, YR (reprint author), Univ Arkansas, Dept Phys, Fayetteville, AR 72701 USA.; Yang, YR (reprint author), Univ Arkansas, Inst Nanosci & Engn, Fayetteville, AR 72701 USA. EM yyrwater@uark.edu; diwu@nju.edu.cn RI Su, Dong/A-8233-2013; Wu, Di/B-1147-2008 OI Su, Dong/0000-0002-1921-6683; Wu, Di/0000-0003-3619-1411 FU State Key Program for Basic Research of China [2015CB921203]; Natural Science Foundation of China [11374139, U1431112]; ONR Grant [N00014-12-1-1034]; NSF [0722625, 0959124, 0918970]; U.S. Department of Energy, Office of Basic Energy Sciences [DE-SC0012704]; DoD FX This work was sponsored by State Key Program for Basic Research of China (2015CB921203), Natural Science Foundation of China (11374139 and U1431112). Y.Y. and L.B. thank ONR Grant N00014-12-1-1034. We also acknowledge a challenge and a DURIP grants from DoD allowing us the access of supercomputers and clusters, respectively. Some computations were also made possible thanks to the MRI grant 0722625, MRI-R2 grant 0959124, and CI-TRAIN grant 0918970 from NSF. Electron Microscopy work carried out at the Center for Functional Nanomaterials and National Synchrotron Light Source, Brookhaven National Laboratory, was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, under Contract No. DE-SC0012704. Shanghai Synchrotron Radiation Facility (China) is acknowledged for providing the beam time and technical assistance for XRD. NR 50 TC 0 Z9 0 U1 16 U2 16 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 27 PY 2016 VL 94 IS 24 AR 241116 DI 10.1103/PhysRevB.94.241116 PG 7 WC Physics, Condensed Matter SC Physics GA EG4KK UT WOS:000391012400002 ER PT J AU Bramante, J Fox, PJ Kribs, GD Martin, A AF Bramante, Joseph Fox, Patrick J. Kribs, Graham D. Martin, Adam TI Inelastic frontier: Discovering dark matter at high recoil energy SO PHYSICAL REVIEW D LA English DT Article ID NEUTRALINO AB There exist well-motivated models of particle dark matter which predominantly scatter inelastically off nuclei in direct detection experiments. This inelastic transition causes the dark matter to upscatter in terrestrial experiments into an excited state up to 550 keV heavier than the dark matter itself. An inelastic transition of this size is highly suppressed by both kinematics and nuclear form factors. In this paper, we extend previous studies of inelastic dark matter to determine the present bounds on the scattering cross section and the prospects for improvements in sensitivity. Three scenarios provide illustrative examples: nearly pure Higgsino supersymmetric dark matter, magnetic inelastic dark matter, and inelastic models with dark photon exchange. We determine the elastic scattering rate (through loop diagrams involving the heavy state) as well as verify that exothermic transitions are negligible (in the parameter space we consider). Presently, the strongest bounds on the cross section are from xenon at LUX-PandaX (when the mass splitting delta less than or similar to 160 keV), iodine at PICO (when 160 less than or similar to delta less than or similar to 300 keV), and tungsten at CRESST (when delta greater than or similar to 300 keV). Amusingly, once delta greater than or similar to 200 keV, weak scale (and larger) dark matter-nucleon scattering cross sections are allowed. The relative competitiveness of these diverse experiments is governed by the upper bound on the recoil energies employed by each experiment, as well as strong sensitivity to the mass of the heaviest element in the detector. Several implications, including sizable recoil energy-dependent annual modulation and improvements for future experiments, are discussed. We show that the xenon experiments can improve on the PICO results, if they were to analyze their existing data over a larger range of recoil energies, i.e., 20-500 keV Intriguingly, CRESST has reported several events in the recoil energy range 45-100 keV that, if interpreted as dark matter scattering, is compatible with delta similar to 200 keV and an approximately weak scale cross section. Future data from PICO and CRESST can test this speculation, while xenon experiments could verify or refute this upon analyzing their higher energy recoil data. C1 [Bramante, Joseph; Martin, Adam] Univ Notre Dame, Dept Phys, 225 Nieuwland Hall, Notre Dame, IN 46556 USA. [Fox, Patrick J.] Fermilab Natl Accelerator Lab, Dept Theoret Phys, Batavia, IL 60510 USA. [Kribs, Graham D.] Univ Oregon, Dept Phys, Eugene, OR 97403 USA. RP Bramante, J (reprint author), Univ Notre Dame, Dept Phys, 225 Nieuwland Hall, Notre Dame, IN 46556 USA. FU Alexander von Humboldt Foundation; U.S. Department of Energy [DE-SC0011640]; National Science Foundation [PHY-1417118]; United States Department of Energy [DE-AC02-07CH11359] FX We thank P. Agrawal, Y. Bai, B. Batell, S. Chang, E. Dahl, A. Delgado, O. Harris, K. Howe, C. Newby, T. Roy, and P. Sorensen for useful discussions. We are also extremely grateful to A. Fitzpatrick and W. Haxton for clarifications of Ref. [54] and for providing us with the latest set of response functions. J. B. thanks Los Alamos National Laboratory (LANL) and the Center for Theoretical Underground Physics (CETUP) for hospitality while this work was completed. P. J. F., G. D. K., and A. M. are grateful to the Mainz Institute for Theoretical Physics (MITP) for its hospitality and its partial support during the completion of this work. P. J. F. thanks the Alexander von Humboldt Foundation for support during the completion of this work. The work of G. D. K. was supported in part by the U.S. Department of Energy under Grant No. DE-SC0011640. The work of A. M. was partially supported by the National Science Foundation under Grant No. PHY-1417118. Fermilab is operated by Fermi Research Alliance, LLC under Contract No. DE-AC02-07CH11359 with the United States Department of Energy. NR 73 TC 1 Z9 1 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 27 PY 2016 VL 94 IS 11 AR 115026 DI 10.1103/PhysRevD.94.115026 PG 19 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EG4LS UT WOS:000391016400011 ER PT J AU Hattori, K Satow, D AF Hattori, Koichi Satow, Daisuke TI Electrical conductivity of quark-gluon plasma in strong magnetic fields SO PHYSICAL REVIEW D LA English DT Article ID HEAVY-ION COLLISIONS; TEMPERATURE; EXCITATIONS; EVENT AB We compute the electrical conductivity of quark-gluon plasma in a strong magnetic field B with quantum field theory at finite temperature using the lowest Landau level approximation. We provide the one-loop result arising from 1-to-2 scattering processes of which the kinematics are satisfied by the (1 + 1)-dimensional fermion dispersion relation. Because of the chirality conservation, the conductivity diverges in the massless limit and is sensitive to the value of the current quark mass. As a result, we find that the conductivity along the direction of the magnetic field is quite large compared with the value at B = 0, mainly because of the small value of the current quark mass. We show that the resummation of the ladder diagrams for the current-current correlator gives rise to only subleading contributions beyond the leading-log order and thus verify our one-loop result at the leading-log accuracy. We also discuss possible implications for the relativistic heavy-ion collisions. C1 [Hattori, Koichi] Fudan Univ, Dept Phys, Shanghai 200433, Peoples R China. [Hattori, Koichi] Fudan Univ, Ctr Particle Phys & Field Theory, Shanghai 200433, Peoples R China. [Hattori, Koichi] Brookhaven Natl Lab, RIKEN BNL Res Ctr, Upton, NY 11973 USA. [Satow, Daisuke] Goethe Univ Frankfurt, Inst Theoret Phys, Max von Laue Str 1, D-60438 Frankfurt, Germany. RP Hattori, K (reprint author), Fudan Univ, Dept Phys, Shanghai 200433, Peoples R China.; Hattori, K (reprint author), Fudan Univ, Ctr Particle Phys & Field Theory, Shanghai 200433, Peoples R China.; Hattori, K (reprint author), Brookhaven Natl Lab, RIKEN BNL Res Ctr, Upton, NY 11973 USA. EM koichi.hattori@riken.jp; dsato@th.physik.uni-frankfurt.de FU Alexander von Humboldt Foundation; China Postdoctoral Science Foundation [2016M590312]; Japan Society for the Promotion of Science [25287066]; RIKEN-BNL Research Center FX D. S. thanks Dirk Rischke and Shi Pu for fruitful discussion. We thank Moritz Greif for providing us with the numerical data for the conductivity evaluated with BAMPS. D. S. is supported by the Alexander von Humboldt Foundation. K. H. is supported by China Postdoctoral Science Foundation under Grant No. 2016M590312 and, at the early stage of this work, by Japan Society for the Promotion of Science Grants-in-Aid, Grant No. 25287066. K. H. is also grateful for support from RIKEN-BNL Research Center. NR 59 TC 0 Z9 0 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 27 PY 2016 VL 94 IS 11 AR 114032 DI 10.1103/PhysRevD.94.114032 PG 16 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EG4LS UT WOS:000391016400005 ER PT J AU Ma, YQ Vogt, R AF Ma, Yan-Qing Vogt, Ramona TI Quarkonium production in an improved color evaporation model SO PHYSICAL REVIEW D LA English DT Article ID HADRONIC PRODUCTION; HEAVY QUARKONIUM; PP COLLISIONS; HADROPRODUCTION; FLAVORS; MESON; TEV AB We propose an improved version of the color evaporation model to describe heavy quarkonium production. In contrast to the traditional color evaporation model, we impose the constraint that the invariant mass of the intermediate heavy quark-antiquark pair be larger than the mass of produced quarkonium. We also introduce a momentum shift between the heavy quark-antiquark pair and the quarkonium. Numerical calculations show that our model can describe the charmonium yields as well as the ratio of psi' over J/psi better than the traditional color evaporation model. C1 [Ma, Yan-Qing] Peking Univ, Sch Phys, Beijing 100871, Peoples R China. [Ma, Yan-Qing] Peking Univ, State Key Lab Nucl Phys & Technol, Beijing 100871, Peoples R China. [Ma, Yan-Qing] Peking Univ, Ctr High Energy Phys, Beijing 100871, Peoples R China. [Ma, Yan-Qing] Collaborat Innovat Ctr Quantum Matter, Beijing 100871, Peoples R China. [Vogt, Ramona] Lawrence Livermore Natl Lab, Nucl & Chem Sci Div, Livermore, CA 94551 USA. [Vogt, Ramona] Univ Calif Davis, Dept Phys, Davis, CA 95616 USA. RP Ma, YQ (reprint author), Peking Univ, Sch Phys, Beijing 100871, Peoples R China.; Ma, YQ (reprint author), Peking Univ, State Key Lab Nucl Phys & Technol, Beijing 100871, Peoples R China.; Ma, YQ (reprint author), Peking Univ, Ctr High Energy Phys, Beijing 100871, Peoples R China.; Ma, YQ (reprint author), Collaborat Innovat Ctr Quantum Matter, Beijing 100871, Peoples R China. EM yqma@pku.edu.cn; rlvogt@lbl.gov FU U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344]; U.S. Department of Energy, Office of Science, Office of Nuclear Physics (Nuclear Theory) [DE-SC-0004014] FX We thank Kuang-Ta Chao, Raju Venugopalan and Hong-Fei Zhang for useful discussions. The work of R. V. was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract No. DE-AC52-07NA27344 and supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics (Nuclear Theory) under Contract No. DE-SC-0004014. NR 29 TC 0 Z9 0 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 27 PY 2016 VL 94 IS 11 AR 114029 DI 10.1103/PhysRevD.94.114029 PG 6 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EG4LS UT WOS:000391016400002 ER PT J AU Ben Guerrero, E Soria, M Salvador, R Ceja-Navarro, JA Campos, E Brodie, EL Talia, P AF Ben Guerrero, Emiliano Soria, Marcelo Salvador, Ricardo Ceja-Navarro, Javier A. Campos, Eleonora Brodie, Eoin L. Talia, Paola TI Effect of Different Lignocellulosic Diets on Bacterial Microbiota and Hydrolytic Enzyme Activities in the Gut of the Cotton Boll Weevil (Anthonomus grandis) SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE Anthonomus grandis; gut microbiota; 16S rRNA gene; illumina amplicon sequencing; hydrolytic activities; lignocellulosic feedstocks ID CELLULASE-PRODUCING BACTERIA; COMMUNITY STRUCTURE; COLEOPTERA-CURCULIONIDAE; CELLULOMONAS-FLAVIGENA; CDNA CLONING; CELLULOLYTIC BACTERIA; DEGRADING BACTERIA; APRIONA-GERMARI; EXPRESSION; DIVERSITY AB Cotton boll weevils, Anthonomus grandis, are omnivorous coleopteran that can feed on diets with different compositions, including recalcitrant lignocellulosic materials. We characterized the changes in the prokaryotic community structure and the hydrolytic activities of A. grandis larvae fed on different lignocellulosic diets. A. grandis larvae were fed on three different artificial diets: cottonseed meal (CM), Napier grass (NG) and corn stover (CS). Total DNA was extracted from the gut samples for amplification and sequencing of the V3-V4 hypervariable region of the 16S rRNA gene. Proteobacteria and Firmicutes dominated the gut microbiota followed by Actinobacteria, Spirochaetes and a small number of unclassified phyla in CM and NG microbiomes. In the CS feeding group, members of Spirochaetes were the most prevalent, followed by Proteobacteria and Firmicutes. BrayCurtis distances showed that the samples from the CS community were clearly separated from those samples of the CM and NG diets. Gut extracts from all three diets exhibited endoglucanase, xylanase, beta-glucosidase and pectinase activities. These activities were significantly affected by pH and temperature across different diets. We observed that the larvae reared on a CM showed significantly higher activities than larvae reared on NG and CS. We demonstrated that the intestinal bacterial community structure varies depending on diet composition. Diets with more variable and complex compositions, such as CS, showed higher bacterial diversity and richness than the two other diets. In spite of the detected changes in composition and diversity, we identified a core microbiome shared between the three different lignocellulosic diets. These results suggest that feeding with diets of different lignocellulosic composition could be a viable strategy to discover variants of hemicellulose and cellulose breakdown systems. C1 [Ben Guerrero, Emiliano; Campos, Eleonora; Talia, Paola] Inst Nacl Technol Agr Castelar, Ctr Natl Invest Agr, Ctr Invest Ciencias Vet & Agron, Inst Biotechnol, Hurlingham, Argentina. [Soria, Marcelo] Univ Buenos Aires, Fac Agron, Inst Invest Biociencias Agr & Ambientales, Catedra Microbiol Agr,CONICET, Buenos Aires, DF, Argentina. [Salvador, Ricardo] Inst Nacl Technol Agr Castelar, Ctr Nacl Invest Agr, Ctr Invest Ciencias Vet & Agron, Inst Microbiol & Zool Agr, Hurlingham, Argentina. [Ceja-Navarro, Javier A.; Brodie, Eoin L.] Lawrence Berkeley Natl Lab, Earth & Environm Sci, Berkeley, CA USA. [Campos, Eleonora; Talia, Paola] Consejo Nacl Invest Cient & Tecn, Buenos Aires, DF, Argentina. RP Talia, P (reprint author), Inst Nacl Technol Agr Castelar, Ctr Natl Invest Agr, Ctr Invest Ciencias Vet & Agron, Inst Biotechnol, Hurlingham, Argentina.; Talia, P (reprint author), Consejo Nacl Invest Cient & Tecn, Buenos Aires, DF, Argentina. EM talia.paola@inta.gob.ar RI Ceja-Navarro, Javier/A-1731-2013 OI Ceja-Navarro, Javier/0000-0002-2954-3477 FU Instituto Nacional de Tecnologia Agropecuaria (INTA) [PNAIyAV-1130034]; Agencia Nacional de Promocion Cientifica y Tecnologica (ANPCyT) Proyecto de Investigacion Cientifica y Tecnologica (PICT), (Argentina) [1454] FX This work was supported by grants from the Instituto Nacional de Tecnologia Agropecuaria (INTA) (PNAIyAV-1130034), Agencia Nacional de Promocion Cientifica y Tecnologica (ANPCyT) Proyecto de Investigacion Cientifica y Tecnologica (PICT) 2013 No. 1454 (Argentina). NR 98 TC 0 Z9 0 U1 7 U2 7 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 27 PY 2016 VL 7 AR 2093 DI 10.3389/fmicb.2016.02093 PG 13 WC Microbiology SC Microbiology GA EF9QG UT WOS:000390664100002 PM 28082962 ER PT J AU Daiquigan, N Grim, CJ White, JR Hanes, DE Jarvis, KG AF Daiquigan, Ninalynn Grim, Christopher J. White, James R. Hanes, Darcy E. Jarvis, Karen G. TI Early Recovery of Salmonella from Food Using a 6-Hour Non-selective Pre-enrichment and Reformulation of Tetrathionate Broth SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE Salmonella; FDA BAM; metagenomics; 16S rRNA; selective enrichment; tetrathionate broth ID ENRICHMENT CONDITIONS; SELECTIVE ENRICHMENT; RIBOSOMAL-RNA; MEDIA; SENSITIVITY; MICROBIOME; SEQUENCES; ALIGNMENT; PRODUCTS; OUTBREAK AB Culture based methods are commonly employed to detect pathogens in food and environmental samples. These methods are time consuming and complex, requiring multiple non-selective and selective enrichment broths, and usually take at least 1 week to recover and identify pathogens. Improving pathogen detection in foods is a primary goal for regulatory agencies and industry. Salmonella detection in food relies on a series of culture steps in broth formulations optimized to resuscitate Salmonella and reduce the abundance of competitive bacteria. Examples of non-selective pre-enrichment broths used to isolate Salmonella from food include Lactose, Universal Pre-enrichment, BPW, and Trypticase Soy broths. Tetrathionate (TT) and Rappaport-Vassiliadis (RV) broths are employed after a 24-h non-selective enrichment to select for Salmonella and hamper the growth of competitive bacteria. In this study, we tested a new formulation of TT broth that lacks brilliant green dye and has lower levels of TT . We employed this TT broth formulation in conjunction with a 6-h non-selective pre-enrichment period and determined that Salmonella recovery was possible one day earlier than standard food culture methods. We tested the shortened culture method in different non-selective enrichment broths, enumerated Salmonella in the non-selective enrichments, and used 16S rRNA gene sequencing to determine the proportional abundances of Salmonella in the TT and RV selective enrichments. Together these data revealed that a 6-h non-selective pre-enrichment reduces the levels of competitive bacteria inoculated into the selective TT and RV broths, enabling the recovery of Salmonella 1 day earlier than standard culture enrichment methods. C1 [Daiquigan, Ninalynn; Grim, Christopher J.; Hanes, Darcy E.; Jarvis, Karen G.] US FDA, Off Appl Res & Safety Assessment, Ctr Food Safety & Appl Nutr, Laurel, MD 20740 USA. [Daiquigan, Ninalynn] Oak Ridge Inst Sci & Technol, Oak Ridge, TN USA. [White, James R.] Resphera Biosci, Baltimore, MD USA. RP Jarvis, KG (reprint author), US FDA, Off Appl Res & Safety Assessment, Ctr Food Safety & Appl Nutr, Laurel, MD 20740 USA. EM karen.jarvis@fda.hhs.gov FU United States Food and Drug Administration; Oak Ridge Institute for Science and Education FX The work was funded by the United States Food and Drug Administration and the Oak Ridge Institute for Science and Education. NR 49 TC 0 Z9 0 U1 10 U2 10 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 27 PY 2016 VL 7 AR 2103 DI 10.3389/fmicb.2016.02103 PG 12 WC Microbiology SC Microbiology GA EF9QL UT WOS:000390664600001 ER PT J AU Xu, YT Petrik, NG Smith, S Kay, BD Kimmel, GA AF Xu, Yuntao Petrik, Nikolay G. Smith, Scott Kay, Bruce D. Kimmel, Greg A. TI Growth rate of crystalline ice and the diffusivity of supercooled water from 126 to 262 K SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE supercooled water; self-diffusion; crystallization kinetics; dynamic crossover ID AMORPHOUS SOLID WATER; LIQUID-LIQUID TRANSITION; STOKES-EINSTEIN RELATION; SELF-DIFFUSION; TEMPERATURE-DEPENDENCE; GLASS-TRANSITION; MOLECULAR-BEAMS; LIMITED GROWTH; NO CRITICALITY; WIDOM LINE AB Understanding deeply supercooled water is key to unraveling many of water's anomalous properties. However, developing this understanding has proven difficult due to rapid and uncontrolled crystallization. Using a pulsed-laser-heating technique, we measure the growth rate of crystalline ice, G(T), for 180 K < T < 262 K, that is, deep within water's "no man's land" in ultrahigh-vacuum conditions. Isothermal measurements of G(T) are also made for 126 K <= T <= 151 K. The self-diffusion of supercooled liquid water, D(T), is obtained from G(T) using the Wilson-Frenkel model of crystal growth. For T > 237 K and P similar to 10(-8) Pa, G(T) and D(T) have super-Arrhenius ("fragile") temperature dependences, but both cross over to Arrhenius ("strong") behavior with a large activation energy in no man's land. The fact that G(T) and D(T) are smoothly varying rules out the hypothesis that liquid water's properties have a singularity at or near 228 K at ambient pressures. However, the results are consistent with a previous prediction for D(T) that assumed no thermodynamic transitions occur in no man's land. C1 [Xu, Yuntao; Petrik, Nikolay G.; Smith, Scott; Kay, Bruce D.; Kimmel, Greg A.] Pacific Northwest Natl Lab, Phys & Computat Sci Directorate, Div Phys Sci, Chem Phys & Anal, Richland, WA 99352 USA. RP Kay, BD; Kimmel, GA (reprint author), Pacific Northwest Natl Lab, Phys & Computat Sci Directorate, Div Phys Sci, Chem Phys & Anal, Richland, WA 99352 USA. EM bruce.kay@pnnl.gov; gregory.kimmel@pnnl.gov RI Xu, Yuntao/G-1896-2015; Petrik, Nikolay/G-3267-2015; OI Petrik, Nikolay/0000-0001-7129-0752; Kimmel, Greg/0000-0003-4447-2440 FU US Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences; Department of Energy's Office of Biological and Environmental Research FX This work was supported by the US Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences. Pacific Northwest National Laboratory (PNNL) is a multiprogram national laboratory operated for Department of Energy by Battelle. The research was performed using Environmental Molecular Sciences Laboratory, a national scientific user facility sponsored by the Department of Energy's Office of Biological and Environmental Research and located at PNNL. NR 82 TC 2 Z9 2 U1 32 U2 32 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 27 PY 2016 VL 113 IS 52 BP 14921 EP 14925 DI 10.1073/pnas.1611395114 PG 5 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG5NL UT WOS:000391090800027 PM 27956609 ER PT J AU Mills, JH Sheffler, W Ener, ME Almhjell, PJ Oberdorfer, G Pereira, JH Parmeggiani, F Sankaran, B Zwart, PH Baker, D AF Mills, Jeremy H. Sheffler, William Ener, Maraia E. Almhjell, Patrick J. Oberdorfer, Gustav Pereira, Jose Henrique Parmeggiani, Fabio Sankaran, Banumathi Zwart, Peter H. Baker, David TI Computational design of a homotrimeric metalloprotein with a trisbipyridyl core SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE computational protein design; noncanonical amino acids; metalloproteins; protein self-assembly ID AMINO-ACID; BUNDLE PROTEIN; COMPLEXES; PHENIX; REFINEMENT; SOFTWARE; IRON(II); LIGAND AB Metal-chelating heteroaryl small molecules have found widespread use as building blocks for coordination-driven, self-assembling nanostructures. The metal-chelating noncanonical amino acid (2,2'-bipyridin-5yl) alanine (Bpy-ala) could, in principle, be used to nucleate specific metalloprotein assemblies if introduced into proteins such that one assembly had much lower free energy than all alternatives. Here we describe the use of the Rosetta computational methodology to design a self-assembling homotrimeric protein with [Fe (Bpy-ala)(3)](2+) complexes at the interface between monomers. X-ray crystallographic analysis of the homotrimer showed that the design process had near-atomic-level accuracy: The all-atom rmsd between the design model and crystal structure for the residues at the protein interface is similar to 1.4 angstrom. These results demonstrate that computational protein design together with genetically encoded noncanonical amino acids can be used to drive formation of precisely specified metal-mediated protein assemblies that could find use in a wide range of photophysical applications. C1 [Mills, Jeremy H.; Sheffler, William; Ener, Maraia E.; Oberdorfer, Gustav; Parmeggiani, Fabio; Baker, David] Univ Washington, Dept Biochem, Seattle, WA 98195 USA. [Mills, Jeremy H.; Sheffler, William; Ener, Maraia E.; Oberdorfer, Gustav; Parmeggiani, Fabio; Baker, David] Univ Washington, Inst Prot Design, Seattle, WA 98195 USA. [Mills, Jeremy H.; Almhjell, Patrick J.] Arizona State Univ, Sch Mol Sci, Tempe, AZ 85281 USA. [Mills, Jeremy H.; Almhjell, Patrick J.] Arizona State Univ, Biodesign Ctr Mol Design & Biomimet, Tempe, AZ 85281 USA. [Ener, Maraia E.] Univ Washington, Dept Chem, Seattle, WA 98195 USA. [Pereira, Jose Henrique] Joint BioEnergy Inst, Emeryville, CA 94608 USA. [Sankaran, Banumathi; Zwart, Peter H.] Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Bioimaging, Berkeley Ctr Struct Biol, Berkeley, CA 94720 USA. [Baker, David] Univ Washington, Howard Hughes Med Inst, Seattle, WA 98195 USA. RP Baker, D (reprint author), Univ Washington, Howard Hughes Med Inst, Seattle, WA 98195 USA. EM dabaker@uw.edu RI Parmeggiani, Fabio/B-9344-2016 OI Parmeggiani, Fabio/0000-0001-8548-1090 FU Office of Naval Research DURIP Grant [N00014-14-1-0757]; National Institutes of Health, National Institute of General Medical Sciences; Howard Hughes Medical Institute; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231]; National Institute of General Medical Science of the National Institutes of Health [F32GM099210]; Defense Threat Reduction Agency [HDTRA1-11-1-0041]; ACS Irving S. Sigal Postdoctoral Fellowship; Swiss National Science Foundation [PBZHP3-125470, LT000070/2009]; Marie Curie International Outgoing Fellowship (ASR-CompEnzDes FP7-People-IOF) [332094] FX We thank Peter Schultz for the generous gift of the pEVOL-BpyRS plasmid; Neil P. King for helpful discussions; Prof. Cody Schlenker (Office of Naval Research DURIP Grant N00014-14-1-0757) for access to the ultrafast TA laser system; Tim Pollock for experimental assistance; and Gwyneth Gordon and Trevor Martin for assistance with ICP-MS analysis. The Berkeley Center for Structural Biology is supported in part by the National Institutes of Health, National Institute of General Medical Sciences, and the Howard Hughes Medical Institute. The Advanced Light Source is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy Contract DE-AC02-05CH11231. J.H.M. was supported by the National Institute of General Medical Science of the National Institutes of Health Award F32GM099210. D.B. and J.H.M. were supported by Defense Threat Reduction Agency Award HDTRA1-11-1-0041. M.E.E. was supported by the ACS Irving S. Sigal Postdoctoral Fellowship. F.P. was the recipient of Swiss National Science Foundation Postdoc Fellowship PBZHP3-125470 and Human Frontier Science Program Long-Term Fellowship LT000070/2009-L. G. O. is a Marie Curie International Outgoing Fellowship fellow (332094 ASR-CompEnzDes FP7-People-2012-IOF). NR 33 TC 0 Z9 0 U1 5 U2 5 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 27 PY 2016 VL 113 IS 52 BP 15012 EP 15017 DI 10.1073/pnas.1600188113 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG5NL UT WOS:000391090800043 PM 27940918 ER PT J AU Lastovetsky, OA Gaspar, ML Mondo, SJ LaButti, KM Sandor, L Grigoriev, IV Henry, SA Pawlowska, TE AF Lastovetsky, Olga A. Gaspar, Maria L. Mondo, Stephen J. LaButti, Kurt M. Sandor, Laura Grigoriev, Igor V. Henry, Susan A. Pawlowska, Teresa E. TI Lipid metabolic changes in an early divergent fungus govern the establishment of a mutualistic symbiosis with endobacteria SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE mutualism evolution; antagonism; Mucoromycotina; oleaginous fungi; Rhizopus-Burkholderia symbiosis ID YEAST SACCHAROMYCES-CEREVISIAE; DIACYLGLYCEROL KINASE; PHOSPHOLIPASE-D; PHOSPHATIDYLETHANOLAMINE; MEMBRANE; IDENTIFICATION; ACTIVATION; PHYLOGENY; BACTERIA; HOST AB The recent accumulation of newly discovered fungal-bacterial mutualisms challenges the paradigm that fungi and bacteria are natural antagonists. To understand the mechanisms that govern the establishment and maintenance over evolutionary time of mutualisms between fungi and bacteria, we studied a symbiosis of the fungus Rhizopus microsporus (Mucoromycotina) and its Burkholderia endobacteria. We found that nonhost R. microsporus, as well as other mucoralean fungi, interact antagonistically with endobacteria derived from the host and are not invaded by them. Comparison of gene expression profiles of host and nonhost fungi during interaction with endobacteria revealed dramatic changes in expression of lipid metabolic genes in the host. Analysis of the host lipidome confirmed that symbiosis establishment was accompanied by specific changes in the fungal lipid profile. Diacylglycerol kinase (DGK) activity was important for these lipid metabolic changes, as its inhibition altered the fungal lipid profile and caused a shift in the host-bacterial interaction into an antagonism. We conclude that adjustments in host lipid metabolism during symbiosis establishment, mediated by DGKs, are required for the mutualistic outcome of the Rhizopus-Burkholderia symbiosis. In addition, the neutral and phospholipid profiles of R. microsporus provide important insights into lipid metabolism in an understudied group of oleaginous Mucoromycotina. Lastly, our study revealed that the DGKs involved in the symbiosis form a previously uncharacterized clade of DGK domain proteins. C1 [Lastovetsky, Olga A.] Cornell Univ, Grad Field Microbiol, Ithaca, NY 14853 USA. [Gaspar, Maria L.; Henry, Susan A.] Cornell Univ, Dept Mol Biol & Genet, Ithaca, NY 14853 USA. [Mondo, Stephen J.; LaButti, Kurt M.; Sandor, Laura; Grigoriev, Igor V.] US DOE, Joint Genome Inst, Walnut Creek, CA 94598 USA. [Pawlowska, Teresa E.] Cornell Univ, Sch Integrat Plant Sci Plant Pathol & Plant Micro, Ithaca, NY 14853 USA. RP Pawlowska, TE (reprint author), Cornell Univ, Sch Integrat Plant Sci Plant Pathol & Plant Micro, Ithaca, NY 14853 USA. EM tep8@cornell.edu FU National Science Foundation [IOS-1261004]; NIH [GM19629]; US Department of Energy (DOE) Joint Genome Institute (JGI) Community Sequencing Project [1450]; Office of Science of the DOE [DE-AC02-05CH11231] FX We thank N. Schwardt for assistance with cocultivation of M. circinelloides with bacteria; Q. Sun for advice on RNA-seq analyses; F. Vermeylen for help with statistical analyses; A. Collmer and J. Worley for the gift of the pBS46:YFP plasmid; and A. Griganskyi and T. James for permission to analyze unpublished genomes of Backusella circina Jena Microbial Resource Collection (FSU) 941, Lichtheimia hyalospora FSU 10163, Linderina pennispora ATCC 12442, and Martensiomyces pterosporus CBS 209.56. This work was supported by National Science Foundation Grant IOS-1261004 (to T.E.P.) and NIH Grant GM19629 (to S.A.H.). Genomes of R. microsporus ATCC 52814 and ATCC 11559 were sequenced within the framework of the US Department of Energy (DOE) Joint Genome Institute (JGI) Community Sequencing Project Proposal ID 1450. The work conducted by the DOE JGI was supported by the Office of Science of the DOE under Contract DE-AC02-05CH11231. NR 34 TC 0 Z9 0 U1 8 U2 8 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 27 PY 2016 VL 113 IS 52 BP 15102 EP 15107 DI 10.1073/pnas.1615148113 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG5NL UT WOS:000391090800058 PM 27956601 ER PT J AU Alessi, DA Rosso, PA Nguyen, HT Aasen, MD Britten, JA Haefner, C AF Alessi, David A. Rosso, Paul A. Nguyen, Hoang T. Aasen, Michael D. Britten, Jerald A. Haefner, Constantin TI Active cooling of pulse compression diffraction gratings for high energy, high average power ultrafast lasers SO OPTICS EXPRESS LA English DT Article ID SYSTEMS AB Laser energy absorption and subsequent heat removal from diffraction gratings in chirped pulse compressors poses a significant challenge in high repetition rate, high peak power laser development. In order to understand the average power limitations, we have modeled the time-resolved thermo-mechanical properties of current and advanced diffraction gratings. We have also developed and demonstrated a technique of actively cooling Petawatt scale, gold compressor gratings to operate at 600W of average power-a 15x increase over the highest average power petawatt laser currently in operation. Combining this technique with low absorption multilayer dielectric gratings developed in our group would enable pulse compressors for petawatt peak power lasers operating at average powers well above 40kW. C1 [Alessi, David A.; Rosso, Paul A.; Nguyen, Hoang T.; Aasen, Michael D.; Britten, Jerald A.; Haefner, Constantin] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. RP Alessi, DA (reprint author), Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. EM alessi2@llnl.gov FU U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344] FX This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. NR 15 TC 0 Z9 0 U1 3 U2 3 PU OPTICAL SOC AMER PI WASHINGTON PA 2010 MASSACHUSETTS AVE NW, WASHINGTON, DC 20036 USA SN 1094-4087 J9 OPT EXPRESS JI Opt. Express PD DEC 26 PY 2016 VL 24 IS 26 BP 30015 EP 30023 DI 10.1364/OE.24.030015 PG 9 WC Optics SC Optics GA EG1RE UT WOS:000390809100074 PM 28059386 ER PT J AU Kadlec, EA Olson, BV Goldflam, MD Kim, JK Klem, JF Hawkins, SD Coon, WT Cavaliere, MA Tauke-Pedretti, A Fortune, TR Harris, CT Shaner, EA AF Kadlec, E. A. Olson, B. V. Goldflam, M. D. Kim, J. K. Klem, J. F. Hawkins, S. D. Coon, W. T. Cavaliere, M. A. Tauke-Pedretti, A. Fortune, T. R. Harris, C. T. Shaner, E. A. TI Effects of electron doping level on minority carrier lifetimes in n-type mid-wave infrared InAs/InAs1-xSbx type-II superlattices SO APPLIED PHYSICS LETTERS LA English DT Article ID PERFORMANCE; HGCDTE AB The minority carrier lifetime (tau(MC)) and equilibrium electron concentration (i.e., the doping level, n(0)) are both important values that directly determine diffusion current in infrared photodetectors utilizing n-type absorbing regions. Here, time-resolved microwave reflectance measurements are used to non-destructively measure both of these values in mid-wave infrared InAs/InAs1-xSbx type-II superlattices with varying n-type doping levels between 2 x 10(14) cm(-3) and 2 x 10(16) cm(-3). The measured data are analyzed using carrier recombination theory to determine the doping level ranges where Shockley-Read-Hall (SRH), radiative, and Auger recombination limit tau(MC). The optimal doping level, which minimizes dark current, is experimentally determined and corresponds to the electron density at which tau(MC) switches from SRH limited to Auger limited behavior. A comparison of two InAs/InAs1-xSbx photodetectors of different equilibrium electron densities demonstrates a decrease in dark current for a doping level near the optimal n(0)tau(MC) product. Published by AIP Publishing. C1 [Kadlec, E. A.; Olson, B. V.; Goldflam, M. D.; Kim, J. K.; Klem, J. F.; Hawkins, S. D.; Coon, W. T.; Cavaliere, M. A.; Tauke-Pedretti, A.; Fortune, T. R.; Harris, C. T.; Shaner, E. A.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. RP Kadlec, EA (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. EM eakadle@sandia.gov OI Olson, Benjamin/0000-0003-1421-2541 FU U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000]; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division FX Sandia National Laboratories is a multi- program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. This work was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. NR 23 TC 0 Z9 0 U1 3 U2 3 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 26 PY 2016 VL 109 IS 26 AR 261105 DI 10.1063/1.4973352 PG 5 WC Physics, Applied SC Physics GA EI9ND UT WOS:000392834000005 ER PT J AU Park, K Kang, S Ravindran, S Min, JW Hwang, HY Jho, YD Lee, YT AF Park, Kwangwook Kang, Seokjin Ravindran, Sooraj Min, Jung-Wook Hwang, Hyeong-Yong Jho, Young-Dahl Lee, Yong Tak TI Robust optical properties of sandwiched lateral composition modulation GaInP structure grown by molecular beam epitaxy SO APPLIED PHYSICS LETTERS LA English DT Article ID SHORT-PERIOD SUPERLATTICES; MULTIPLE-QUANTUM WELLS; TEMPERATURE; PHOTOLUMINESCENCE; EXCITATION AB Double-hetero structure lateral composition modulated (LCM) GaInP and sandwiched LCM GaInP having the same active layer thickness were grown and their optical properties were compared. Sandwiched LCM GaInP showed robust optical properties due to periodic potential nature of the LCM structure, and the periodicity was undistorted even for thickness far beyond the critical layer thickness. A thick LCM GaInP structure with undistorted potential that could preserve the properties of native LCM structure was possible by stacking thin LCM GaInP structures interspaced with strain compensating GaInP layers. The sandwiched structure could be beneficial in realizing the LCM structure embedded high efficiency solar cells. Published by AIP Publishing. C1 [Park, Kwangwook] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Kang, Seokjin; Hwang, Hyeong-Yong; Jho, Young-Dahl; Lee, Yong Tak] Gwangju Inst Sci & Technol, Sch Elect Engn & Comp Sci, Gwangju 61005, South Korea. [Ravindran, Sooraj] Indian Inst Space Sci & Technol, Dept Avion, Trivandrum 695547, Kerala, India. [Min, Jung-Wook] Gwangju Inst Sci & Technol, Dept Phys & Photon Sci, Gwangju 61005, South Korea. RP Park, K (reprint author), Natl Renewable Energy Lab, Golden, CO 80401 USA. EM kwangwook.park@nrel.gov; ytlee@gist.ac.kr OI Park, Kwangwook/0000-0002-4600-4600 FU GIST Research Institute (GRI) FX This work was supported by the GIST Research Institute (GRI) in 2016. NR 20 TC 1 Z9 1 U1 1 U2 1 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 26 PY 2016 VL 109 IS 26 AR 262103 DI 10.1063/1.4973298 PG 5 WC Physics, Applied SC Physics GA EI9ND UT WOS:000392834000019 ER PT J AU Feuermann, M Gaudet, P Mi, HY Lewis, SE Thomas, PD AF Feuermann, Marc Gaudet, Pascale Mi, Huaiyu Lewis, Suzanna E. Thomas, Paul D. TI Large-scale inference of gene function through phylogenetic annotation of Gene Ontology terms: case study of the apoptosis and autophagy cellular processes SO DATABASE-THE JOURNAL OF BIOLOGICAL DATABASES AND CURATION LA English DT Article ID ENDOPLASMIC-RETICULUM; SELECTIVE AUTOPHAGY; MITOCHONDRIA; MITOPHAGY; MEMBRANE; PROTEINS; CONTEXT; DEATH; TREES; TOOL AB We previously reported a paradigm for large-scale phylogenomic analysis of gene families that takes advantage of the large corpus of experimentally supported Gene Ontology (GO) annotations. This 'GO Phylogenetic Annotation' approach integrates GO annotations from evolutionarily related genes across similar to 100 different organisms in the context of a gene family tree, in which curators build an explicit model of the evolution of gene functions. GO Phylogenetic Annotation models the gain and loss of functions in a gene family tree, which is used to infer the functions of uncharacterized (or incompletely characterized) gene products, even for human proteins that are relatively well studied. Here, we report our results from applying this paradigm to two well-characterized cellular processes, apoptosis and autophagy. This revealed several important observations with respect to GO annotations and how they can be used for function inference. Notably, we applied only a small fraction of the experimentally supported GO annotations to infer function in other family members. The majority of other annotations describe indirect effects, phenotypes or results from high throughput experiments. In addition, we show here how feedback from phylogenetic annotation leads to significant improvements in the PANTHER trees, the GO annotations and GO itself. Thus GO phylogenetic annotation both increases the quantity and improves the accuracy of the GO annotations provided to the research community. We expect these phylogenetically based annotations to be of broad use in gene enrichment analysis as well as other applications of GO annotations. C1 [Feuermann, Marc] Ctr Med Univ Geneva, SIB Swiss Inst Bioinformat, Swiss Prot Grp, 1 Rue Michel Servet, CH-1211 Geneva 4, Switzerland. [Gaudet, Pascale] Ctr Med Univ Geneva, SIB Swiss Inst Bioinformat, CALIPHO Grp, 1 Rue Michel Servet, CH-1211 Geneva 4, Switzerland. [Mi, Huaiyu; Thomas, Paul D.] Univ Southern Calif, Keck Sch Med, Dept Prevent Med, Div Bioinformat, Los Angeles, CA USA. [Lewis, Suzanna E.] Lawrence Berkeley Natl Lab, Genom Div, Berkeley, CA USA. RP Gaudet, P (reprint author), Ctr Med Univ Geneva, SIB Swiss Inst Bioinformat, CALIPHO Grp, 1 Rue Michel Servet, CH-1211 Geneva 4, Switzerland.; Thomas, PD (reprint author), Univ Southern Calif, Keck Sch Med, Dept Prevent Med, Div Bioinformat, Los Angeles, CA USA. EM pascale.gaudet@isb-sib.ch; pdthomas@med.usc.edu OI Feuermann, Marc/0000-0002-4187-2863 FU National Institutes of Health/National Human Genome Research Institute [HG002273] FX National Institutes of Health/National Human Genome Research Institute grant [HG002273]. NR 39 TC 0 Z9 0 U1 5 U2 5 PU OXFORD UNIV PRESS PI OXFORD PA GREAT CLARENDON ST, OXFORD OX2 6DP, ENGLAND SN 1758-0463 J9 DATABASE-OXFORD JI Database PD DEC 26 PY 2016 AR baw155 DI 10.1093/database/baw155 PG 11 WC Mathematical & Computational Biology SC Mathematical & Computational Biology GA EH0YV UT WOS:000391491300001 ER PT J AU Chen, J Hofmockel, KS Hobbie, EA AF Chen, Janet Hofmockel, Kirsten S. Hobbie, Erik A. TI Isotopic Analysis of Sporocarp Protein and Structural Material Improves Resolution of Fungal Carbon Sources SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE organic nitrogen use; C-13; N-15; ectomycorrhizal fungi; saprotrophic fungi; carbon uptake ID ECTOMYCORRHIZAL FUNGI; MYCORRHIZAL FUNGI; NATURAL C-13; PINE FOREST; NITROGEN; ABUNDANCE; PATTERNS; N-15; PLANTS; CO2 AB Fungal acquisition of resources is difficult to assess in the field. To determine whether fungi received carbon from recent plant photosynthate, litter or soil-derived organic (C:N bonded) nitrogen, we examined differences in delta C-13 among bulk tissue, structural carbon, and protein extracts of sporocarps of three fungal types: saprotrophic fungi, fungi with hydrophobic ectomycorrhizae, or fungi with hydrophilic ectomycorrhizae. Sporocarps were collected from experimental plots of the Duke Free-air CO2 enrichment experiment during and after CO2 enrichment. The differential C-13 labeling of ecosystem pools in CO2 enrichment experiments was tracked into fungi and provided novel insights into organic nitrogen use. Specifically, sporocarp delta C-13 as well as delta N-15 of protein and structural material indicated that fungi with hydrophobic ectomycorrhizae used soil-derived organic nitrogen sources for protein carbon, fungi with hydrophilic ectomycorrhizae used recent plant photosynthates for protein carbon and both fungal groups used photosynthates for structural carbon. Saprotrophic fungi depended on litter produced during fumigation for both protein and structural material. C1 [Chen, Janet; Hobbie, Erik A.] Univ New Hampshire, Earth Syst Res Ctr, Earth Oceans & Space, Durham, NH 03824 USA. [Chen, Janet] FAO IAEA Agr & Biotechnol Labs, Soil & Water Management & Crop Nutr Lab, Seibersdorf, Austria. [Hofmockel, Kirsten S.] Iowa State Univ, Dept Ecol Evolut & Organismal Biol, Ames, IA USA. [Hofmockel, Kirsten S.] Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA USA. [Hofmockel, Kirsten S.] Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA USA. RP Chen, J (reprint author), Univ New Hampshire, Earth Syst Res Ctr, Earth Oceans & Space, Durham, NH 03824 USA.; Chen, J (reprint author), FAO IAEA Agr & Biotechnol Labs, Soil & Water Management & Crop Nutr Lab, Seibersdorf, Austria. EM Janet.chen@unh.edu FU US National Science Foundation (NSF) [DEB-1146328]; US Department of Energy [ER65430]; Office of Science (BER), US Department of Energy [DE-FG02-95ER62083] FX This work was supported by grant DEB-1146328 from the US National Science Foundation (NSF) and grant ER65430 from the US Department of Energy. Core funding for the Duke FACE site was provided by the Office of Science (BER), US Department of Energy, grant no. DE-FG02-95ER62083. NR 36 TC 0 Z9 0 U1 6 U2 6 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 26 PY 2016 VL 7 AR 1994 DI 10.3389/fmicb.2016.01994 PG 10 WC Microbiology SC Microbiology GA EF9OZ UT WOS:000390660800001 PM 28082951 ER PT J AU Lance, MJ Haynes, JA Pint, BA AF Lance, M. J. Haynes, J. A. Pint, B. A. TI The effects of temperature and substrate curvature on TBC lifetime and residual stress in alumina scales beneath APS YSZ SO SURFACE & COATINGS TECHNOLOGY LA English DT Article; Proceedings Paper CT 43rd International Conference on Metallurgical Coatings and Thin Films (ICMCTF) CY APR 25-29, 2016 CL San Diego, CA SP Amer Vacuum Soc, Adv Surface Engn Div DE Photo-stimulated luminescence piezospectroscopy (PLPS); Furnace cycle testing (FCT); Bond coating; Alumina scale; TBC; Directionally-solidified superalloy ID NICOCRALYHFSI BOND COATINGS; WATER-VAPOR; OXIDATION BEHAVIOR; ALLOYS; ROUGHNESS; ELEMENTS; SYSTEMS AB In order to assess the role of temperature on the lifetime of thermal barrier coatings (TBCs) and the development of residual stresses in Al2O3 scales grown under yttria-stabilized zirconia (YSZ) top coatings, two vacuum plasma sprayed (VPS) NiCoCrAIYHf bond coating (BC) compositions, with and without Si, were deposited on Hf-rich directionally-solidified (DS) 247 substrates and then coated with air plasma sprayed (APS) YSZ. Samples were thermally-cycled at temperatures ranging from 1075 to 1150 degrees C with 1-h cycles in air with 10% H2O. Photo stimulated luminescence spectroscopy (PSLS) was used to map residual stresses in the Al2O3 scale at the YSZ/BC interface from the same region at regular cycling intervals. All samples exhibited similar stress distributions after 100 1-h cycles with the exception of the YHfSi BC cycled at 1150 degrees C which had a lower average compressive stress with more delaminations. This specimen also had the shortest TBC lifetime which shows that the PSLS measurements correlate well to interfacial damage accumulation in TBCs. The presence of Si had no effect on life-time or residual stress but was found to reduce the amount of internal oxidation. The effect of sample curvature on the interfacial stress and TBC lifetime was also assessed by comparing TBC-coated rod specimens to flat buttons. Rod specimens failed much earlier than flat specimens and had lower Al2O3 residual stress. (C) 2016 Elsevier B.V. All rights reserved. C1 [Lance, M. J.; Haynes, J. A.; Pint, B. A.] Oak Ridge Natl Lab, Div Mat Sci & Technol, 1 Bethel Valley Rd, Oak Ridge, TN 37831 USA. RP Lance, MJ (reprint author), Oak Ridge Natl Lab, Div Mat Sci & Technol, 1 Bethel Valley Rd, Oak Ridge, TN 37831 USA. EM lancem@ornl.gov NR 22 TC 0 Z9 0 U1 16 U2 16 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0257-8972 J9 SURF COAT TECH JI Surf. Coat. Technol. PD DEC 25 PY 2016 VL 308 BP 19 EP 23 DI 10.1016/j.surfcoat.2016.09.087 PG 5 WC Materials Science, Coatings & Films; Physics, Applied SC Materials Science; Physics GA EF9BF UT WOS:000390625000004 ER PT J AU Semnani, SJ White, JA Borja, RI AF Semnani, Shabnam J. White, Joshua A. Borja, Ronaldo I. TI Thermoplasticity and strain localization in transversely isotropic materials based on anisotropic critical state plasticity SO INTERNATIONAL JOURNAL FOR NUMERICAL AND ANALYTICAL METHODS IN GEOMECHANICS LA English DT Article DE anisotropy; bifurcation; shear band; thermoplasticity; transverse isotropy ID COUPLED DYNAMIC CONDITIONS; SHEAR-BAND LOCALIZATION; HOFFMAN YIELD CRITERION; FINITE-ELEMENT-ANALYSIS; SATURATED CLAYS; THERMOMECHANICAL MODEL; MATHEMATICAL FRAMEWORK; CONSTITUTIVE MODEL; NUMERICAL-ANALYSIS; DEFORMATION BANDS AB Geomaterials such as soils and rocks are inherently anisotropic and sensitive to temperature changes caused by various internal and external processes. They are also susceptible to strain localization in the form of shear bands when subjected to critical loads. We present a thermoplastic framework for modeling coupled thermomechanical response and for predicting the inception of a shear band in a transversely isotropic material using the general framework of critical state plasticity and the specific framework of an anisotropic modified Cam-Clay model. The formulation incorporates anisotropy in both elastic and plastic responses under the assumption of infinitesimal deformation. The model is first calibrated using experimental data from triaxial tests to demonstrate its capability in capturing anisotropy in the mechanical response. Subsequently, stresspoint simulations of strain localization are carried out under two different conditions, namely, isothermal localization and adiabatic localization. The adiabatic formulation investigates the effect of temperature on localization via thermomechanical coupling. Numerical simulations are presented to demonstrate the important role of anisotropy, hardening, and thermal softening on strain localization inception and orientation. Copyright (C) 2016 John Wiley & Sons, Ltd. C1 [Semnani, Shabnam J.; Borja, Ronaldo I.] Stanford Univ, Dept Civil & Environm Engn, Stanford, CA 94305 USA. [White, Joshua A.] Lawrence Livermore Natl Lab, Atmospher Earth & Energy Div, Livermore, CA 94550 USA. RP Borja, RI (reprint author), Stanford Univ, Dept Civil & Environm Engn, Stanford, CA 94305 USA. EM borja@stanford.edu FU U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division [DE-FG02- 03ER15454]; National Science Foundation Graduate Research Fellowship [DGE-114747]; Stanford-Total Enhanced Modeling of Source Rock Project; U.S. Department of Energy, National Nuclear Security Administration [DE-AC52-07NA27344] FX This material is based upon work supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division, under award number DE-FG02- 03ER15454. The first author acknowledges National Science Foundation Graduate Research Fellowship under grant no. DGE-114747. Portions of this work were performed by the first author on a summer internship at Lawrence Livermore National Laboratory, supported by the Stanford-Total Enhanced Modeling of Source Rock Project. LLNL is operated by Lawrence Livermore National Security, LLC, for the U.S. Department of Energy, National Nuclear Security Administration under contract DE-AC52-07NA27344. NR 92 TC 1 Z9 1 U1 7 U2 7 PU WILEY-BLACKWELL PI HOBOKEN PA 111 RIVER ST, HOBOKEN 07030-5774, NJ USA SN 0363-9061 EI 1096-9853 J9 INT J NUMER ANAL MET JI Int. J. Numer. Anal. Methods Geomech. PD DEC 25 PY 2016 VL 40 IS 18 BP 2423 EP 2449 DI 10.1002/nag.2536 PG 27 WC Engineering, Geological; Materials Science, Multidisciplinary; Mechanics SC Engineering; Materials Science; Mechanics GA EB2QY UT WOS:000387208100001 ER PT J AU Kessler, SH Abrecht, DG Clark, RA Schwantes, JM AF Kessler, Sean H. Abrecht, David G. Clark, Richard A. Schwantes, Jon M. TI Vibrational contributions to phase stability in the Mo-Ru system SO JOURNAL OF ALLOYS AND COMPOUNDS LA English DT Article DE Transition metal alloys and compounds; Nuclear reactor materials; Phase diagrams; Phonons; Thermal expansion; Thermodynamic modeling ID TOTAL-ENERGY CALCULATIONS; IRRADIATED OXIDE FUELS; WAVE BASIS-SET; MOLYBDENUM-RUTHENIUM; AB-INITIO; 1ST-PRINCIPLES COMPUTATION; DISORDERED NI3AL; FISSION-PRODUCTS; CHEMICAL-STATE; RH-PD AB Density functional theory using the Perdew-Burke-Ernzerhof functional and the small displacement method was used to calculate the quasiharmonic phonon density of states (DOS) for 69 ordered structures in the Mo-Ru substitutional alloy system to estimate the effect of vibrational contributions to the free energy of formation. These structures were used to determine interaction parameters in the cluster expansion approximation up to triplet sets to incorporate the vibrational contribution into the configurational energy of formation for the randomly mixed system. The free energies calculated using this approximation are shown to resolve lingering disagreement between reported theoretical and experimental results, and the stabilizing effect of vibrational entropy is observed to improve theoretical predictions of the Mo-Ru phase diagram. (C) 2016 Elsevier B.V. All rights reserved. C1 [Kessler, Sean H.; Abrecht, David G.; Clark, Richard A.; Schwantes, Jon M.] Pacific Northwest Natl Lab, Natl Secur Directorate, 902 Battelle Blvd, Richland, WA 99352 USA. RP Kessler, SH (reprint author), Pacific Northwest Natl Lab, Natl Secur Directorate, 902 Battelle Blvd, Richland, WA 99352 USA. EM sean.kessler@pnnl.gov FU Pacific Northwest National Laboratory; Nuclear Process Science Initiative (NPSI); United States Department of Energy [DE-AC06-76RLO-1830] FX This work was funded by Pacific Northwest National Laboratory utilizing Laboratory Directed Research and Development (LDRD) funds with support from the Nuclear Process Science Initiative (NPSI) and was performed using PNNL Institutional Computing (PIC). Pacific Northwest National Laboratory is operated by Battelle Memorial Institute for the United States Department of Energy under contract DE-AC06-76RLO-1830. NR 46 TC 0 Z9 0 U1 17 U2 17 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0925-8388 EI 1873-4669 J9 J ALLOY COMPD JI J. Alloy. Compd. PD DEC 25 PY 2016 VL 689 BP 969 EP 976 DI 10.1016/j.jallcom.2016.08.071 PG 8 WC Chemistry, Physical; Materials Science, Multidisciplinary; Metallurgy & Metallurgical Engineering SC Chemistry; Materials Science; Metallurgy & Metallurgical Engineering GA DX5NH UT WOS:000384427200124 ER PT J AU Datskos, P Polizos, G Cullen, DA Bhandari, M Sharma, J AF Datskos, Panos Polizos, Georgios Cullen, David A. Bhandari, Mahabir Sharma, Jaswinder TI Synthesis of Half-Sphere/Half-Funnel-Shaped Silica Structures by Reagent Localization and the Role of Water in Shape Control SO CHEMISTRY-A EUROPEAN JOURNAL LA English DT Article DE colloidal; localization; rods; shape; silica ID GOLD NANOPARTICLES; GROWTH; RODS; PARTICLES; NANOWIRES; MECHANISM; COLLOIDS; COMPLEX AB Shape control of silica structures is demonstrated by localization of the reagents. A uniform dispersion of reagents provided straight silica rods, whereas localization of the reagents in the emulsion droplet periphery provided a new type of half-sphere/half-funnel structure. The effect of water concentration appeared to be related to the ease of diffusion of the silica precursor inside the emulsion droplet (i.e., the higher the water concentration, the lower the silica precursor diffusion). C1 [Datskos, Panos; Polizos, Georgios; Sharma, Jaswinder] Oak Ridge Natl Lab, Energy & Transportat Sci Div, Nanosyst Separat & Mat Res Grp, 1 Bethel Valley Rd, Oak Ridge, TN 37831 USA. [Cullen, David A.] Oak Ridge Natl Lab, Div Mat Sci & Technol, Oak Ridge, TN 37831 USA. [Bhandari, Mahabir] Oak Ridge Natl Lab, Bldg Technol Res & Integrat Ctr, Oak Ridge, TN 37831 USA. RP Sharma, J (reprint author), Oak Ridge Natl Lab, Energy & Transportat Sci Div, Nanosyst Separat & Mat Res Grp, 1 Bethel Valley Rd, Oak Ridge, TN 37831 USA. EM sharmajk@ornl.gov OI Cullen, David/0000-0002-2593-7866 FU Building Technologies Office of US Department of Energy [1027-1605]; [DE-AC05-00OR22725] FX J.S. is a staff scientist at the Oak Ridge National Laboratory, which is managed by UT-Battelle, LLC, for the U.S. Department of Energy under Contract DE-AC05-00OR22725. This work is supported by Building Technologies Office of US Department of Energy under grant #1027-1605 to J.S. A portion of this research was conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility. NR 36 TC 0 Z9 0 U1 6 U2 6 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0947-6539 EI 1521-3765 J9 CHEM-EUR J JI Chem.-Eur. J. PD DEC 23 PY 2016 VL 22 IS 52 BP 18700 EP 18704 DI 10.1002/chem.201604130 PG 5 WC Chemistry, Multidisciplinary SC Chemistry GA EJ4XA UT WOS:000393219300007 PM 27785846 ER PT J AU Peng, B Kowalski, K AF Peng, Bo Kowalski, Karol TI Coupled-cluster Green's function: Analysis of properties originating in the exponential parametrization of the ground-state wave function SO PHYSICAL REVIEW A LA English DT Article ID MEAN-FIELD THEORY; ELECTRON PROPAGATOR THEORY; SHELL IONIZATION ENERGIES; QUASI-PARTICLE THEORY; QUANTUM-CHEMISTRY; MOLECULAR-SYSTEMS; EQUATION; MODEL; POTENTIALS; POLARIZABILITIES AB In this paper we derive basic properties of the Green's-functionmatrix elements stemming from the exponential coupled-cluster (CC) parametrization of the ground-state wave function. We demonstrate that all intermediates used to express the retarded (or, equivalently, ionized) part of the Green's function in the. representation can be expressed only through connected diagrams. Similar properties are also shared by the first-order. derivative of the retarded part of the CC Green's function. Moreover, the first-order. derivative of the CC Green's function can be evaluated analytically. This result can be generalized to any order of. derivatives. Through the Dyson equation, derivatives of the corresponding CC self-energy operator can be evaluated analytically. In analogy to the CC Green's function, the corresponding CC self-energy operator can be represented by connected terms. Our analysis can easily be generalized to the advanced part of the CC Green's function. C1 [Peng, Bo; Kowalski, Karol] Battelle Mem Inst, Pacific Northwest Natl Lab, William R Wiley Environm Mol Sci Lab, K8-91,POB 999, Richland, WA 99352 USA. RP Kowalski, K (reprint author), Battelle Mem Inst, Pacific Northwest Natl Lab, William R Wiley Environm Mol Sci Lab, K8-91,POB 999, Richland, WA 99352 USA. EM karol.kowalski@pnnl.gov FU Office of Biological and Environmental Research in the U.S. Department of Energy; U.S. Department of Energy [DE-AC06-76RLO-1830]; PNNL; Extreme Scale Computing Initiative, a Laboratory Directed Research and Development Program at Pacific Northwest National Laboratory FX This work has been performed using the Molecular Science Computing Facility (MSCF) in the Environmental Molecular Sciences Laboratory (EMSL) at the Pacific Northwest National Laboratory (PNNL). EMSL is funded by the Office of Biological and Environmental Research in the U.S. Department of Energy. PNNL is operated for the U.S. Department of Energy by the Battelle Memorial Institute under Contract No. DE-AC06-76RLO-1830. B.P. acknowledges the Linus Pauling Postdoctoral Fellowship from PNNL. K.K. acknowledge support from the Extreme Scale Computing Initiative, a Laboratory Directed Research and Development Program at Pacific Northwest National Laboratory. NR 79 TC 1 Z9 1 U1 4 U2 4 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9926 EI 2469-9934 J9 PHYS REV A JI Phys. Rev. A PD DEC 23 PY 2016 VL 94 IS 6 AR 062512 DI 10.1103/PhysRevA.94.062512 PG 10 WC Optics; Physics, Atomic, Molecular & Chemical SC Optics; Physics GA EG2WK UT WOS:000390904600006 ER PT J AU Rocco, N Lovato, A Benhar, O AF Rocco, Noemi Lovato, Alessandro Benhar, Omar TI Comparison of the electromagnetic responses of C-12 obtained from the Green's function Monte Carlo and spectral function approaches SO PHYSICAL REVIEW C LA English DT Article ID LIGHT-NUCLEI; SCATTERING AB The electromagnetic responses of carbon obtained from the Green's function Monte Carlo and spectral function approaches using the same dynamical input are compared in the kinematical region corresponding to momentum transfer in the range 300-570 MeV. The results of our analysis, aimed at pinning down the limits of applicability of the approximations involved in the two schemes, indicate that the factorization ansatz underlying the spectral function formalism provides remarkably accurate results down to momentum transfer as low as 300 MeV. On the other hand, it appears that at 570 MeV relativistic corrections to the electromagnetic current not included in the Monte Carlo calculations may play a significant role in the transverse channel. C1 [Rocco, Noemi; Benhar, Omar] Sapienza Univ, Ist Nazl Fis Nucl, I-00185 Rome, Italy. [Rocco, Noemi; Benhar, Omar] Sapienza Univ, Dept Phys, I-00185 Rome, Italy. [Rocco, Noemi] Univ Valencia, CSIC, Ctr Mixto, Inst Fis Corpuscular IFIC,Inst Invest Patema, E-46071 Valencia, Spain. [Lovato, Alessandro] Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. RP Rocco, N (reprint author), Sapienza Univ, Ist Nazl Fis Nucl, I-00185 Rome, Italy.; Rocco, N (reprint author), Sapienza Univ, Dept Phys, I-00185 Rome, Italy.; Rocco, N (reprint author), Univ Valencia, CSIC, Ctr Mixto, Inst Fis Corpuscular IFIC,Inst Invest Patema, E-46071 Valencia, Spain. FU Spanish Ministerio de Economia y Competitividad; European FEDER funds [FIS2014-51948-C2-1-P]; INFN under grant MANYBODY; US Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC02-06CH11357] FX Many illuminating discussions and a critical reading of the manuscript by Rocco Schiavilla are gratefully acknowledged. N.R. thanks the Theory Group at TRIUMF for its hospitality and for partial support during the completion of this work. The work of N.R. has been partially supported by the Spanish Ministerio de Economia y Competitividad and European FEDER funds under the Contract No. FIS2014-51948-C2-1-P. The work of O.B. and N.R. was supported by INFN under grant MANYBODY. The work of A.L. was supported by the US Department of Energy, Office of Science, Office of Nuclear Physics, under Contract No. DE-AC02-06CH11357. NR 32 TC 0 Z9 0 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 23 PY 2016 VL 94 IS 6 AR 065501 DI 10.1103/PhysRevC.94.065501 PG 7 WC Physics, Nuclear SC Physics GA EG2XW UT WOS:000390908400002 ER PT J AU Potter, AC Vasseur, R AF Potter, Andrew C. Vasseur, Romain TI Symmetry constraints on many-body localization SO PHYSICAL REVIEW B LA English DT Article ID NON-ABELIAN ANYONS; TOPOLOGICAL INSULATORS; 2 DIMENSIONS; TRANSITION; STATES; SUPERCONDUCTORS AB We derive general constraints on the existence of many-body localized (MBL) phases in the presence of global symmetries, and show that MBL is not possible with symmetry groups that protect multiplets (e.g., all non-Abelian symmetry groups). Based on simple representation theoretic considerations, we derive general Mermin-Wagner-type principles governing the possible alternative fates of nonequilibrium dynamics in isolated, strongly disordered quantum systems. Our results rule out the existence of MBL symmetry-protected topological phases with non-Abelian symmetry groups, as well as time-reversal symmetry-protected electronic topological insulators, and in fact all fermion topological insulators and superconductors in the 10-fold way classification. Moreover, extending our arguments to systems with intrinsic topological order, we rule out MBL phases with non-Abelian anyons as well as certain classes of symmetry-enriched topological orders. C1 [Potter, Andrew C.] Univ Texas Austin, Dept Phys, Austin, TX 78712 USA. [Vasseur, Romain] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Vasseur, Romain] Lawrence Berkeley Natl Labs, Mat Sci Div, Berkeley, CA 94720 USA. RP Potter, AC (reprint author), Univ Texas Austin, Dept Phys, Austin, TX 78712 USA. FU Gordon and Betty Moore Foundation's EPiQS Initiative [GBMF4307]; Quantum Materials Program at LBNL FX We thank T. Morimoto, S. Parameswaran, and A. Vishwanath for insightful discussions. This work was supported by the Gordon and Betty Moore Foundation's EPiQS Initiative through Grant No. GBMF4307 (A.C.P.) and the Quantum Materials Program at LBNL (R.V.). NR 81 TC 2 Z9 2 U1 4 U2 4 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 23 PY 2016 VL 94 IS 22 AR 224206 DI 10.1103/PhysRevB.94.224206 PG 7 WC Physics, Condensed Matter SC Physics GA EG2WO UT WOS:000390905000002 ER PT J AU Zhao, X Wang, CZ Yao, YX Ho, KM AF Zhao, Xin Wang, Cai-Zhuang Yao, Yongxin Ho, Kai-Ming TI Large magnetic anisotropy predicted for rare-earth-free Fe16-xCoxN2 alloys SO PHYSICAL REVIEW B LA English DT Article ID TOTAL-ENERGY CALCULATIONS; SINGLE-CRYSTAL FILMS; WAVE BASIS-SET; GENETIC ALGORITHM; METALS; FE16N2; ALPHA-FE16N2; MOMENT AB Structures and magnetic properties of Fe16-xCoxN2 are studied using adaptive genetic algorithm and firstprinciples calculations. We show that substituting Fe with Co in Fe16N2 with a Co/Fe ratio <= 1 can greatly improve the magnetic anisotropy of the material. The magnetocrystalline anisotropy energy from first-principles calculations reaches 3.18 MJ/m(3) (245.6 mu eV permetal atom) for Fe12Co4N2, much larger than that of Fe16N2, and is one of the largest among the reported rare-earth-free magnets. From our systematic crystal structure searches, we show that there is a structure transition from tetragonal Fe16N2 to cubic Co16N2 in Fe16-xCoxN2 as the Co concentration increases, which can be well explained by electron counting analysis. Differentmagnetic properties between the Fe-rich (x <= 8) and Co-rich (x > 8) Fe16-xCoxN2 is closely related to the structural transition. C1 [Zhao, Xin] Iowa State Univ, US DOE, Ames Lab, Ames, IA 50011 USA. Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. RP Zhao, X (reprint author), Iowa State Univ, US DOE, Ames Lab, Ames, IA 50011 USA. EM xzhao@iastate.edu; wangcz@ameslab.gov FU National Science Foundation (NSF), Division of Materials Research (DMR) [DMREF: SusChEM 1436386]; US Department of Energy, Basic Energy Sciences, Division of Materials Science and Engineering [DE-AC02-07CH11358] FX This work was supported by the National Science Foundation (NSF), Division of Materials Research (DMR) under Award No. DMREF: SusChEM 1436386. The development of the adaptive genetic algorithm (AGA) and the method for rigid-band perturbation analysis was supported by the US Department of Energy, Basic Energy Sciences, Division of Materials Science and Engineering, under Contract No. DE-AC02-07CH11358, including a grant of computer time at the National Energy Research Scientific Computing Center (NERSC) in Berkeley, CA. NR 28 TC 0 Z9 0 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 23 PY 2016 VL 94 IS 22 AR 224424 DI 10.1103/PhysRevB.94.224424 PG 5 WC Physics, Condensed Matter SC Physics GA EG2WO UT WOS:000390905000003 ER PT J AU Defurne, M Mazouz, M Ahmed, Z Albataineh, H Allada, K Aniol, KA Bellini, V Benali, M Boeglin, W Bertin, P Brossard, M Camsonne, A Canan, M Chandavar, S Chen, C Chen, JP de Jager, CW de Leo, R Desnault, C Deur, A El Fassi, L Ent, R Flay, D Friend, M Fuchey, E Frullani, S Garibaldi, F Gaskell, D Giusa, A Glamazdin, O Golge, S Gomez, J Hansen, O Higinbotham, D Holmstrom, T Horn, T Huang, J Huang, M Huber, GM Hyde, CE Iqbal, S Itard, F Kang, H Kang, H Kelleher, A Keppel, C Koirala, S Korover, I LeRose, JJ Lindgren, R Long, E Magne, M Mammei, J Margaziotis, DJ Markowitz, P Jimenez-Arguello, AM Meddi, F Meekins, D Michaels, R Mihovilovic, M Muangma, N Camacho, CM Nadel-Turonski, P Nuruzzaman, N Paremuzyan, R Puckett, A Punjabi, V Qiang, Y Rakhman, A Rashad, MNH Riordan, S Roche, J Russo, G Sabatie, F Saenboonruang, K Saha, A Sawatzky, B Selvy, L Shahinyan, A Sirca, S Solvignon, P Sperduto, ML Subedi, R Sulkosky, V Sutera, C Tobias, WA Urciuoli, GM Wang, D Wojtsekhowski, B Yao, H Ye, Z Zana, L Zhan, X Zhang, J Zhao, B Zhao, Z Zheng, X Zhu, P AF Defurne, M. Mazouz, M. Ahmed, Z. Albataineh, H. Allada, K. Aniol, K. A. Bellini, V. Benali, M. Boeglin, W. Bertin, P. Brossard, M. Camsonne, A. Canan, M. Chandavar, S. Chen, C. Chen, J. -P. de Jager, C. W. de Leo, R. Desnault, C. Deur, A. El Fassi, L. Ent, R. Flay, D. Friend, M. Fuchey, E. Frullani, S. Garibaldi, F. Gaskell, D. Giusa, A. Glamazdin, O. Golge, S. Gomez, J. Hansen, O. Higinbotham, D. Holmstrom, T. Horn, T. Huang, J. Huang, M. Huber, G. M. Hyde, C. E. Iqbal, S. Itard, F. Kang, Ho. Kang, Hy. Kelleher, A. Keppel, C. Koirala, S. Korover, I. LeRose, J. J. Lindgren, R. Long, E. Magne, M. Mammei, J. Margaziotis, D. J. Markowitz, P. Marti Jimenez-Arguello, A. Meddi, F. Meekins, D. Michaels, R. Mihovilovic, M. Muangma, N. Camacho, C. Munoz Nadel-Turonski, P. Nuruzzaman, N. Paremuzyan, R. Puckett, A. Punjabi, V. Qiang, Y. Rakhman, A. Rashad, M. N. H. Riordan, S. Roche, J. Russo, G. Sabatie, F. Saenboonruang, K. Saha, A. Sawatzky, B. Selvy, L. Shahinyan, A. Sirca, S. Solvignon, P. Sperduto, M. L. Subedi, R. Sulkosky, V. Sutera, C. Tobias, W. A. Urciuoli, G. M. Wang, D. Wojtsekhowski, B. Yao, H. Ye, Z. Zana, L. Zhan, X. Zhang, J. Zhao, B. Zhao, Z. Zheng, X. Zhu, P. CA Jefferson Lab Hall A Collaboration TI Rosenbluth Separation of the pi(0) Electroproduction Cross Section SO PHYSICAL REVIEW LETTERS LA English DT Article ID HARD EXCLUSIVE ELECTROPRODUCTION; MESONS AB We present deeply virtual pi(0) electroproduction cross-section measurements at x(B) = 0.36 and three different Q(2) values ranging from 1.5 to 2 GeV2, obtained from Jefferson Lab Hall A experiment E07-007. The Rosenbluth technique is used to separate the longitudinal and transverse responses. Results demonstrate that the cross section is dominated by its transverse component and, thus, is far from the asymptotic limit predicted by perturbative quantum chromodynamics. Nonetheless, an indication of a nonzero longitudinal contribution is provided by the measured interference term sigma(LT). Results are compared with several models based on the leading-twist approach of generalized parton distributions (GPDs). In particular, a fair agreement is obtained with models in which the scattering amplitude includes convolution terms of chiral-odd (transversity) GPDs of the nucleon with the twist-3 pion distribution amplitude. This experiment, together with previous extensive unseparated measurements, provides strong support to the exciting idea that transversity GPDs can be accessed via neutral pion electroproduction in the high-Q(2) regime. C1 [Defurne, M.; Sabatie, F.] Univ Paris Saclay, CEA, Irfu, F-91191 Gif Sur Yvette, France. [Mazouz, M.] Fac Sci Monastir, Monastir, Tunisia. [Ahmed, Z.; Rakhman, A.; Zana, L.] Syracuse Univ, Syracuse, NY 13244 USA. [Albataineh, H.] Texas A&M Univ Kingsville, Kingsville, TX 78363 USA. [Allada, K.; Huang, J.; Muangma, N.; Sulkosky, V.] MIT, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Aniol, K. A.; Iqbal, S.; Margaziotis, D. J.] Calif State Univ Los Angeles, Los Angeles, CA 90032 USA. [Bellini, V.; Giusa, A.; Russo, G.; Sperduto, M. L.; Sutera, C.] Ist Nazl Fis Nucl, Sez Catania, I-95125 Catania, Italy. [Benali, M.; Bertin, P.; Brossard, M.; Fuchey, E.; Hyde, C. E.; Itard, F.; Magne, M.; Camacho, C. Munoz] Univ Blaise Pascal, Clermont Univ, CNRS IN2P3, Lab Phys Corpusculaire, FR-63000 Clermont Ferrand, France. [Boeglin, W.; Markowitz, P.] Florida Int Univ, Miami, FL 33199 USA. [Bertin, P.; Camsonne, A.; Chen, J. -P.; de Jager, C. W.; Deur, A.; Ent, R.; Gaskell, D.; Gomez, J.; Hansen, O.; Higinbotham, D.; Keppel, C.; LeRose, J. J.; Meekins, D.; Michaels, R.; Nadel-Turonski, P.; Qiang, Y.; Saha, A.; Sawatzky, B.; Solvignon, P.; Wojtsekhowski, B.; Zhang, J.] Thomas Jefferson Natl Accelerator Facil, Newport News, VA 23606 USA. [Canan, M.; Hyde, C. E.; Koirala, S.; Rashad, M. N. H.] Old Dominion Univ, Norfolk, VA 23529 USA. [Chandavar, S.; Roche, J.] Ohio Univ, Athens, OH 45701 USA. [Chen, C.; Nuruzzaman, N.] Hampton Univ, Hampton, VA 23668 USA. [de Leo, R.] Univ Bari, I-70121 Bari, Italy. [Desnault, C.; Marti Jimenez-Arguello, A.; Camacho, C. Munoz; Paremuzyan, R.] Inst Phys Nucl CNRS IN2P3, F-91400 Orsay, France. [El Fassi, L.] Rutgers State Univ, Piscataway, NJ 08854 USA. [Flay, D.; Sawatzky, B.; Yao, H.] Temple Univ, Philadelphia, PA 19122 USA. [Friend, M.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Frullani, S.; Garibaldi, F.; Meddi, F.] Ist Nazl Fis Nucl, Sez Sanita, I-00161 Rome, Italy. [Glamazdin, O.] Kharkov Phys & Technol Inst, UA-61108 Kharkov, Ukraine. [Golge, S.] North Carolina Cent Univ, Durham, NC 27701 USA. [Holmstrom, T.] Longwood Univ, Farmville, VA 23909 USA. [Horn, T.] Catholic Univ Amer, Washington, DC 20064 USA. [Huang, M.] Duke Univ, Durham, NC 27708 USA. [Kang, Ho.; Kang, Hy.] Seoul Natl Univ, Seoul 151747, South Korea. [Kelleher, A.; Zhao, B.] Coll William & Mary, Williamsburg, VA 23187 USA. [Korover, I.] Tel Aviv Univ, IL-69978 Tel Aviv, Israel. [Lindgren, R.; Saenboonruang, K.; Tobias, W. A.; Wang, D.; Ye, Z.; Zhao, Z.; Zheng, X.; Zhu, P.] Univ Virginia, Charlottesville, VA 22904 USA. [Long, E.; Selvy, L.] Kent State Univ, Kent, OH 44242 USA. [Mammei, J.] Univ Massachusetts, Amherst, MA 01003 USA. [Marti Jimenez-Arguello, A.] Univ Valencia, Fac Fis, Valencia 46071, Spain. [Mihovilovic, M.; Sirca, S.] Univ Ljubljana, Ljubljana 1000, Slovenia. [Puckett, A.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Punjabi, V.] Norfolk State Univ, Norfolk, VA 23529 USA. [Riordan, S.] SUNY Stony Brook, Stony Brook, NY 11794 USA. [Saenboonruang, K.] Kasetsart Univ, Bangkok 10900, Thailand. [Shahinyan, A.] Yerevan Phys Inst, Yerevan 375036, Armenia. [Subedi, R.] George Washington Univ, Washington, DC 20052 USA. [Urciuoli, G. M.] Ist Nazl Fis Nucl, Sez Roma, I-00185 Rome, Italy. [Zhan, X.] Argonne Natl Lab, Lemont, IL 60439 USA. [Huber, G. M.] Univ Regina, Regina, SK S4S 0A2, Canada. RP Defurne, M (reprint author), Univ Paris Saclay, CEA, Irfu, F-91191 Gif Sur Yvette, France. EM maxime.defurne@cea.fr RI BELLINI, Vincenzo/B-1239-2012; Ye, Zhihong/E-6651-2017 OI BELLINI, Vincenzo/0000-0001-6906-7463; Ye, Zhihong/0000-0002-1873-2344 FU Department of Energy (DOE); National Science Foundation; French Centre National de la Recherche Scientifique; Agence Nationale de la Recherche; Commissariat a l'energie atomique et aux energies alternatives; P2IO Laboratory of Excellence; U.S. DOE [DE-AC05-060R23177] FX We thank G. Goldstein, S. Goloskokov, M. Guidal, P. Kroll, S. Liuti, and M. Vanderhaeghen for valuable information about their work and providing the results of their models. We acknowledge essential work of the JLab accelerator staff and the Hall A technical staff. This work was supported by the Department of Energy (DOE), the National Science Foundation, the French Centre National de la Recherche Scientifique, the Agence Nationale de la Recherche, the Commissariat a l'energie atomique et aux energies alternatives, and P2IO Laboratory of Excellence. Jefferson Science Associates, LLC, operates Jefferson Lab for the U.S. DOE under U.S. DOE Contract No. DE-AC05-060R23177. NR 25 TC 1 Z9 1 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 23 PY 2016 VL 117 IS 26 AR 262001 DI 10.1103/PhysRevLett.117.262001 PG 6 WC Physics, Multidisciplinary SC Physics GA EF4MD UT WOS:000390301400003 PM 28059549 ER PT J AU He, JF Zhang, CF Ghimire, NJ Liang, T Jia, CJ Jiang, J Tang, SJ Chen, SS He, Y Mo, SK Hwang, CC Hashimoto, M Lu, DH Moritz, B Devereaux, TP Chen, YL Mitchell, JF Shen, ZX AF He, Junfeng Zhang, Chaofan Ghimire, Nirmal J. Liang, Tian Jia, Chunjing Jiang, Juan Tang, Shujie Chen, Sudi He, Yu Mo, S. -K. Hwang, C. C. Hashimoto, M. Lu, D. H. Moritz, B. Devereaux, T. P. Chen, Y. L. Mitchell, J. F. Shen, Z. -X. TI Distinct Electronic Structure for the Extreme Magnetoresistance in YSb SO PHYSICAL REVIEW LETTERS LA English DT Article ID GIANT MAGNETORESISTANCE; ULTRAHIGH MOBILITY; SEMIMETAL PHASE; FERMI ARCS; RESISTIVITY; DISCOVERY; SURFACE; CD3AS2; WTE2 AB An extreme magnetoresistance (XMR) has recently been observed in several nonmagnetic semimetals. Increasing experimental and theoretical evidence indicates that the XMR can be driven by either topological protection or electron-hole compensation. Here, by investigating the electronic structure of a XMR material, YSb, we present spectroscopic evidence for a special case which lacks topological protection and perfect electron-hole compensation. Further investigations reveal that a cooperative action of a substantial difference between electron and hole mobility and a moderate carrier compensation might contribute to the XMR in YSb. C1 [He, Junfeng; Zhang, Chaofan; Liang, Tian; Jia, Chunjing; Tang, Shujie; Chen, Sudi; He, Yu; Moritz, B.; Devereaux, T. P.; Shen, Z. -X.] SLAC Natl Accelerator Lab, Stanford Inst Mat & Energy Sci, 2575 Sand Hill Rd, Menlo Pk, CA 94025 USA. [He, Junfeng; Zhang, Chaofan; Liang, Tian; Jia, Chunjing; Tang, Shujie; Chen, Sudi; He, Yu; Moritz, B.; Devereaux, T. P.; Shen, Z. -X.] Stanford Univ, Geballe Lab Adv Mat, Dept Phys, Stanford, CA 94305 USA. [He, Junfeng; Zhang, Chaofan; Liang, Tian; Jia, Chunjing; Tang, Shujie; Chen, Sudi; He, Yu; Moritz, B.; Devereaux, T. P.; Shen, Z. -X.] Stanford Univ, Geballe Lab Adv Mat, Dept Appl Phys, Stanford, CA 94305 USA. [Ghimire, Nirmal J.; Mitchell, J. F.] Argonne Natl Lab, Div Mat Sci, Argonne, IL 60439 USA. [Jiang, Juan; Mo, S. -K.] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Jiang, Juan; Chen, Y. L.] ShanghaiTech Univ, Sch Phys Sci & Technol, Shanghai 200031, Peoples R China. [Jiang, Juan; Hwang, C. C.] Pohang Univ Sci & Technol, Pohang Accelerator Lab, Pohang 790784, South Korea. [Hashimoto, M.; Lu, D. H.] SLAC Natl Accelerator Lab, Stanford Synchrotron Radiat Lightsource, 2575 Sand Hill Rd, Menlo Pk, CA 94025 USA. [Chen, Y. L.] Univ Oxford, Dept Phys, Oxford OX1 3PU, England. RP Shen, ZX (reprint author), SLAC Natl Accelerator Lab, Stanford Inst Mat & Energy Sci, 2575 Sand Hill Rd, Menlo Pk, CA 94025 USA.; Shen, ZX (reprint author), Stanford Univ, Geballe Lab Adv Mat, Dept Phys, Stanford, CA 94305 USA.; Shen, ZX (reprint author), Stanford Univ, Geballe Lab Adv Mat, Dept Appl Phys, Stanford, CA 94305 USA. EM zxshen@stanford.edu RI Moritz, Brian/D-7505-2015; Mo, Sung-Kwan/F-3489-2013 OI Moritz, Brian/0000-0002-3747-8484; Mo, Sung-Kwan/0000-0003-0711-8514 FU U.S. DOE, Office of Basic Energy Science, Division of Materials Science and Engineering; Office of Basic Energy Sciences, U.S. DOE [DE-AC02-05CH11231, DE-AC02-76SF00515]; U.S. DOE, Office of Basic Energy Science, Materials Science and Engineering Division; NRF, Korea through the SRC center for Topological Matter [2011-0030787] FX We thank E. Y. Ma, S. N. Rebec, and X. Dai for useful discussions. The work at SLAC and Stanford is supported by the U.S. DOE, Office of Basic Energy Science, Division of Materials Science and Engineering. ALS and SSRL are operated by the Office of Basic Energy Sciences, U.S. DOE, under Contracts No. DE-AC02-05CH11231 and No. DE-AC02-76SF00515, respectively. Work at Argonne (sample growth, characterization and transport measurement) is supported by the U.S. DOE, Office of Basic Energy Science, Materials Science and Engineering Division. J.J. and C.C.H. acknowledge support from the NRF, Korea through the SRC center for Topological Matter (No. 2011-0030787). NR 37 TC 0 Z9 0 U1 34 U2 34 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 23 PY 2016 VL 117 IS 26 AR 267201 DI 10.1103/PhysRevLett.117.267201 PG 6 WC Physics, Multidisciplinary SC Physics GA EF4MD UT WOS:000390301400008 PM 28059532 ER PT J AU Sivadas, N Okamoto, S Xiao, D AF Sivadas, Nikhil Okamoto, Satoshi Xiao, Di TI Gate-Controllable Magneto-optic Kerr Effect in Layered Collinear Antiferromagnets SO PHYSICAL REVIEW LETTERS LA English DT Article ID AUGMENTED-WAVE METHOD; BILAYER GRAPHENE; WANNIER FUNCTIONS; CRYSTAL AB Using symmetry arguments and a tight-binding model, we show that for layered collinear antiferromagnets, magneto-optic effects can be generated and manipulated by controlling crystal symmetries through a gate voltage. This provides a promising route for electric field manipulation of the magneto-optic effects without modifying the underlying magnetic structure. We further demonstrate the gate control of the magneto-optic Kerr effect (MOKE) in bilayer MnPSe3 using first-principles calculations. The field-induced inversion symmetry breaking effect leads to gate-controllable MOKE, whose direction of rotation can be switched by the reversal of the gate voltage. C1 [Sivadas, Nikhil; Xiao, Di] Carnegie Mellon Univ, Dept Phys, Pittsburgh, PA 15213 USA. [Okamoto, Satoshi] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. RP Sivadas, N (reprint author), Carnegie Mellon Univ, Dept Phys, Pittsburgh, PA 15213 USA. RI Okamoto, Satoshi/G-5390-2011; Xiao, Di/B-1830-2008 OI Okamoto, Satoshi/0000-0002-0493-7568; Xiao, Di/0000-0003-0165-6848 FU Air Force Office of Scientific Research [FA9550-12-1-0479, FA9550-14-1-0277]; National Science Foundation [EFRI-1433496]; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division; DOE Office of Science [DE-AC02-05CH11231]; Research Corporation for Science Advancement Cottrell Scholar Award FX We are grateful to Hua Chen, Matthew W. Daniels, Guang-Yu Guo, Tony Heinz, Kin Fai Mak, David Mandrus, Jiaqiang Yan, and Xiaodong Xu for stimulating discussions. We would also like to thank Valentino Cooper, Ji Feng, and Xiao Li for their computational input. We are indebted to the anonymous reviewers for providing insightful comments on an earlier version of this work. This work was supported by the Air Force Office of Scientific Research under Grants No. FA9550-12-1-0479 and No. FA9550-14-1-0277, and by the National Science Foundation under Grant No. EFRI-1433496. S.O. acknowledges support by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. This research used resources of the National Energy Research Scientific Computing Center, which is supported by the DOE Office of Science under Contract No. DE-AC02-05CH11231. D. X. also acknowledges support from a Research Corporation for Science Advancement Cottrell Scholar Award. NR 41 TC 0 Z9 0 U1 15 U2 15 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 23 PY 2016 VL 117 IS 26 AR 267203 DI 10.1103/PhysRevLett.117.267203 PG 5 WC Physics, Multidisciplinary SC Physics GA EF4MD UT WOS:000390301400010 PM 28059540 ER PT J AU Papari, GP Glatz, A Carillo, F Stornaiuolo, D Massarotti, D Rouco, V Longobardi, L Beltram, F Vinokur, VM Tafuri, F AF Papari, G. P. Glatz, A. Carillo, F. Stornaiuolo, D. Massarotti, D. Rouco, V. Longobardi, L. Beltram, F. Vinokur, V. M. Tafuri, F. TI Geometrical vortex lattice pinning and melting in YBaCuO submicron bridges SO SCIENTIFIC REPORTS LA English DT Article ID HIGH-TEMPERATURE SUPERCONDUCTORS; VORTICES; MATTER; STATE; RESISTIVITY; DYNAMICS AB Since the discovery of high-temperature superconductors (HTSs), most efforts of researchers have been focused on the fabrication of superconducting devices capable of immobilizing vortices, hence of operating at enhanced temperatures and magnetic fields. Recent findings that geometric restrictions may induce self-arresting hypervortices recovering the dissipation-free state at high fields and temperatures made superconducting strips a mainstream of superconductivity studies. Here we report on the geometrical melting of the vortex lattice in a wide YBCO submicron bridge preceded by magnetoresistance (MR) oscillations fingerprinting the underlying regular vortex structure. Combined magnetoresistance measurements and numerical simulations unambiguously relate the resistance oscillations to the penetration of vortex rows with intermediate geometrical pinning and uncover the details of geometrical melting. Our findings offer a reliable and reproducible pathway for controlling vortices in geometrically restricted nanodevices and introduce a novel technique of geometrical spectroscopy, inferring detailed information of the structure of the vortex system through a combined use of MR curves and large-scale simulations. C1 [Papari, G. P.; Stornaiuolo, D.; Rouco, V.] Univ Naples Federico II, Dipartimento Fis, I-80126 Naples, Italy. [Glatz, A.; Beltram, F.; Vinokur, V. M.] Argonne Natl Lab, Div Mat Sci, Lemont, IL 60439 USA. [Glatz, A.] Northern Illinois Univ, Dept Phys, De Kalb, IL 60115 USA. [Carillo, F.] CNR INFM, NEST, Piazza San Silvestro 12, I-56127 Pisa, Italy. [Carillo, F.] Scuola Normale Super Pisa, Piazza San Silvestro 12, I-56127 Pisa, Italy. [Stornaiuolo, D.; Massarotti, D.; Tafuri, F.] Complesso Univ Monte St Angelo, CNR SPIN UOS Napoli, I-80126 Naples, Italy. [Massarotti, D.; Longobardi, L.; Tafuri, F.] Univ Naples 2, Dipartimento Ingn Ind & Informaz, I-80131 Aversa, CE, Italy. [Longobardi, L.] Amer Phys Soc, Ridge, NY 11961 USA. RP Vinokur, VM (reprint author), Argonne Natl Lab, Div Mat Sci, Lemont, IL 60439 USA.; Tafuri, F (reprint author), Complesso Univ Monte St Angelo, CNR SPIN UOS Napoli, I-80126 Naples, Italy.; Tafuri, F (reprint author), Univ Naples 2, Dipartimento Ingn Ind & Informaz, I-80131 Aversa, CE, Italy. EM vinokur@anl.gov; tafuri@na.infn.it OI Tafuri, Francesco/0000-0003-0784-1454 FU COST; Scientific Discovery through Advanced Computing (SciDAC) program - U.S. Department of Energy, Office of Science, Advanced Scientific Computing Research; Basic Energy Science, Division of Materials Science and Engineering FX The experimental work was supported by COST. The computational and theoretical work was supported by the Scientific Discovery through Advanced Computing (SciDAC) program funded by U.S. Department of Energy, Office of Science, Advanced Scientific Computing Research and Basic Energy Science, Division of Materials Science and Engineering. NR 28 TC 0 Z9 0 U1 5 U2 5 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 23 PY 2016 VL 6 AR 38677 DI 10.1038/srep38677 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF5KK UT WOS:000390368900001 PM 28008911 ER PT J AU MacMartin, DG Kravitz, B AF MacMartin, Douglas G. Kravitz, Ben TI Dynamic climate emulators for solar geoengineering SO ATMOSPHERIC CHEMISTRY AND PHYSICS LA English DT Article ID SCENARIO AB Climate emulators trained on existing simulations can be used to project project the climate effects that result from different possible future pathways of anthropogenic forcing, without further relying on general circulation model (GCM) simulations. We extend this idea to include different amounts of solar geoengineering in addition to different pathways of greenhouse gas concentrations, by training emulators from a multi-model ensemble of simulations from the Geoengineering Model Intercomparison Project (GeoMIP). The emulator is trained on the abrupt 4xCO(2) and a compensating solar reduction simulation (G1), and evaluated by comparing predictions against a simulated 1% per year CO2 increase and a similarly smaller solar reduction (G2). We find reasonable agreement in most models for predicting changes in temperature and precipitation (including regional effects), and annual-mean Northern Hemisphere sea ice extent, with the difference between simulation and prediction typically being smaller than natural variability. This verifies that the linearity assumption used in constructing the emulator is sufficient for these variables over the range of forcing considered. Annual-minimum Northern Hemisphere sea ice extent is less well predicted, indicating a limit to the linearity assumption. C1 [MacMartin, Douglas G.] Cornell Univ, Dept Mech & Aerosp Engn, Ithaca, NY 14850 USA. [MacMartin, Douglas G.] CALTECH, Comp & Math Sci, Pasadena, CA 91125 USA. [Kravitz, Ben] Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. RP MacMartin, DG (reprint author), Cornell Univ, Dept Mech & Aerosp Engn, Ithaca, NY 14850 USA.; MacMartin, DG (reprint author), CALTECH, Comp & Math Sci, Pasadena, CA 91125 USA. EM dgm224@cornell.edu OI MacMartin, Douglas/0000-0003-1987-9417 FU U.S. Department of Energy by Battelle Memorial Institute [DE-AC05-76RL01830]; Cornell University's David R. Atkinson Center for a Sustainable Future (ACSF) FX We thank all participants of the Geoengineering Model Intercomparison Project and their model development teams, CLIVAR/WCRP Working Group on Coupled Modeling for endorsing GeoMIP, and the scientists managing the Earth System Grid data nodes, who assisted with making GeoMIP output available. The Pacific Northwest National Laboratory is operated for the U.S. Department of Energy by Battelle Memorial Institute under contract DE-AC05-76RL01830. This work was partially supported by Cornell University's David R. Atkinson Center for a Sustainable Future (ACSF). NR 34 TC 1 Z9 1 U1 5 U2 5 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1680-7316 EI 1680-7324 J9 ATMOS CHEM PHYS JI Atmos. Chem. Phys. PD DEC 22 PY 2016 VL 16 IS 24 BP 15789 EP 15799 DI 10.5194/acp-16-15789-2016 PG 11 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA EH1XK UT WOS:000391561300001 ER PT J AU Ghajar, CM Bissell, MJ AF Ghajar, Cyrus M. Bissell, Mina J. TI METASTASIS Pathways of parallel progression SO NATURE LA English DT Editorial Material ID CARCINOMA IN-SITU; BREAST-CANCER; TUMOR-CELLS; BONE-MARROW; DISSEMINATION AB Two studies in mice identify mechanisms by which tumour cells disseminate in very early breast cancer. Both show that these cells colonize distant tissues more efficiently than their later counterparts. See Article p.552 & Letter p.588 C1 [Ghajar, Cyrus M.] Fred Hutchinson Canc Res Ctr, Div Publ Hlth Sci, Translat Res Program, Seattle, WA 98109 USA. [Ghajar, Cyrus M.] Fred Hutchinson Canc Res Ctr, Human Biol Div, Seattle, WA 98109 USA. [Bissell, Mina J.] Lawrence Berkeley Natl Lab, Biol Syst & Engn Div, Berkeley, CA 94720 USA. RP Ghajar, CM (reprint author), Fred Hutchinson Canc Res Ctr, Div Publ Hlth Sci, Translat Res Program, Seattle, WA 98109 USA.; Ghajar, CM (reprint author), Fred Hutchinson Canc Res Ctr, Human Biol Div, Seattle, WA 98109 USA. EM cghajar@fredhutch.org; mjbissell@lbl.gov NR 14 TC 0 Z9 0 U1 11 U2 11 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 0028-0836 EI 1476-4687 J9 NATURE JI Nature PD DEC 22 PY 2016 VL 540 IS 7634 BP 528 EP 529 PG 2 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG6XV UT WOS:000391190500037 ER PT J AU Shen, Y Li, YD Wo, HL Li, YS Shen, SD Pan, BY Wang, QS Walker, HC Steffens, P Boehm, M Hao, YQ Quintero-Castro, DL Harriger, LW Frontzek, MD Hao, LJ Meng, SQ Zhang, QM Chen, G Zhao, J AF Shen, Yao Li, Yao-Dong Wo, Hongliang Li, Yuesheng Shen, Shoudong Pan, Bingying Wang, Qisi Walker, H. C. Steffens, P. Boehm, M. Hao, Yiqing Quintero-Castro, D. L. Harriger, L. W. Frontzek, M. D. Hao, Lijie Meng, Siqin Zhang, Qingming Chen, Gang Zhao, Jun TI Evidence for a spinon Fermi surface in a triangular-lattice quantum-spin-liquid candidate SO NATURE LA English DT Article ID VALENCE-BOND STATE; KAGOME-LATTICE; GROUND-STATE; SUPERCONDUCTIVITY; ANTIFERROMAGNET; EXCITATIONS; TOPOLOGY; PHYSICS AB A quantum spin liquid is an exotic quantum state of matter in which spins are highly entangled and remain disordered down to zero temperature. Such a state of matter is potentially relevant to high-temperature superconductivity and quantum-information applications, and experimental identification of a quantum spin liquid state is of fundamental importance for our understanding of quantum matter. Theoretical studies have proposed various quantum-spin-liquid ground states1-4, most of which are characterized by exotic spin excitations with fractional quantum numbers (termed 'spinons'). Here we report neutron scattering measurements of the triangular-lattice antiferromagnet YbMgGaO4 that reveal broad spin excitations covering a wide region of the Brillouin zone. The observed diffusive spin excitation persists at the lowest measured energy and shows a clear upper excitation edge, consistent with the particle-hole excitation of a spinon Fermi surface. Our results therefore point to the existence of a quantum spin liquid state with a spinon Fermi surface in YbMgGaO4, which has a perfect spin-1/2 triangular lattice as in the original proposal(4) of quantum spin liquids. C1 [Shen, Yao; Wo, Hongliang; Shen, Shoudong; Pan, Bingying; Wang, Qisi; Hao, Yiqing; Chen, Gang; Zhao, Jun] Fudan Univ, State Key Lab Surface Phys, Shanghai 200433, Peoples R China. [Shen, Yao; Wo, Hongliang; Shen, Shoudong; Pan, Bingying; Wang, Qisi; Hao, Yiqing; Chen, Gang; Zhao, Jun] Fudan Univ, Dept Phys, Shanghai 200433, Peoples R China. [Li, Yao-Dong] Fudan Univ, Sch Comp Sci, Shanghai 200433, Peoples R China. [Li, Yuesheng; Zhang, Qingming] Renmin Univ China, Beijing Key Lab Optoelect Funct Mat & Micronano D, Dept Phys, Beijing 100872, Peoples R China. [Walker, H. C.] STFC, Rutherford Appleton Lab, ISIS Facil, Didcot OX11 0QX, Oxon, England. [Steffens, P.; Boehm, M.] Inst Laue Langevin, 71 Ave Martyrs, F-38042 Grenoble 9, France. [Quintero-Castro, D. L.] Helmholtz Zentrum Berlin Mat & Energie, D-14109 Berlin, Germany. [Harriger, L. W.] NIST, Ctr Neutron Res, Gaithersburg, MD 20899 USA. [Frontzek, M. D.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Hao, Lijie; Meng, Siqin] China Inst Atom Energy, Neutron Scattering Lab, Beijing 102413, Peoples R China. [Zhang, Qingming] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. [Zhang, Qingming; Chen, Gang; Zhao, Jun] Collaborat Innovat Ctr Adv Microstruct, Nanjing 210093, Jiangsu, Peoples R China. [Chen, Gang] Fudan Univ, Ctr Field Theory & Particle Phys, Shanghai 200433, Peoples R China. RP Chen, G; Zhao, J (reprint author), Fudan Univ, State Key Lab Surface Phys, Shanghai 200433, Peoples R China.; Chen, G; Zhao, J (reprint author), Fudan Univ, Dept Phys, Shanghai 200433, Peoples R China.; Chen, G; Zhao, J (reprint author), Collaborat Innovat Ctr Adv Microstruct, Nanjing 210093, Jiangsu, Peoples R China.; Chen, G (reprint author), Fudan Univ, Ctr Field Theory & Particle Phys, Shanghai 200433, Peoples R China. EM gchen_physics@fudan.edu.cn; zhaoj@fudan.edu.cn RI Walker, Helen/C-4201-2011; Zhao, Jun/A-2492-2010; OI Walker, Helen/0000-0002-7859-5388; Zhao, Jun/0000-0002-0421-8934; Li, Yaodong/0000-0003-3742-1944 FU National Key R&D Program of the MOST of China [2016YFA0300203]; Ministry of Science and Technology of China (Program 973) [2015CB921302]; National Natural Science Foundation of China [91421106]; Thousand Youth Talent Program of China; NSF of China; Ministry of Science and Technology of China [2016YFA0300504] FX We thank D. Lee, S. Li, Y. Lu, X. Wang and, especially, J.-W. Mei for discussions, and F. Song for assistance with magnetic susceptibility measurements. This work was supported by the National Key R&D Program of the MOST of China (grant number 2016YFA0300203), the Ministry of Science and Technology of China (Program 973: 2015CB921302), and the National Natural Science Foundation of China (grant number 91421106). Y.-D.L. and G.C. were supported by the Thousand Youth Talent Program of China. Q.M.Z. was supported by the NSF of China and the Ministry of Science and Technology of China (grant number 2016YFA0300504). A portion of this research used resources at the High Flux Isotope Reactor, a DOE Office of Science User Facility operated by the Oak Ridge National Laboratory. NR 38 TC 4 Z9 4 U1 40 U2 40 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 0028-0836 EI 1476-4687 J9 NATURE JI Nature PD DEC 22 PY 2016 VL 540 IS 7634 BP 559 EP + DI 10.1038/nature20614 PG 13 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG6XV UT WOS:000391190500046 ER PT J AU Shkrob, IA Pupek, KZ Gilbert, JA Trask, SE Ahraham, DP AF Shkrob, Ilya A. Pupek, Krzysztof Z. Gilbert, James A. Trask, Stephen E. Ahraham, Daniel P. TI Chemical Stability of Lithium 2-Trifluoromethyl-4,5-dicyanoimidazolide, an Electrolyte Salt for Li-Ion Cells SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID ZEOLITIC IMIDAZOLATE FRAMEWORKS; ALUMINUM CURRENT COLLECTORS; SI ANODES; PHOTOELECTRON-SPECTROSCOPY; CARBONATE ELECTROLYTES; REDUCTION-MECHANISMS; ETHYLENE CARBONATE; INTERFACE SEI; LITDI-SALT; BATTERIES AB Lithium hexafluorophosphate (LiPF6) is ubiquitous in commercial lithium-ion batteries, but it is hydrolytically unstable and corrosive on electrode surfaces. Using a more stable salt would confer multiple benefits for high-voltage operation, but many such electrolyte systems facilitate anodic dissolution and pitting corrosion of aluminum current collectors that negate their advantages. Lithium 2-trifluoromethyl-4,5-dicyanoirnidazolide (LiTDI) is a new salt that was designed specifically for high-voltage cells. In this study we demonstrate that in carbonate electrolytes, LiTDI prevents anodic dissolution of Al current collectors, which places it into a select group of corrosion inhibitors. However, we also demonstrate that LiTDI becomes reduced on lithiated graphite, undergoing sequential defluorination and yielding a thick and resistive solid-electrolyte interphase (SEI), which increases impedance and lowers electrode capacity. The mechanistic causes for this behavior are examined using computational chemistry methods in light of recent spectroscopic studies. We demonstrate that LiTDI reduction can be prevented by certain electrolyte additives, which include fluoroethylene carbonate, vinylene carbonate, and lithium bis(oxalato)borate. This beneficial: action is due to preferential reduction of these additives over LiTDI at a higher potential vs Li/Li+, so the resulting SEI can prevent the direct reduction of LiTDI at lower potentials on the graphite electrode. C1 [Shkrob, Ilya A.; Gilbert, James A.; Trask, Stephen E.; Ahraham, Daniel P.] Argonne Natl Lab, Mat Engn Res Facil, Chem Sci & Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. [Pupek, Krzysztof Z.] Argonne Natl Lab, Mat Engn Res Facil, Div Energy Syst, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Shkrob, IA; Ahraham, DP (reprint author), Argonne Natl Lab, Mat Engn Res Facil, Chem Sci & Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. EM shkrob@anl.gov; abraham@anl.gov FU U.S. Department of Energy's Vehicle Technologies Program (DOE-VTP); US-DOE Office of Science, Division of Chemical Sciences, Geosciences, and Biosciences; Applied Battery Research (ABR) for Transportation Program; U.S. Department of Energy Office of Science laboratory [DE-AC02-06CH11357] FX This work was supported by the U.S. Department of Energy's Vehicle Technologies Program (DOE-VTP). Support from the US-DOE Office of Science, Division of Chemical Sciences, Geosciences, and Biosciences is also acknowledged. The electrodes and cells used in this article were fabricated at Argonne's Cell Analysis, Modeling, and Prototyping (CAMP) Facility; the electrolytes were prepared at Argonne's Materials Engineering Research Facility (MERF). Both facilities are supported within the core funding of the Applied Battery Research (ABR) for Transportation Program. The submitted manuscript has been created by UChicago Argonne, LLC, Operator of Argonne National Laboratory ("Argonne"). Argonne, a U.S. Department of Energy Office of Science laboratory, is operated under Contract No. DE-AC02-06CH11357. The U.S. Government retains for itself, and others acting on its behalf, a paid-up nonexclusive, irrevocable worldwide license in said article to reproduce, prepare derivative works, distribute copies to the public, and perform publicly and display publicly, by or on behalf of the Government. NR 55 TC 0 Z9 0 U1 21 U2 21 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 22 PY 2016 VL 120 IS 50 BP 28463 EP 28471 DI 10.1021/acs.jpcc.6b09837 PG 9 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG0PV UT WOS:000390735600011 ER PT J AU Liu, DJ Zahariev, F Gordon, MS Evans, JW AF Liu, Da-Jiang Zahariev, Federico Gordon, Mark S. Evans, James W. TI Predictive Beyond-Mean-Field Rate Equations for Multisite Lattice-Gas Models of Catalytic Surface Reactions: CO Oxidation on Pd(100) SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID MONTE-CARLO-SIMULATION; AUGMENTED-WAVE METHOD; METAL-SURFACES; 1ST PRINCIPLES; PD SURFACES; BASIS-SET; ADSORPTION; KINETICS; DIFFUSION; OXYGEN AB Tailored multisite lattice-gas (msLG) models are developed for CO oxidation on Pd(100) at low-pressures. These models include multiple adsorption site types and superlattice adlayer ordering due to short-range exclusion for highly mobile reactant adspecies. However, they are simplified to neglect longer-range weaker adspecies interactions, so that the key energetic parameters are the CO desorption barrier and the reaction barrier. We discuss existing density functional theory results for these energies and present additional analysis for CO adsorption. After also including an appropriate nontrivial specification of the dynamics of adsorption onto mixed reactant adlayers, we develop rate equations for the reaction kinetics. Our formulation goes beyond traditional mean-field (MF) Langmuirian treatments by accounting for multiple adsorption sites and for the strong spatial correlations associated with superlattice ordering. Specifically, we utilize factorization approximations based on appropriate site motifs, and also Fade resummation of exact low-coverage expansions for sticking coefficients. Our beyond-MF rate equations are successful in accurately predicting key aspects of reactive steady-state behavior, and thus expand the utility of rate equation formulations in surface chemistry. This is confirmed by comparison with precise kinetic Monte Carlo simulation results. Specifically, we not only assess bistability and criticality observed for CO oxidation but also find more complex multistability associated with symmetry-breaking transitions in high-coverage CO adlayers. C1 [Liu, Da-Jiang; Zahariev, Federico; Gordon, Mark S.; Evans, James W.] US DOE, Ames Lab, Ames, IA 50011 USA. [Gordon, Mark S.] Iowa State Univ, Dept Chem, Ames, IA 50011 USA. [Evans, James W.] Iowa State Univ, Dept Math, Ames, IA 50011 USA. [Evans, James W.] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. RP Liu, DJ; Evans, JW (reprint author), US DOE, Ames Lab, Ames, IA 50011 USA.; Evans, JW (reprint author), Iowa State Univ, Dept Math, Ames, IA 50011 USA.; Evans, JW (reprint author), Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. EM dajiang@ameslab.gov; evans@ameslab.gov OI Evans, James/0000-0002-5806-3720 FU U.S. Department of Energy (USDOE), Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences through the Ames Laboratory Chemical Physics program; USDOE by Iowa State University [DE-AC02-07CH11358] FX We thank M.W. Schmidt for useful suggestions regarding quantum chemistry analysis. This work was supported by the U.S. Department of Energy (USDOE), Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences through the Ames Laboratory Chemical Physics program. We acknowledge the use of NERSC computational resources for analysis of CO adsorption energetics. The work was performed at Ames Lab oratory which is operated for the USDOE by Iowa State University under Contract No. DE-AC02-07CH11358. NR 60 TC 0 Z9 0 U1 9 U2 9 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 22 PY 2016 VL 120 IS 50 BP 28639 EP 28653 DI 10.1021/acs.jpcc.6b10102 PG 15 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG0PV UT WOS:000390735600029 ER PT J AU Zenyuk, IV Lamibrac, A Eller, J Parkinson, DY Marone, F Buchi, FN Weber, AZ AF Zenyuk, Iryna V. Lamibrac, Adrien Eller, Jens Parkinson, Dilworth Y. Marone, Federica Buchi, Felix N. Weber, Adam Z. TI Investigating Evaporation in Gas Diffusion Layers for Fuel Cells with X-ray Computed Tomography SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID MEMBRANE-ELECTRODE ASSEMBLIES; LIQUID WATER SATURATION; POROUS-MEDIA; PHYSICAL DEGRADATION; COLD START; TRANSPORT; MICROSCOPY; MODEL; NETWORK; PEFC AB Understanding evaporation in porous media and the associated water distribution for a given saturation is critical for optimizing many different technologies including polymer electrolyte fuel cells. In these devices, heat and mass-transport are coupled due to the two-phase '5 transport of water and operating temperatures from subzero to 80 degrees C. Especially critical is understanding phase change in the mixed wettability, carbon gas-diffusion layers (GDLs). While previous works have measured evaporation rates empirically for a given saturation, there remains a need to explore the mechanisms governing evaporation, which are tied directly to the internal water distribution. In this article, liquid-water evaporation rates in GDLs are measured in situ using synchrotron X-ray computed tomography (CT). X-ray CT allows visualizing the evaporating water-front 10-cation and interfacial water/air surface area, thereby enabling true surface-area based evaporation rates. It is found that the overall specific evaporation rate is essentially constant as a function of saturation and that the water/air interfacial area scales almost linearly with saturation. To isolate transport and kinetic contributions to the overall evaporation rate, we systematically varied gas flow rate and composition. A three-dimensional mathematical model with direct meshes of liquid-water evaporation fronts from the X-ray CT studies allowed for the determination that the evaporation is transport limited. The overall results provide insight into evaporation phenomena in porous media. C1 [Zenyuk, Iryna V.] Tufts Univ, Dept Mech Engn, Medford, MA 02155 USA. [Lamibrac, Adrien; Eller, Jens; Buchi, Felix N.] Paul Scherrer Inst, Electrochem Lab, CH-5232 Villigen, Switzerland. [Marone, Federica] Paul Scherrer Inst, Swiss Light Source, CH-5232 Villigen, Switzerland. [Weber, Adam Z.] Lawrence Berkeley Natl Lab, Energy Storage & Distributed Resources Div, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Parkinson, Dilworth Y.] Lawrence Berkeley Natl Lab, Adv Light Source, 1 Cyclotron Rd, Berkleey, CA 94720 USA. RP Zenyuk, IV (reprint author), Tufts Univ, Dept Mech Engn, Medford, MA 02155 USA. EM iryna.zenyuk@tufts.edu RI Marone, Federica/J-4420-2013; Buchi, Felix/K-9247-2015; OI Buchi, Felix/0000-0002-3541-4591; Weber, Adam/0000-0002-7749-1624; Zenyuk, Iryna/0000-0002-1612-0475 FU Fuel Cell Performance and Durability Consortium (FC PAD) - Energy Efficiency and Renewable Energy, Fuel Cell Technologies Office, of the U.S. Department of Energy [DE-AC02-05CH11231]; Program Development Managers Dimitrios Papageorgopoulos and Greg Been; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX We thank Prof. Jeff Gostick for insightful discussions. This work was funded under the Fuel Cell Performance and Durability Consortium (FC PAD) funded by the Energy Efficiency and Renewable Energy, Fuel Cell Technologies Office, of the U.S. Department of Energy under contract number DE-AC02-05CH11231, Program Development Managers Dimitrios Papageorgopoulos and Greg Been. The Advanced Light Source is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. The work performed at PSI and SLS was carried out in the framework of the Swiss Competence Center for Energy Research (SCCER). Technical support by T. Gloor and M. Hottiger (both PSI) is gratefully acknowledged. NR 51 TC 0 Z9 0 U1 10 U2 10 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 22 PY 2016 VL 120 IS 50 BP 28701 EP 28711 DI 10.1021/acs.jpcc.6b10658 PG 11 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG0PV UT WOS:000390735600035 ER PT J AU Sifain, AE Bjorgaard, JA Myers, TW Veauthier, JM Chavez, DE Prezhdo, OV Scharff, RJ Tretiak, S AF Sifain, Andrew E. Bjorgaard, Josiah A. Myers, Thomas W. Veauthier, Jackie M. Chavez, David E. Prezhdo, Oleg V. Scharff, R. Jason Tretiak, Sergei TI Photoactive Excited States in Explosive Fe(II) Tetrazine Complexes: A Time-Dependent Density Functional Theory Study SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID TRANSITION-METAL-COMPLEXES; EMITTING ELECTROCHEMICAL-CELLS; CYCLOMETALATED IRIDIUM(III) COMPLEXES; IGNITABLE PRIMARY EXPLOSIVES; EFFECTIVE CORE POTENTIALS; ELECTROLUMINESCENT DEVICES; BASIS-SET; MOLECULAR CALCULATIONS; 2-PHOTON ABSORPTION; ENERGETIC MATERIALS AB Time-dependent density functional theory was used to investigate optical absorption of novel Fe(II) coordination complexes with tetrazine ligands. These octahedral compounds absorb near-infrared (NIR) light and can be applied as secondary explosives with low laser-initiation thresholds compared to pentaerythritol tetranitrate. Herein, numerous ligand architectures are studied to determine relationships between molecular structure and optical absorption in order to tune the low-energy charge transfer (CT) band. Geometrical structures and vertical excitation energies calculated with the TPSSh density functional and 6-311G basis set are in excellent agreement with experiment, with a maximum deviation from UV-vis spectra of 0.10 eV. By altering molecular substituents of the ligand scaffold, the CT band can be tuned between 500 and 1100 nm. Additional conjugation in the ligand scaffold pushes the CT band into the NIR region of the spectrum. Triazolo-tetrazine ligands shift the CT band by approximately 0.70 eV relative to that of Fe(II) coordinated with bipyridine ligands. Oxygenated analogues of several compounds are also studied in order to predict optical response, while improving explosive performance. A natural population analysis suggests that the high nitrogen content of the ligand scaffolds in these energetic compounds lessens their metal-to-ligand charge transfer character compared to that of Fe(II) coordinated with bipyridine ligands. The proposed model quantum chemistry is used to establish structure property relationships for optical properties in this class of materials in order to make optical initiation with conventional lasers a more feasible approach. C1 [Sifain, Andrew E.; Prezhdo, Oleg V.] Univ Southern Calif, Dept Phys & Astron, Los Angeles, CA 90089 USA. [Sifain, Andrew E.; Bjorgaard, Josiah A.; Tretiak, Sergei] Los Alamos Natl Lab, Ctr Nonlinear Studies, Los Alamos, NM 87545 USA. [Bjorgaard, Josiah A.; Tretiak, Sergei] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. [Myers, Thomas W.; Veauthier, Jackie M.; Chavez, David E.] Los Alamos Natl Lab, Div Chem, Los Alamos, NM 87545 USA. [Prezhdo, Oleg V.] Univ Soouthern Calif, Dept Chem, Los Angeles, CA 90089 USA. [Scharff, R. Jason] Los Alamos Natl Lab, Explos Sci & Shock Phys Div, Los Alamos, NM 87545 USA. [Tretiak, Sergei] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. RP Tretiak, S (reprint author), Los Alamos Natl Lab, Ctr Nonlinear Studies, Los Alamos, NM 87545 USA.; Tretiak, S (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA.; Scharff, RJ (reprint author), Los Alamos Natl Lab, Explos Sci & Shock Phys Div, Los Alamos, NM 87545 USA.; Tretiak, S (reprint author), Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. EM scharff@lanl.gov; serg@lanl.gov RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU U.S. Department of Energy through the Los Alamos National Laboratory (LANL) LDRD Program; U.S. Department of Energy [DE-AC52-06NA25396]; US Department of Energy [DE-SC0014429] FX The authors acknowledge support of the U.S. Department of Energy through the Los Alamos National Laboratory (LANL) LDRD Program. LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. This work was done in part at the Center for Nonlinear Studies (CNLS) and the Center for Integrated Nanotechnology (CINT) at LANL. We also acknowledge the LANL Institutional Computing (IC) program for providing computational resources. O.V.P. and A.E.S. acknowledge support of the US Department of Energy, Grant No. DE-SC0014429. A.E.S. thanks CNLS for their hospitality. NR 92 TC 2 Z9 2 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 22 PY 2016 VL 120 IS 50 BP 28762 EP 28773 DI 10.1021/acs.jpcc.6b10333 PG 12 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EG0PV UT WOS:000390735600042 ER PT J AU Chappell, MD Li, RH Smith, SC Dressman, BA Tromiczak, EG Tripp, AE Blanco, MJ Vetman, T Quimby, SJ Matt, J Britton, TC Fivush, AM Schkeryantz, JM Mayhugh, D Erickson, JA Bures, MG Jaramillo, C Carpintero, M de Diego, JE Barberis, M Garcia-Cerrada, S Soriano, JF Antonysamy, S Atwell, S MacEwan, L Condon, B Sougias, C Wang, J Zhang, AP Conners, K Groshong, C Wasserman, SR Koss, JW Witkin, JM Li, X Overshiner, C Wafford, KA Seidel, W Wang, XS Heinz, BA Swanson, S Catlow, JT Bedwell, DW Monn, JA Mitch, CH Ornstein, PL AF Chappell, Mark D. Li, Renhua Smith, Stephon C. Dressman, Bruce A. Tromiczak, Eric G. Tripp, Allie E. Blanco, Maria-Jesus Vetman, Tatiana Quimby, Steven J. Matt, James Britton, Thomas C. Fivush, Adam M. Schkeryantz, Jeffrey M. Mayhugh, Daniel Erickson, Jon A. Bures, Mark G. Jaramillo, Carlos Carpintero, Mercedes Eugenio de Diego, Jose Barberis, Mario Garcia-Cerrada, Susana Soriano, Jose F. Antonysamy, Stephen Atwell, Shane MacEwan, Lain Condon, Bradley Sougias, Christine Wang, Jing Zhang, Aiping Conners, Kris Groshong, Chris Wasserman, Stephen R. Koss, John W. Witkin, Jeffrey M. Li, Xia Overshiner, Carl Wafford, Keith A. Seidel, Wesley Wang, Xu-Shan Heinz, Beverly A. Swanson, Steven Catlow, John T. Bedwell, David W. Monn, James A. Mitch, Charles H. Ornstein, Paul L. TI Discovery of (1S,2R,3S,4S,5R,6R)-2-Amino-3-[(3,4-difluorophenyl)sulfanylmethyl]-4-hyd roxy-bicyclo[3.1.0]hexane-2,6-dicarboxylic Acid Hydrochloride (LY3020371 center dot HCl): A Potent, Metabotropic Glutamate 2/3 Receptor Antagonist with Antidepressant-Like Activity SO JOURNAL OF MEDICINAL CHEMISTRY LA English DT Article ID RESISTANT MAJOR DEPRESSION; GROUP-II; PHARMACOLOGICAL CHARACTERIZATION; MGLU2/3 RECEPTORS; TERM DEPRESSION; MOOD DISORDERS; PERFORANT PATH; DENTATE GYRUS; ANIMAL-MODELS; IN-VITRO AB As part of our ongoing efforts to identify novel ligands for the metabotropic glutamate 2 and 3 (mGlu(2/3)) receptors, we have incorporated substitution at the C3 and C4 positions of the (1.5,2R,SR,6R)-2-amino-bicydo[3.1.0]hexane-2,6-dicarboxylic acid scaffold to generate rnGlu(2/3) antagonists. Exploration of this structure-activity relationship (SAR) led to the identification of (15,2R,35,4S,A6R)-2-amino-3-[(3,4-difluorophenyl) sulfanylmethyl]-4-hydroxy-bicyclo [3.1.0] hexane-2,6-dicarboxylic acid hydrochloride (LY3020371 center dot HCl, 19f), a potent, selective, and maximally efficacious mGlu(2/3) antagonist. Further characterization of compound 19f binding to the human metabotropic 2 glutamate (hmGlu(2)) site was established by cocrystallization of this molecule with the amino terminal domain (ATD) of the hmGlu(2) receptor protein. The resulting cocrystal structure revealed the specific ligand protein interactions, which likely explain the high affinity of 19f for this site and support its functional mGlu(2) antagonist pharmacology. Further characterization of 19f in vivo demonstrated an antidepressant-like signature in the mouse forced-swim test (mFST) assay when brain levels of this compound exceeded the cellular mGlu(2) IC50 value. C1 [Chappell, Mark D.; Li, Renhua; Smith, Stephon C.; Dressman, Bruce A.; Tromiczak, Eric G.; Tripp, Allie E.; Blanco, Maria-Jesus; Vetman, Tatiana; Quimby, Steven J.; Matt, James; Britton, Thomas C.; Fivush, Adam M.; Schkeryantz, Jeffrey M.; Mayhugh, Daniel; Erickson, Jon A.; Bures, Mark G.; Monn, James A.; Mitch, Charles H.; Ornstein, Paul L.] Eli Lilly & Co, Discovery Chem Res & Technol Med Chem, Indianapolis, IN 46285 USA. [Wang, Xu-Shan; Heinz, Beverly A.] Eli Lilly & Co, Quantitat Biol, Indianapolis, IN 46285 USA. [Jaramillo, Carlos; Carpintero, Mercedes; Eugenio de Diego, Jose; Barberis, Mario; Garcia-Cerrada, Susana; Soriano, Jose F.] Ctr Invest Lilly SA, Discovery Chem Synth Grp, Avda Ind,30 Alcobendas, Madrid 28108, Spain. [Antonysamy, Stephen; Atwell, Shane; MacEwan, Lain; Condon, Bradley; Sougias, Christine; Wang, Jing; Zhang, Aiping; Conners, Kris; Groshong, Chris] Eli Lilly & Co, Lilly Biotechnol Ctr, Struct Biol, San Diego, CA 92121 USA. [Wasserman, Stephen R.; Koss, John W.] Eli Lilly & Co, Adv Photon Source, Argonne Natl Lab, Struct Biol, Bldg 438A,9700 South Cass Ave, Argonne, IL 60439 USA. [Wafford, Keith A.; Seidel, Wesley] Eli Lilly & Co, Neurosci Res, Erl Wood Manor, Sunninghill Rd, Windlesham GU20 6PH, Surrey, England. [Swanson, Steven; Catlow, John T.; Bedwell, David W.] Eli Lilly & Co, Drug Disposit, Indianapolis, IN 46285 USA. [Witkin, Jeffrey M.; Li, Xia; Overshiner, Carl] Eli Lilly & Co, Neurosci Res, Indianapolis, IN 46285 USA. RP Chappell, MD (reprint author), Eli Lilly & Co, Discovery Chem Res & Technol Med Chem, Indianapolis, IN 46285 USA. EM chappell_mark@lilly.com RI Blanco, Maria-Jesus/E-4313-2017 OI Blanco, Maria-Jesus/0000-0003-4333-365X FU DOE Office of Science [DE-AC02-06CH11357] FX The authors wish to thank Marijane Russell, Sonal T. Sojitra, David W. Smith, and Laura L. Morisco for support in the acquisition of the crystallographic data. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. Use of the Lilly Research Laboratories Collaborative Access Team (LRL-CAT) beamline at Sector 31 of the Advanced Photon Source was provided by Eli Lilly Company, which operates the facility. NR 65 TC 1 Z9 1 U1 3 U2 3 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0022-2623 EI 1520-4804 J9 J MED CHEM JI J. Med. Chem. PD DEC 22 PY 2016 VL 59 IS 24 BP 10974 EP 10993 DI 10.1021/acs.jmedchem.6b01119 PG 20 WC Chemistry, Medicinal SC Pharmacology & Pharmacy GA EG0PU UT WOS:000390735500010 PM 28002967 ER PT J AU Rahman, A Majewski, PW Doerk, G Black, CT Yager, KG AF Rahman, Atikur Majewski, Pawel W. Doerk, Gregory Black, Charles T. Yager, Kevin G. TI Non-native three-dimensional block copolymer morphologies SO NATURE COMMUNICATIONS LA English DT Article ID THIN-FILMS; DIBLOCK COPOLYMERS; MONTE-CARLO; PATTERNS; CONFINEMENT; BLENDS; MELTS; THERMODYNAMICS; NANOPARTICLES; TRANSITION AB Self-assembly is a powerful paradigm, wherein molecules spontaneously form ordered phases exhibiting well-defined nanoscale periodicity and shapes. However, the inherent energyminimization aspect of self-assembly yields a very limited set of morphologies, such as lamellae or hexagonally packed cylinders. Here, we show how soft self-assembling materials-block copolymer thin films-can be manipulated to form a diverse library of previously unreported morphologies. In this iterative assembly process, each polymer layer acts as both a structural component of the final morphology and a template for directing the order of subsequent layers. Specifically, block copolymer films are immobilized on surfaces, and template successive layers through subtle surface topography. This strategy generates an enormous variety of three-dimensional morphologies that are absent in the native block copolymer phase diagram. C1 [Rahman, Atikur; Majewski, Pawel W.; Doerk, Gregory; Black, Charles T.; Yager, Kevin G.] Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. RP Black, CT; Yager, KG (reprint author), Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. EM ctblack@bnl.gov; kyager@bnl.gov FU U.S. Department of Energy, Office of Basic Energy Sciences [DE-SC0012704] FX Research carried out at the Center for Functional Nanomaterials, and the National Synchrotron Light Source II, Brookhaven National Laboratory, which are supported by the U.S. Department of Energy, Office of Basic Energy Sciences, under Contract No. DE-SC0012704. We thank the Dow Chemical Company for providing the chemical brush material. NR 70 TC 1 Z9 1 U1 50 U2 50 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 22 PY 2016 VL 7 AR 13988 DI 10.1038/ncomms13988 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF4HK UT WOS:000390285600001 PM 28004774 ER PT J AU Talou, P Kawano, T Stetcu, I Lestone, JP McKigney, E Chadwick, MB AF Talou, P. Kawano, T. Stetcu, I. Lestone, J. P. McKigney, E. Chadwick, M. B. TI Late-time emission of prompt fission gamma rays SO PHYSICAL REVIEW C LA English DT Article ID NUCLEAR-DATA; CF-252; FRAGMENTS; PU-239(N,F); U-235(N,F); MODEL AB The emission of prompt fission gamma rays within a few nanoseconds to a few microseconds following the scission point is studied in the Hauser-Feshbach formalism applied to the deexcitation of primary excited fission fragments. Neutron and gamma-ray evaporations from fully accelerated fission fragments are calculated in competition at each stage of the decay, and the role of isomers in the fission products, before beta decay, is analyzed. The time evolution of the average total gamma-ray energy, the average total gamma-ray multiplicity, and the fragment-specific gamma-ray spectra is presented in the case of neutron-induced fission reactions of U-235 and Pu-239, as well as spontaneous fission of Cf-252. The production of specific isomeric states is calculated and compared to available experimental data. About 7% of all prompt fission. rays are predicted to be emitted between 10 ns and 5 mu s following fission, in the case of U-235 and Pu-239 (nth, f) reactions, and up to 3% in the case of Cf-252 spontaneous fission. The cumulative average total gamma-ray energy increases by 2% to 5% in the same time interval. Finally, those results are shown to be robust against significant changes in the model input parameters. C1 [Talou, P.; Kawano, T.; Stetcu, I.; Lestone, J. P.; McKigney, E.; Chadwick, M. B.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. RP Talou, P (reprint author), Los Alamos Natl Lab, Los Alamos, NM 87545 USA. EM talou@lanl.gov FU National Nuclear Security Administration of the US Department of Energy at Los Alamos National Laboratory [DE-AC52-06NA25396]; Office of Defense Nuclear Nonproliferation Research & Development (DNN R&D), National Nuclear Security Administration, US Department of Energy FX We would like to acknowledge stimulating discussions with S. Oberstedt, A. Oberstedt, F.-J. Hambsch, A. Gook, N. Carjan, M. Jandel, C. Walker, and A. Tonchev. This work was performed at Los Alamos National Laboratory, under the auspices of the National Nuclear Security Administration of the US Department of Energy at Los Alamos National Laboratory under Contract No. DE-AC52-06NA25396. This work was partly supported by the Office of Defense Nuclear Nonproliferation Research & Development (DNN R&D), National Nuclear Security Administration, US Department of Energy. NR 36 TC 0 Z9 0 U1 4 U2 4 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 22 PY 2016 VL 94 IS 6 AR 064613 DI 10.1103/PhysRevC.94.064613 PG 10 WC Physics, Nuclear SC Physics GA EF4AA UT WOS:000390265500001 ER PT J AU Clair, G Piehowski, PD Nicola, T Kitzmiller, JA Huang, EL Zink, EM Sontag, RL Orton, DJ Moore, RJ Carson, JP Smith, RD Whitsett, JA Corley, RA Ambalavanan, N Ansong, C AF Clair, Geremy Piehowski, Paul D. Nicola, Teodora Kitzmiller, Joseph A. Huang, Eric L. Zink, Erika M. Sontag, Ryan L. Orton, Daniel J. Moore, Ronald J. Carson, James P. Smith, Richard D. Whitsett, Jeffrey A. Corley, Richard A. Ambalavanan, Namasivayam Ansong, Charles TI Spatially-Resolved Proteomics: Rapid Quantitative Analysis of Laser Capture Microdissected Alveolar Tissue Samples SO SCIENTIFIC REPORTS LA English DT Article ID EPITHELIAL-MESENCHYMAL TRANSITION; IONIZATION-MASS-SPECTROMETRY; GLYCATION END-PRODUCTS; LUNG DEVELOPMENT; MOUSE LUNG; NANOELECTROSPRAY IONIZATION; LIQUID-CHROMATOGRAPHY; EPIGENETIC REGULATION; PULMONARY-FIBROSIS; LABEL-FREE AB Laser capture microdissection (LCM)-enabled region-specific tissue analyses are critical to better understand complex multicellular processes. However, current proteomics workflows entail several manual sample preparation steps and are challenged by the microscopic mass-limited samples generated by LCM, impacting measurement robustness, quantification and throughput. Here, we coupled LCM with a proteomics workflow that provides fully automated analysis of proteomes from microdissected tissues. Benchmarking against the current state-of-the-art in ultrasensitive global proteomics (FASP workflow), our approach demonstrated significant improvements in quantification (similar to 2-fold lower variance) and throughput (> 5 times faster). Using our approach we for the first time characterized, to a depth of > 3,400 proteins, the ontogeny of protein changes during normal lung development in microdissected alveolar tissue containing only 4,000 cells. Our analysis revealed seven defined modules of coordinated transcription factor-signaling molecule expression patterns, suggesting a complex network of temporal regulatory control directs normal lung development with epigenetic regulation fine-tuning pre-natal developmental processes. C1 [Clair, Geremy; Piehowski, Paul D.; Huang, Eric L.; Zink, Erika M.; Sontag, Ryan L.; Orton, Daniel J.; Moore, Ronald J.; Smith, Richard D.; Corley, Richard A.; Ansong, Charles] Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99352 USA. [Nicola, Teodora; Ambalavanan, Namasivayam] Univ Alabama Birmingham, Dept Pediat, Birmingham, AL 35249 USA. [Kitzmiller, Joseph A.; Whitsett, Jeffrey A.] Cincinnati Childrens Hosp Med Ctr, Div Pulm Biol, Cincinnati, OH 45229 USA. [Carson, James P.] Univ Texas Austin, Texas Adv Comp Ctr, Austin, TX 78712 USA. RP Ansong, C (reprint author), Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99352 USA. EM charles.ansong@pnnl.gov RI Smith, Richard/J-3664-2012; OI Smith, Richard/0000-0002-2381-2349; Ambalavanan, Namasivayam/0000-0003-0731-9092; Piehowski, Paul/0000-0001-5108-2227 FU National Heart Lung Blood Institute of NIH [U01 HL122703, U01 HL122626, U01 HL122642]; National Institute of General Medical Sciences of NIH [P41 GM103493] FX Portions of this research were supported by grants from the National Heart Lung Blood Institute of NIH (U01 HL122703, U01 HL122626, and U01 HL122642) and National Institute of General Medical Sciences of NIH (P41 GM103493). Work was performed in W. R. Wiley Environmental Molecular Sciences Laboratory (EMSL), a Department Of Energy (DOE) office of Biological and Environmental Research (BER) national user facility located at Pacific Northwest National Laboratory (PNNL). We thank Mr. Cortland Johnson for graphic art assistance in drawing images in Fig. 1. NR 72 TC 0 Z9 0 U1 10 U2 10 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 22 PY 2016 VL 6 AR 39223 DI 10.1038/srep39223 PG 13 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF4NH UT WOS:000390305700001 PM 28004771 ER PT J AU Williams, GJ Lee, S Walko, DA Watson, MA Jo, W Lee, DR Landahl, EC AF Williams, G. Jackson Lee, Sooheyong Walko, Donald A. Watson, Michael A. Jo, Wonhuyk Lee, Dong Ryeol Landahl, Eric C. TI Direct measurements of multi-photon induced nonlinear lattice dynamics in semiconductors via time-resolved x-ray scattering SO SCIENTIFIC REPORTS LA English DT Article ID FREE-ELECTRON LASER; 2-PHOTON ABSORPTION; SATURABLE ABSORBER; GAAS; DIFFRACTION; STRAIN; VISUALIZATION; TRANSISTOR; EMISSION; CRYSTALS AB Nonlinear optical phenomena in semiconductors present several fundamental problems in modern optics that are of great importance for the development of optoelectronic devices. In particular, the details of photo-induced lattice dynamics at early time-scales prior to carrier recombination remain poorly understood. We demonstrate the first integrated measurements of both optical and structural, material-dependent quantities while also inferring the bulk impulsive strain profile by using high spatial-resolution time-resolved x-ray scattering (TRXS) on bulk crystalline gallium arsenide. Our findings reveal distinctive laser-fluence dependent crystal lattice responses, which are not described by previous TRXS experiments or models. The initial linear expansion of the crystal upon laser excitation stagnates at a laser fluence corresponding to the saturation of the free carrier density before resuming expansion in a third regime at higher fluences where two-photon absorption becomes dominant. Our interpretations of the lattice dynamics as nonlinear optical effects are confirmed by numerical simulations and by additional measurements in an n-type semiconductor that allows higher-order nonlinear optical processes to be directly observed as modulations of x-ray diffraction lineshapes. C1 [Williams, G. Jackson; Watson, Michael A.; Landahl, Eric C.] De Paul Univ, Dept Phys, Chicago, IL 60614 USA. [Williams, G. Jackson; Jo, Wonhuyk] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Lee, Sooheyong] KRISS, Frontier Extreme Phys, Daejeon 305340, South Korea. [Lee, Sooheyong] UST, Dept Nanosci, Daejeon 305350, South Korea. [Walko, Donald A.] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA. [Jo, Wonhuyk; Lee, Dong Ryeol] Soong Sil Univ, Dept Phys, Seoul 06978, South Korea. RP Lee, S (reprint author), KRISS, Frontier Extreme Phys, Daejeon 305340, South Korea.; Lee, S (reprint author), UST, Dept Nanosci, Daejeon 305350, South Korea. EM sooheyong@gmail.com FU National Research Foundation of Korea [NRF-2016K1A3A7A09005386, NRF-2016R1A6B2A02005468]; DePaul University; Research Corporation for Science Advancement; Converging Research Center Program through the Ministry of Science, ICT and Future Planning [NRF-2014M1A7A1A01030128]; Argonne National Laboratory [DE-AC02-06CH11357]; [NRF-2016K1A3A7A09005585] FX S.L. and W.J. were supported by the National Research Foundation of Korea (NRF-2016K1A3A7A09005386 and NRF-2016R1A6B2A02005468). D.R.L. was supported by NRF-2016K1A3A7A09005585. E.C.L. was supported in part by a DePaul University URC research leave. E.C.L. and M.A.W. were supported by the Research Corporation for Science Advancement. R. Coleman made significant financial contributions to this project. The research was supported by the Converging Research Center Program through the Ministry of Science, ICT and Future Planning (NRF-2014M1A7A1A01030128). This research used resources of the Advanced Photon Source, a U.S. Department Of Energy Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. We acknowledge useful discussions with D.A. Reis. NR 50 TC 0 Z9 0 U1 3 U2 3 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 22 PY 2016 VL 6 AR 39506 DI 10.1038/srep39506 PG 10 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF4OE UT WOS:000390308700001 PM 28004757 ER PT J AU Nazarov, R Majevadia, JS Patel, M Wenman, MR Balint, DS Neugebauer, J Sutton, AP AF Nazarov, R. Majevadia, J. S. Patel, M. Wenman, M. R. Balint, D. S. Neugebauer, J. Sutton, A. P. TI First-principles calculation of the elastic dipole tensor of a point defect: Application to hydrogen in alpha-zirconium SO PHYSICAL REVIEW B LA English DT Article ID INITIO MOLECULAR-DYNAMICS; TOTAL-ENERGY CALCULATIONS; AUGMENTED-WAVE METHOD; AB-INITIO; IONIC-CRYSTALS; BASIS-SET; METALS; HCP AB The elastic dipole tensor is a fundamental quantity relating the elastic field and atomic structure of a point defect. We review three methods in the literature to calculate the dipole tensor and apply them to hydrogen in alpha-zirconium using density functional theory (DFT). The results are compared with the dipole tensor deduced from earlier experimental measurements of the lambda tensor for hydrogen in alpha-zirconium. There are significant errors with all three methods. We show that calculation of the lambda tensor, in combination with experimentally measured elastic constants and lattice parameters, yields dipole tensor components that differ from experimental values by only 10%-20%. There is evidence to suggest that current state-of-the-art DFT calculations underestimate bonding between hydrogen and alpha-zirconium. C1 [Nazarov, R.] Lawrence Livermore Natl Lab, Div Phys, 7000 East Ave, Livermore, CA 94550 USA. [Majevadia, J. S.; Patel, M.; Sutton, A. P.] Imperial Coll London, Dept Phys, Exhibit Rd, London SW7 2AZ, England. [Wenman, M. R.] Imperial Coll London, Dept Mat, Exhibit Rd, London SW7 2AZ, England. [Balint, D. S.] Imperial Coll London, Dept Mech Engn, Exhibit Rd, London SW7 2AZ, England. [Neugebauer, J.] Max Planck Inst Eisenforsch GmbH, Max Planck Str, D-40237 Dusseldorf, Germany. RP Sutton, AP (reprint author), Imperial Coll London, Dept Phys, Exhibit Rd, London SW7 2AZ, England. EM a.sutton@imperial.ac.uk FU U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344]; EPSRC Centre for Doctoral Training on Theory and Simulation of Materials [EP/G036888/1]; Rolls-Royce plc FX Work by R.N. was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract No. DE-AC52-07NA27344. J.S.M and M.P. were supported by the EPSRC Centre for Doctoral Training on Theory and Simulation of Materials funded through EP/G036888/1. M.P. also received support from Rolls-Royce plc. NR 33 TC 0 Z9 0 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 21 PY 2016 VL 94 IS 24 AR 241112 DI 10.1103/PhysRevB.94.241112 PG 5 WC Physics, Condensed Matter SC Physics GA EN8FN UT WOS:000396236400001 ER PT J AU Kashif, MK Milhuisen, RA Nippe, M Hellerstedt, J Zee, DZ Duffy, NW Halstead, B De Angelis, F Fantacci, S Fuhrer, MS Chang, CJ Cheng, YB Long, JR Spiccia, L Bach, U AF Kashif, Muhammad K. Milhuisen, Rebecca A. Nippe, Michael Hellerstedt, Jack Zee, David Z. Duffy, Noel W. Halstead, Barry De Angelis, Filippo Fantacci, Simona Fuhrer, Michael S. Chang, Christopher J. Cheng, Yi-Bing Long, Jeffrey R. Spiccia, Leone Bach, Udo TI Cobalt Polypyridyl Complexes as Transparent SolutionProcessable Solid- State Charge Transport Materials SO ADVANCED ENERGY MATERIALS LA English DT Article ID SENSITIZED SOLAR-CELLS; LIGHT-EMITTING-DIODES; ELECTROLYTES; PERFORMANCE AB Charge transport materials (CTMs) are traditionally inorganic semiconductors or metals. However, over the past few decades, new classes of solution-processable CTMs have evolved alongside new concepts for fabricating electronic devices at low cost and with exceptional properties. The vast majority of these novel materials are organic compounds and the use of transition metal complexes in electronic applications remains largely unexplored. Here, a solution-processable solid-state charge transport material composed of a blend of [Co(bpyPY4)](OTf)(2) and Co(bpyPY4)](OTf)(3) where bpyPY4 is the hexadentate ligand 6,6'-bis(1,1-di(pyridin-2-yl) ethyl)-2,2'-bipyridine and OTf-is the trifluoromethanesulfonate anion is reported. Surprisingly, these films exhibit a negative temperature coefficient of conductivity (d sigma/dT) and non-Arrhenius behavior, with respectable solid-state conductivities of 3.0 S m(-1) at room temperature and 7.4 S m(-1) at 4.5 K. When employed as a CTM in a solid-state dye-sensitized solar cell, these largely amorphous, transparent films afford impressive solar energy conversion efficiencies of up to 5.7%. Organic-inorganic hybrid materials with negative temperature coefficients of conductivity generally feature extended flat p-systems with strong p-p interactions or high crystallinity. The lack of these features promotes [Co(bpyPY4)](OTf)(2+x) films as a new class of CTMs with a unique charge transport mechanism that remains to be explored. C1 [Kashif, Muhammad K.; Milhuisen, Rebecca A.; Cheng, Yi-Bing; Bach, Udo] Monash Univ, Dept Mat Sci & Engn, Clayton, Vic 3800, Australia. [Nippe, Michael; Zee, David Z.; Chang, Christopher J.; Long, Jeffrey R.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Nippe, Michael; Chang, Christopher J.] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Nippe, Michael] Texas A&M Univ, Dept Chem, College Stn, TX 77840 USA. [Hellerstedt, Jack; Fuhrer, Michael S.] Monash Univ, Sch Phys, Clayton, Vic 3800, Australia. [Hellerstedt, Jack; Fuhrer, Michael S.] Monash Univ, Monash Ctr Atom Thin Mat, Clayton, Vic 3800, Australia. [Hellerstedt, Jack; Fuhrer, Michael S.] Univ Maryland, Ctr Nanophys & Adv Mat, College Pk, MD 20742 USA. [Duffy, Noel W.; Halstead, Barry; Bach, Udo] CSIRO, Clayton, Vic 3169, Australia. [De Angelis, Filippo; Fantacci, Simona] CNR ISTM, Computat Lab Hybrid Organ Photovolta CLHYO, Via Elce di Sotto 8, I-06123 Perugia, Italy. [De Angelis, Filippo] Ist Italiano Tecnol, CompuNet, Via Morego 30, I-16163 Genoa, Italy. [Chang, Christopher J.] Univ Calif Berkeley, Dept Mol & Cell Biol, 229 Stanley Hall, Berkeley, CA 94720 USA. [Chang, Christopher J.] Univ Calif Berkeley, Howard Hughes Med Inst, Berkeley, CA 94720 USA. [Long, Jeffrey R.] Univ Calif Berkeley, Dept Chem & Biomol Engn, Berkeley, CA 94720 USA. [Spiccia, Leone] Monash Univ, Sch Chem, Clayton, Vic 3800, Australia. RP Bach, U (reprint author), Monash Univ, Dept Mat Sci & Engn, Clayton, Vic 3800, Australia.; Bach, U (reprint author), CSIRO, Clayton, Vic 3169, Australia.; Spiccia, L (reprint author), Monash Univ, Sch Chem, Clayton, Vic 3800, Australia. EM leone.spiccia@monash.edu; udo.bach@monash.edu RI Bach, Udo/F-3880-2012 FU Australian Government through the Australian Research Council (ARC); Australian Renewable Energy Agency (ARENA); CSIRO; ARC Laureate Fellowship [FL120100038]; U.S. NSF [DMR-11-05224]; DOE/LBNL [DE-AC02-05CH11231]; FWP [CH030201]; NSF [CHE-1464841] FX This study was supported by the Australian Government through the Australian Research Council (ARC) and the Australian Renewable Energy Agency (ARENA). The CSIRO provided support through the OCE Science Leader program. M.S.F. was supported by an ARC Laureate Fellowship FL120100038. J.H. was supported by U.S. NSF Award No. DMR-11-05224. Contributions of M.N. and C.J.C. were supported by DOE/LBNL DE-AC02-05CH11231 and FWP CH030201. C.J.C. is an Investigator with the Howard Hughes Medical Institute. Contributions of D.Z.Z. and J.R.L. were supported by NSF Grant No. CHE-1464841. The authors thank Prof. Keith Murray and Dr. Boujemaa Moubaraki for the magnetic and conductivity measurements and valuable discussions. Part of this work was performed at the Melbourne Centre for Nanofabrication (MCN) in the Victorian Node of the Australian National Fabrication Facility (ANFF). NR 26 TC 0 Z9 0 U1 0 U2 0 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1614-6832 EI 1614-6840 J9 ADV ENERGY MATER JI Adv. Energy Mater. PD DEC 21 PY 2016 VL 6 IS 24 AR 1600874 DI 10.1002/aenm.201600874 PG 7 WC Chemistry, Physical; Energy & Fuels; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Energy & Fuels; Materials Science; Physics GA EN9LA UT WOS:000396320500003 ER PT J AU Larson, BW Reid, OG Coffey, DC Avdoshenko, SM Popov, AA Boltalina, OV Strauss, SH Kopidakis, N Rumbles, G AF Larson, Bryon W. Reid, Obadiah G. Coffey, David C. Avdoshenko, Stanislav M. Popov, Alexey A. Boltalina, Olga V. Strauss, Steven H. Kopidakis, Nikos Rumbles, Garry TI Inter-Fullerene Electronic Coupling Controls the Efficiency of Photoinduced Charge Generation in Organic Bulk Heterojunctions SO ADVANCED ENERGY MATERIALS LA English DT Article ID POLYMER SOLAR-CELLS; CONJUGATED POLYMERS; RATIONAL DESIGN; BIS-ADDUCTS; POLY(3-HEXYLTHIOPHENE); PERFORMANCE; MORPHOLOGY; SEPARATION; ACCEPTOR; ENERGY AB Photoinduced charge generation (PCG) dynamics are notoriously difficult to correlate with specific molecular properties in device relevant polymer: fullerene organic photovoltaic blend films due to the highly complex nature of the solid state blend morphology. Here, this study uses six judiciously selected trifluoromethylfullerenes blended with the prototypical polymer poly(3-hexylthiophene) and measure the PCG dynamics in 50 fs-500 ns time scales with time-resolved microwave conductivity and femtosecond transient absorption spectroscopy. The isomeric purity and thorough chemical characterization of the fullerenes used in this study allow for a detailed correlation between molecular properties, driving force, local intermolecular electronic coupling and, ultimately, the efficiency of PCG yield. The findings show that the molecular design of the fullerene not only determines inter-fullerene electronic coupling, but also influences the decay dynamics of free holes in the donor phase even when the polymer microstructure remains unchanged. C1 [Larson, Bryon W.; Boltalina, Olga V.; Strauss, Steven H.; Rumbles, Garry] Colorado State Univ, Dept Chem, 200 W Lake St, Ft Collins, CO 80523 USA. [Larson, Bryon W.; Reid, Obadiah G.; Coffey, David C.; Kopidakis, Nikos; Rumbles, Garry] Natl Renewable Energy Lab, Chem & Nanosci Ctr, 15013 Denver West Pkwy, Golden, CO 80401 USA. [Coffey, David C.] Warren Wilson Coll, Dept Chem & Phys, Swannanoa, NC 28778 USA. [Avdoshenko, Stanislav M.; Popov, Alexey A.] Liebniz Inst Solid State & Mat Res, D-01069 Dresden, Germany. RP Rumbles, G (reprint author), Colorado State Univ, Dept Chem, 200 W Lake St, Ft Collins, CO 80523 USA.; Rumbles, G (reprint author), Natl Renewable Energy Lab, Chem & Nanosci Ctr, 15013 Denver West Pkwy, Golden, CO 80401 USA. EM garry.rumbles@nrel.gov RI Popov, Alexey/A-9937-2011; OI Popov, Alexey/0000-0002-7596-0378; Rumbles, Garry/0000-0003-0776-1462; REID, OBADIAH/0000-0003-0646-3981 FU Solar Photochemistry Program, Division of Chemical Sciences, Geosciences, and Biosciences, Office of Basic Energy Sciences, U.S. Department of Energy (DOE) [DE-AC36-08GO28308]; NSF [CHE-1012468, CHE-1362302] FX We appreciate funding for support for this project from the Solar Photochemistry Program, Division of Chemical Sciences, Geosciences, and Biosciences, Office of Basic Energy Sciences, U.S. Department of Energy (DOE), through contract DE-AC36-08GO28308 to NREL. In addition, O.V.B. and S.H.S. acknowledge funding from the NSF (grants CHE-1012468 and CHE-1362302) for the synthesis, purification and characterization of the fullerene samples. The acknowledgement section was missing in the originally published manuscript. This was added on December 21, 2016. NR 66 TC 0 Z9 0 U1 3 U2 3 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1614-6832 EI 1614-6840 J9 ADV ENERGY MATER JI Adv. Energy Mater. PD DEC 21 PY 2016 VL 6 IS 24 AR 1601427 DI 10.1002/aenm.201601427 PG 11 WC Chemistry, Physical; Energy & Fuels; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Energy & Fuels; Materials Science; Physics GA EN9LA UT WOS:000396320500021 ER PT J AU Senguttuvan, P Han, SD Kim, S Lipson, AL Tepavcevic, S Fister, TT Bloom, ID Burrell, AK Johnson, CS AF Senguttuvan, Premkumar Han, Sang-Don Kim, Soojeong Lipson, Albert L. Tepavcevic, Sanja Fister, Timothy T. Bloom, Ira D. Burrell, Anthony K. Johnson, Christopher S. TI A High Power Rechargeable Nonaqueous Multivalent Zn/V2O5 Battery SO ADVANCED ENERGY MATERIALS LA English DT Article ID SODIUM-ION BATTERIES; HIGH-ENERGY DENSITY; INTERCALATION MECHANISM; ZINC BATTERIES; MAGNESIUM; CATHODE; V2O5; INSERTION; ELECTROLYTES; ALPHA-MNO2 C1 [Senguttuvan, Premkumar; Han, Sang-Don; Kim, Soojeong; Lipson, Albert L.; Tepavcevic, Sanja; Fister, Timothy T.; Burrell, Anthony K.; Johnson, Christopher S.] Argonne Natl Lab, Joint Ctr Energy Storage Res, 9700 S Cass Ave, Argonne, IL 60439 USA. [Senguttuvan, Premkumar; Han, Sang-Don; Kim, Soojeong; Lipson, Albert L.; Fister, Timothy T.; Bloom, Ira D.; Burrell, Anthony K.; Johnson, Christopher S.] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. [Tepavcevic, Sanja] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Johnson, CS (reprint author), Argonne Natl Lab, Joint Ctr Energy Storage Res, 9700 S Cass Ave, Argonne, IL 60439 USA.; Johnson, CS (reprint author), Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. EM cjohnson@anl.gov RI BM, MRCAT/G-7576-2011 FU Joint Center for Energy Storage Research (JCESR), an Energy Innovation Hub - U.S. Department of Energy, Office of Science, Basic Energy Sciences; Argonne, a U.S. Department of Energy Office of Science laboratory [DE-AC02-06CH11357]; DOE Office of Science [DE-AC02-06CH11357] FX P.S. and S.-D.H. contributed equally to this work. The authors thank Dr. B. Genorio for solvent purification. This work was supported as part of the Joint Center for Energy Storage Research (JCESR), an Energy Innovation Hub funded by the U.S. Department of Energy, Office of Science, Basic Energy Sciences. The submitted manuscript was created by UChicago Argonne, LLC, Operator of Argonne National Laboratory ("Argonne"). Argonne, a U.S. Department of Energy Office of Science laboratory, was operated under Contract No. DE-AC02-06CH11357. The U.S. Government retains for itself, and others acting on its behalf, a paid-up nonexclusive, irrevocable worldwide license in said article to reproduce, prepare derivative works, distribute copies to the public, and perform publicly and display publicly, by or on behalf of the Government. MRCAT operations were supported by the Department of Energy and the MRCAT member institutions. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. NR 32 TC 3 Z9 3 U1 13 U2 13 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1614-6832 EI 1614-6840 J9 ADV ENERGY MATER JI Adv. Energy Mater. PD DEC 21 PY 2016 VL 6 IS 24 AR 1600826 DI 10.1002/aenm.201600826 PG 6 WC Chemistry, Physical; Energy & Fuels; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Energy & Fuels; Materials Science; Physics GA EN9LA UT WOS:000396320500001 ER PT J AU Xie, YY Wang, H Xu, GL Wang, JJ Sheng, HP Chen, ZH Ren, Y Sun, CJ Wen, JG Wang, J Miller, DJ Lu, J Amine, K Ma, ZF AF Xie, Yingying Wang, Hong Xu, Guiliang Wang, Jiajun Sheng, Huaping Chen, Zonghai Ren, Yang Sun, Cheng-Jun Wen, Jianguo Wang, Jun Miller, Dean J. Lu, Jun Amine, Khalil Ma, Zi-Feng TI In Operando XRD and TXM Study on the Metastable Structure Change of NaNi1/3Fe1/3Mn1/3O2 under Electrochemical Sodium-Ion Intercalation SO ADVANCED ENERGY MATERIALS LA English DT Article ID POSITIVE ELECTRODE; CATHODE MATERIALS; ENERGY-STORAGE; PRUSSIAN BLUE; BATTERIES; INSERTION C1 [Xie, Yingying; Wang, Hong; Ma, Zi-Feng] Shanghai Jiao Tong Univ, Dept Chem Engn, Shanghai 200240, Peoples R China. [Xie, Yingying; Xu, Guiliang; Chen, Zonghai; Lu, Jun; Amine, Khalil] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Lemont, IL 60439 USA. [Wang, Jiajun; Wang, Jun] Brookhaven Natl Lab, Photon Sci Directorate, Bldg 744 Ring Rd, Upton, NY 11973 USA. [Sheng, Huaping; Wen, Jianguo; Miller, Dean J.] Argonne Natl Lab, Electron Microscopy Ctr, Ctr Nanoscale Mat, 9700 S Cass Ave, Lemont, IL 60439 USA. [Ren, Yang; Sun, Cheng-Jun] Argonne Natl Lab, Adv Photon Source, 9700 S Cass Ave, Lemont, IL 60439 USA. RP Ma, ZF (reprint author), Shanghai Jiao Tong Univ, Dept Chem Engn, Shanghai 200240, Peoples R China.; Lu, J; Amine, K (reprint author), Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Lemont, IL 60439 USA. EM junlu@anl.gov; amine@anl.gov; zfma@sjtu.edu.cn RI XU, GUILIANG/F-3804-2017 FU U.S. Department of Energy [DE-AC0206CH11357]; Vehicle Technologies Office, Department of Energy (DOE) Office of Energy Efficiency and Renewable Energy (EERE); Natural Science Foundation of China [21336003, 21573147, 21506123]; 973 Program of China [2014CB239703]; DOE Office of Science [DE-AC02-06CH11357]; DOE [DE-SC0012704]; Electron Microscopy Center in the Center for Nanoscale Materials, a U.S. Department of Energy Office of Science User Facility [DE-AC02-06CH11357] FX This work was supported by the U.S. Department of Energy under Contract DE-AC0206CH11357 with the main support provided by the Vehicle Technologies Office, Department of Energy (DOE) Office of Energy Efficiency and Renewable Energy (EERE). This work also was supported by the Natural Science Foundation of China (21336003, 21573147, and 21506123), 973 Program of China (2014CB239703). This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. Use of APS Beamline 8BM was in part supported by the National Synchrotron Light Source II, Brookhaven National Laboratory, under DOE Contract No. DE-SC0012704. Electron microscopy was carried out in the Electron Microscopy Center in the Center for Nanoscale Materials, a U.S. Department of Energy Office of Science User Facility under Contract No. DE-AC02-06CH11357. NR 26 TC 0 Z9 0 U1 4 U2 4 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1614-6832 EI 1614-6840 J9 ADV ENERGY MATER JI Adv. Energy Mater. PD DEC 21 PY 2016 VL 6 IS 24 AR 1601306 DI 10.1002/aenm.201601306 PG 5 WC Chemistry, Physical; Energy & Fuels; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Energy & Fuels; Materials Science; Physics GA EN9LA UT WOS:000396320500015 ER PT J AU Yuan, ZK Chen, SY Xie, Y Park, JS Xiang, HJ Gong, XG Wei, SH AF Yuan, Zhen-Kun Chen, Shiyou Xie, Yun Park, Ji-Sang Xiang, Hongjun Gong, Xin-Gao Wei, Su-Huai TI Na-Diffusion Enhanced p- type Conductivity in Cu(In, Ga) Se-2: A New Mechanism for Efficient Doping in Semiconductors SO ADVANCED ENERGY MATERIALS LA English DT Article ID FILM SOLAR-CELLS; CU(IN,GA)SE-2 THIN-FILMS; POLYCRYSTALLINE CU(IN,GA)SE-2; 1ST-PRINCIPLES CALCULATIONS; POSTDEPOSITION TREATMENT; ELECTRONIC-PROPERTIES; ATOM-PROBE; SODIUM; DEFECTS; CUINSE2 C1 [Yuan, Zhen-Kun; Xie, Yun; Xiang, Hongjun; Gong, Xin-Gao] Fudan Univ, State Key Lab Surface Phys, Key Lab Computat Phys Sci MOE, Shanghai 200433, Peoples R China. [Yuan, Zhen-Kun; Xie, Yun; Xiang, Hongjun; Gong, Xin-Gao] Fudan Univ, Dept Phys, Collaborat Innovat Ctr Adv Microstruct, Shanghai 200433, Peoples R China. [Chen, Shiyou] East China Normal Univ, Key Lab Polar Mat & Devices MOE, Shanghai 200241, Peoples R China. [Chen, Shiyou] Shanxi Univ, Collaborat Innovat Ctr Extreme Opt, Taiyuan 030006, Shanxi, Peoples R China. [Park, Ji-Sang] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Wei, Su-Huai] Beijing Computat Sci Res Ctr, Beijing 100094, Peoples R China. RP Chen, SY (reprint author), East China Normal Univ, Key Lab Polar Mat & Devices MOE, Shanghai 200241, Peoples R China.; Chen, SY (reprint author), Shanxi Univ, Collaborat Innovat Ctr Extreme Opt, Taiyuan 030006, Shanxi, Peoples R China. EM chensy@ee.ecnu.edu.cn FU Special Funds for Major State Basic Research; National Natural Science Foundation of China (NSFC); international collaboration project of MOST; NSFC [61574059]; Shanghai Rising-Star Program [14QA1401500]; Shu-Guang program; CC of ECNU FX This work was partially supported by the Special Funds for Major State Basic Research, the National Natural Science Foundation of China (NSFC), and the international collaboration project of MOST. S.C. was supported by the NSFC under Grant No. 61574059, Shanghai Rising-Star Program (Grant No. 14QA1401500), Shu-Guang program, and the CC of ECNU. NR 71 TC 0 Z9 0 U1 6 U2 6 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1614-6832 EI 1614-6840 J9 ADV ENERGY MATER JI Adv. Energy Mater. PD DEC 21 PY 2016 VL 6 IS 24 AR 1601191 DI 10.1002/aenm.201601191 PG 7 WC Chemistry, Physical; Energy & Fuels; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Energy & Fuels; Materials Science; Physics GA EN9LA UT WOS:000396320500010 ER PT J AU Bent, ZW Poorey, K LaBauve, AE Hamblin, R Williams, KP Meagher, RJ AF Bent, Zachary W. Poorey, Kunal LaBauve, Annette E. Hamblin, Rachelle Williams, Kelly P. Meagher, Robert J. TI A Rapid Spin Column-Based Method to Enrich Pathogen Transcripts from Eukaryotic Host Cells Prior to Sequencing SO PLoS One LA English DT Article ID CARBAPENEM-RESISTANT ENTEROBACTERIACEAE; DUAL RNA-SEQ; KLEBSIELLA-PNEUMONIAE; GENE-EXPRESSION; SALMONELLA-ENTERICA; SELECTIVE CAPTURE; ESCHERICHIA-COLI; VIRULENCE FACTOR; INFECTION; MACROPHAGES AB When analyzing pathogen transcriptomes during the infection of host cells, the signal-to-background (pathogen-to-host) ratio of nucleic acids (NA) in infected samples is very small. Despite the advancements in next-generation sequencing, the minute amount of pathogen NA makes standard RNA-seq library preps inadequate for effective gene-level analysis of the pathogen in cases with low bacterial loads. In order to provide a more complete picture of the pathogen transcriptome during an infection, we developed a novel pathogen enrichment technique, which can enrich for transcripts from any cultivable bacteria or virus, using common, readily available laboratory equipment and reagents. To evenly enrich for pathogen transcripts, we generate biotinylated pathogen-targeted capture probes in an enzymatic process using the entire genome of the pathogen as a template. The capture probes are hybridized to a strand-specific cDNA library generated from an RNA sample. The biotinylated probes are captured on a monomeric avidin resin in a miniature spin column, and enriched pathogen-specific cDNA is eluted following a series of washes. To test this method, we performed an in vitro time-course infection using Klebsiella pneumoniae to infect murine macrophage cells. K. pneumoniae transcript enrichment efficiency was evaluated using RNA-seq. Bacterial transcripts were enriched up to similar to 400-fold, and allowed the recovery of transcripts from similar to 2000-3600 genes not observed in untreated control samples. These additional transcripts revealed interesting aspects of K. pneumoniae biology including the expression of putative virulence factors and the expression of several genes responsible for antibiotic resistance even in the absence of drugs. C1 [Bent, Zachary W.; Poorey, Kunal; Hamblin, Rachelle; Williams, Kelly P.] Sandia Natl Labs, Dept Syst Biol, Livermore, CA 94551 USA. [LaBauve, Annette E.; Meagher, Robert J.] Sandia Natl Labs, Biotechnol & Bioengn Dept, Livermore, CA 94551 USA. [Bent, Zachary W.] 10X Genom, Pleasanton, CA 94566 USA. RP Bent, ZW (reprint author), Sandia Natl Labs, Dept Syst Biol, Livermore, CA 94551 USA.; Meagher, RJ (reprint author), Sandia Natl Labs, Biotechnol & Bioengn Dept, Livermore, CA 94551 USA.; Bent, ZW (reprint author), 10X Genom, Pleasanton, CA 94566 USA. EM zachwbent@gmail.com; rmeaghe@sandia.gov FU Sandia National Laboratories Laboratory Directed Research and Development (LDRD) [173021]; U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX This work was funded by Sandia National Laboratories Laboratory Directed Research and Development (LDRD) Project 173021 (RJM). Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract DE-AC04-94AL85000. The funders had no role in study design, data collection and analysis, decision to publish, or preparation of the manuscript. NR 51 TC 0 Z9 0 U1 5 U2 5 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 21 PY 2016 VL 11 IS 12 AR e0168788 DI 10.1371/journal.pone.0168788 PG 16 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EI9TW UT WOS:000392853100069 PM 28002481 ER PT J AU Barnard, E Shi, BC Kang, DZ Craft, N Li, HY AF Barnard, Emma Shi, Baochen Kang, Dezhi Craft, Noah Li, Huiying TI The balance of metagenomic elements shapes the skin microbiome in acne and health SO SCIENTIFIC REPORTS LA English DT Article ID PROPIONIBACTERIUM-ACNES; MOLECULAR ANALYSIS; PSORIATIC LESIONS; GENOME SEQUENCE; BACTERIAL BIOTA; VULGARIS; SURFACE; BARRIER; DISEASE; STAPHYLOCOCCUS AB Studies have emphasized the importance of disease-associated microorganisms in perturbed communities, however, the protective roles of commensals are largely under recognized and poorly understood. Using acne as a model disease, we investigated the determinants of the overall virulence property of the skin microbiota when disease-and health-associated organisms coexist in the community. By ultra-deep metagenomic shotgun sequencing, we revealed higher relative abundances of propionibacteria and Propionibacterium acnes phage in healthy skin. In acne patients, the microbiome composition at the species level and at P. acnes strain level was more diverse than in healthy individuals, with enriched virulence-associated factors and reduced abundance of metabolic synthesis genes. Based on the abundance profiles of the metagenomic elements, we constructed a quantitative prediction model, which classified the clinical states of the host skin with high accuracy in both our study cohort (85%) and an independent sample set (86%). Our results suggest that the balance between metagenomic elements, not the mere presence of disease-associated strains, shapes the overall virulence property of the skin microbiota. This study provides new insights into the microbial mechanism of acne pathogenesis and suggests probiotic and phage therapies as potential acne treatments to modulate the skin microbiota and to maintain skin health. C1 [Barnard, Emma; Shi, Baochen; Kang, Dezhi; Li, Huiying] Univ Calif Los Angeles, David Geffen Sch Med, Crump Inst Mol Imaging, Dept Mol & Med Pharmacol, Los Angeles, CA 90095 USA. [Craft, Noah] Harbor UCLA Med Ctr, Los Angeles Biomed Res Inst, Torrance, CA 90509 USA. [Li, Huiying] Univ Calif Los Angeles, DOE Inst Genom & Prote, Los Angeles, CA USA. RP Li, HY (reprint author), Univ Calif Los Angeles, David Geffen Sch Med, Crump Inst Mol Imaging, Dept Mol & Med Pharmacol, Los Angeles, CA 90095 USA.; Li, HY (reprint author), Univ Calif Los Angeles, DOE Inst Genom & Prote, Los Angeles, CA USA. EM huiying@ucla.edu FU NIH grant from NIGMS [R01GM099530]; NIH grant from NIAMS [UH2AR057503] FX We thank Marie C. Erfe, Bor-Han Chiu, and Emily Curd for their efforts in subject recruitment, sample collection, and technical support. We also thank the UCLA Broad Stem Cell Research Center (BSCRC) and UCLA GenoSeq core for sequencing services. Research was funded by the NIH grants R01GM099530 from NIGMS and UH2AR057503 from NIAMS. NR 72 TC 0 Z9 0 U1 17 U2 17 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 21 PY 2016 VL 6 AR 39491 DI 10.1038/srep39491 PG 12 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF3BV UT WOS:000390200400002 PM 28000755 ER PT J AU VanDelinder, V Adams, PG Bachand, GD AF VanDelinder, Virginia Adams, Peter G. Bachand, George D. TI Mechanical splitting of microtubules into protofilament bundles by surface-bound kinesin-1 SO SCIENTIFIC REPORTS LA English DT Article ID TUBULIN PROTOFILAMENTS; GTP HYDROLYSIS; PROTEINS; TAXOL; NANOTECHNOLOGY; DYNAMICS; MOTILITY; DEVICES; BIOLOGY AB The fundamental biophysics of gliding microtubule (MT) motility by surface-tethered kinesin-1 motor proteins has been widely studied, as well as applied to capture and transport analytes in bioanalytical microdevices. In these systems, phenomena such as molecular wear and fracture into shorter MTs have been reported due the mechanical forces applied on the MT during transport. In the present work, we show that MTs can be split longitudinally into protofilament bundles (PFBs) by the work performed by surface-bound kinesin motors. We examine the properties of these PFBs using several techniques (e. g., fluorescence microscopy, SEM, AFM), and show that the PFBs continue to be mobile on the surface and display very high curvature compared to MT. Further, higher surface density of kinesin motors and shorter kinesin-surface tethers promote PFB formation, whereas modifying MT with GMPCPP or higher paclitaxel concentrations did not affect PFB formation. C1 [VanDelinder, Virginia; Bachand, George D.] Sandia Natl Labs, Ctr Integrated Nanotechnol, POB 5800,MS 1303, Albuquerque, NM 87185 USA. [Adams, Peter G.] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. [Adams, Peter G.] Univ Leeds, Sch Phys & Astron, Leeds LS2 9JT, W Yorkshire, England. RP Bachand, GD (reprint author), Sandia Natl Labs, Ctr Integrated Nanotechnol, POB 5800,MS 1303, Albuquerque, NM 87185 USA. EM gdbacha@sandia.gov FU U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering (BES-MSE); Photosynthetic Antenna Research Center (PARC); Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Basic Energy Sciences [DESC0001035]; U.S. Department of Energy (DOE) Office of Science [RA 2013A0021]; National Nuclear Security Administration of the U.S. Department of Energy [DE-AC52-06NA25396]; U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX We thank Bonnie MacKenzie for help with the SEM imaging, and Drs. Joe Howard and Stefan Diez for kindly providing the GFP-kinesin plasmid. We also thank Marlene Bachand and Walter Paxton for their useful discussion, comments and suggestions. VV and GDB were supported by funding through the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering (BES-MSE). Work by P.G.A. was supported by Photosynthetic Antenna Research Center (PARC), an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Basic Energy Sciences under Award # DESC0001035. This work was performed, in part, at the Center for Integrated Nanotechnologies, an Office of Science User Facility operated for the U.S. Department of Energy (DOE) Office of Science (user project number RA 2013A0021). Los Alamos National Laboratory, an affirmative action equal opportunity employer, is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. Sandia National Laboratories is a multi-mission laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. NR 38 TC 0 Z9 0 U1 9 U2 9 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 21 PY 2016 VL 6 AR 39408 DI 10.1038/srep39408 PG 10 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF3FF UT WOS:000390209400002 PM 28000714 ER PT J AU Nowicki, SMJ Payne, A Larour, E Seroussi, H Goelzer, H Lipscomb, W Gregory, J Abe-Ouchi, A Shepherd, A AF Nowicki, Sophie M. J. Payne, Anthony Larour, Eric Seroussi, Helene Goelzer, Heiko Lipscomb, William Gregory, Jonathan Abe-Ouchi, Ayako Shepherd, Andrew TI Ice Sheet Model Intercomparison Project (ISMIP6) contribution to CMIP6 SO GEOSCIENTIFIC MODEL DEVELOPMENT LA English DT Article ID SURFACE MASS-BALANCE; FUTURE SEA-LEVEL; EARTH-SYSTEM-MODEL; REGIONAL CLIMATE MODELS; MULTIMODEL PROJECTIONS; SPATIAL SENSITIVITIES; ENVIRONMENTAL-CHANGE; EXPERIMENTAL-DESIGN; ELEVATION FEEDBACK; GREENLAND AB Reducing the uncertainty in the past, present, and future contribution of ice sheets to sea-level change requires a coordinated effort between the climate and glaciology communities. The Ice Sheet Model Intercomparison Project for CMIP6 (ISMIP6) is the primary activity within the Coupled Model Intercomparison Project - phase 6 (CMIP6) focusing on the Greenland and Antarctic ice sheets. In this paper, we describe the framework for ISMIP6 and its relationship with other activities within CMIP6. The ISMIP6 experimental design relies on CMIP6 climate models and includes, for the first time within CMIP, coupled ice-sheet-climate models as well as standalone ice-sheet models. To facilitate analysis of the multi-model ensemble and to generate a set of standard climate inputs for standalone ice-sheet models, ISMIP6 defines a protocol for all variables related to ice sheets. ISMIP6 will provide a basis for investigating the feedbacks, impacts, and sea-level changes associated with dynamic ice sheets and for quantifying the uncertainty in ice-sheet-sourced global sea-level change. C1 [Nowicki, Sophie M. J.] NASA, Goddard Space Flight Ctr, Greenbelt, MD 20771 USA. [Payne, Anthony] Univ Bristol, Sch Geog Sci, Bristol BS8 1SS, Avon, England. [Larour, Eric; Seroussi, Helene] CALTECH, Jet Prop Lab, 4800 Oak Grove Dr, Pasadena, CA 91109 USA. [Goelzer, Heiko] Univ Utrecht, Inst Marine & Atmospher Res, NL-3584 CC Utrecht, Netherlands. [Goelzer, Heiko] Univ Libre Bruxelles, Lab Glaciol, CP160-03,Ave Roosevelt 50, B-1050 Brussels, Belgium. [Lipscomb, William] Los Alamos Natl Lab, Los Alamos, NM 87544 USA. [Gregory, Jonathan] Univ Reading, Dept Meteorol, Reading RG6 6BB, Berks, England. [Gregory, Jonathan] Met Off Hadley Ctr, Exeter EX1 3BP, Devon, England. [Abe-Ouchi, Ayako] Univ Tokyo, Atmosphere & Ocean Res Inst, Kashiwa, Chiba 2778564, Japan. [Abe-Ouchi, Ayako] Japan Agcy Marine Earth Sci & Technol, Yokohama, Kanagawa, Japan. [Shepherd, Andrew] Univ Leeds, Sch Earth & Environm, Leeds LS2 9JT, W Yorkshire, England. RP Nowicki, SMJ (reprint author), NASA, Goddard Space Flight Ctr, Greenbelt, MD 20771 USA. EM sophie.nowicki@nasa.gov OI Gregory, Jonathan/0000-0003-1296-8644; Goelzer, Heiko/0000-0002-5878-9599 FU Climate and Cryosphere (CliC) Project; World Climate Research Programme (WCRP); Netherlands Earth System Science Centre (NESSC); Dutch Ministry of Education, Culture and Science (OCW) [024.002.001]; NASA Cryospheric Science Program; NASA Modeling Analysis and Prediction Program; Regional and Global Climate Modeling program of the Office of Biological and Environmental Research within the US Department of Energy's Office of Science; NERC Centre for Polar Observation and Modelling (CPOM) FX We thank the CMIP6 panel members for their continuous leadership of the CMIP6 effort, the Working Group on Coupled Modeling (WGCM) Infrastructure Panel (WIP) for overseeing the CMIP6 and ISMIP6 infrastructure, and in particular Martin Juckes and Alison Pamment for their help with the ISMIP6 data request, and Karl Taylor for sharing his wisdom on CMIP experiment protocols. We thank the current ISMIP6 members, the modeling groups, and the wider glaciology community for their contribution in the ISMIP6 design. We acknowledge the Climate and Cryosphere (CliC) Project and the World Climate Research Programme (WCRP) for their guidance, support, and sponsorship. Heiko Goelzer has received funding from the program of the Netherlands Earth System Science Centre (NESSC), financially supported by the Dutch Ministry of Education, Culture and Science (OCW) under grant no. 024.002.001. Sophie Nowicki, Helene Seroussi, and Eric Larour were supported by grants from the NASA Cryospheric Science Program and the NASA Modeling Analysis and Prediction Program. William Lipscomb was supported by the Regional and Global Climate Modeling program of the Office of Biological and Environmental Research within the US Department of Energy's Office of Science. Anthony Payne is supported by the NERC Centre for Polar Observation and Modelling (CPOM). We thank our topical editor Philippe Huybrechts, our reviewers Christian Rodehacke and Xylar Asay-Davis, and everyone who contributed to the open discussion for constructive comments. NR 133 TC 0 Z9 0 U1 5 U2 5 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1991-959X EI 1991-9603 J9 GEOSCI MODEL DEV JI Geosci. Model Dev. PD DEC 21 PY 2016 VL 9 IS 12 BP 4521 EP 4545 DI 10.5194/gmd-9-4521-2016 PG 25 WC Geosciences, Multidisciplinary SC Geology GA EH2EF UT WOS:000391579600002 ER PT J AU Althammer, M Singh, AV Keshavarz, S Yurtisigi, MK Mishra, R Borisevich, AY LeClair, P Gupta, A AF Althammer, Matthias Singh, Amit Vikam Keshavarz, Sahar Yurtisigi, Mehmet Kenan Mishra, Rohan Borisevich, Albina Y. LeClair, Patrick Gupta, Arunava TI Investigation of the tunnel magnetoresistance in junctions with a strontium stannate barrier SO JOURNAL OF APPLIED PHYSICS LA English DT Article ID ROOM-TEMPERATURE; FILMS; PEROVSKITE; FIELDS AB We experimentally investigate the structural, magnetic, and electrical transport properties of La-0.67 Sr0.33MnO3 based magnetic tunnel junctions with a SrSnO3 barrier. Our results show that despite the high density of defects in the strontium stannate barrier, due to the large lattice mismatch, the observed tunnel magnetoresistance (TMR) is comparable to tunnel junctions with a better lattice matched SrTiO3 barrier, reaching values of up to 350% at T = 5K. Further analysis of the current-voltage characteristics of the junction and the bias voltage dependence of the observed tunnel magnetoresistance show a decrease of the TMR with increasing bias voltage. In addition, the observed TMR vanishes for T > 200K. Our results suggest that by employing a better lattice matched ferromagnetic electrode, and thus reducing the structural defects in the strontium stannate barrier, even larger TMR ratios might be possible in the future. Published by AIP Publishing. C1 [Althammer, Matthias; Singh, Amit Vikam; Keshavarz, Sahar; Yurtisigi, Mehmet Kenan; LeClair, Patrick; Gupta, Arunava] Univ Alabama, MINT Ctr, Tuscaloosa, AL 35487 USA. [Althammer, Matthias] Bayer Akad Wissensch, Walther Meissner Inst, D-85748 Garching, Germany. [Singh, Amit Vikam; Gupta, Arunava] Univ Alabama, Dept Chem & Chem Engn, Tuscaloosa, AL 35487 USA. [Keshavarz, Sahar; Yurtisigi, Mehmet Kenan; LeClair, Patrick] Univ Alabama, Dept Phys & Astron, Tuscaloosa, AL 35487 USA. [Mishra, Rohan] Washington Univ, Dept Mech Engn & Mat Sci, St Louis, MO 63130 USA. [Mishra, Rohan; Borisevich, Albina Y.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. RP Althammer, M (reprint author), Univ Alabama, MINT Ctr, Tuscaloosa, AL 35487 USA.; Althammer, M (reprint author), Bayer Akad Wissensch, Walther Meissner Inst, D-85748 Garching, Germany. EM Matthias.Althammer@wmi.badw.de RI Althammer, Matthias/L-4623-2016; OI Althammer, Matthias/0000-0003-1625-6054; Mishra, Rohan/0000-0003-1261-0087; Singh, Amit/0000-0002-3687-9171 FU NSF-ECCS Grant [1509875]; U.S. Department of Energy (DOE) Office of Science, Office of Basic Energy Sciences, Materials Science and Engineering Directorate FX We gratefully acknowledge financial support via NSF-ECCS Grant No. 1509875. Work at ORNL was supported by the U.S. Department of Energy (DOE) Office of Science, Office of Basic Energy Sciences, Materials Science and Engineering Directorate. NR 35 TC 0 Z9 0 U1 11 U2 11 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-8979 EI 1089-7550 J9 J APPL PHYS JI J. Appl. Phys. PD DEC 21 PY 2016 VL 120 IS 23 AR 233903 DI 10.1063/1.4972103 PG 6 WC Physics, Applied SC Physics GA EH3PZ UT WOS:000391685500014 ER PT J AU Knudson, MD Desjarlais, MP Lemke, RW AF Knudson, M. D. Desjarlais, M. P. Lemke, R. W. TI Shock compression experiments on Lithium Deuteride (LiD) single crystals SO JOURNAL OF APPLIED PHYSICS LA English DT Article ID EQUATION-OF-STATE; PHASE-TRANSITIONS; TPA; PSEUDOPOTENTIALS; PRESSURES AB Shock compression experiments in the few hundred GPa (multi-Mbar) regime were performed on Lithium Deuteride single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17-32 km/s. Measurements included pressure, density, and temperature between similar to 190 and 570 GPa along the Principal Hugoniot-the locus of end states achievable through compression by large amplitude shock waves-as well as pressure and density of reshock states up to similar to 920 GPa. The experimental measurements are compared with density functional theory calculations, tabular equation of state models, and legacy nuclear driven results that have been reanalyzed using modern equations of state for the shock wave standards used in the experiments. Published by AIP Publishing. C1 [Knudson, M. D.; Desjarlais, M. P.; Lemke, R. W.] Sandia Natl Labs, Albuquerque, NM 87123 USA. [Knudson, M. D.] Washington State Univ, Inst Shock Phys, Pullman, WA 99164 USA. RP Knudson, MD (reprint author), Sandia Natl Labs, Albuquerque, NM 87123 USA.; Knudson, MD (reprint author), Washington State Univ, Inst Shock Phys, Pullman, WA 99164 USA. EM mdknuds@sandia.gov FU U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX We would like to thank Dan Dolan for locating the single crystal LiD bottle. Michael Siegal is thanked for providing access to the argon glove box used in target preparation, Mark Rodriguez and Jeff Reich are thanked for performing x-ray diffraction and inductively coupled plasma mass spectrometry measurements, respectively, to characterize the sample material used in these experiments. We also thank the large team at Sandia that contributed to the design and fabrication of the flyer plate loads and the fielding of the shock diagnostics, Sandia National Laboratories is a multi-mission laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract No. DE-AC04-94AL85000. NR 45 TC 0 Z9 0 U1 4 U2 4 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-8979 EI 1089-7550 J9 J APPL PHYS JI J. Appl. Phys. PD DEC 21 PY 2016 VL 120 IS 23 AR 235902 DI 10.1063/1.4972553 PG 9 WC Physics, Applied SC Physics GA EH3PZ UT WOS:000391685500050 ER PT J AU McCoy, CA Gregor, MC Polsin, DN Fratanduono, DE Celliers, PM Boehly, TR Meyerhofer, DD AF McCoy, C. A. Gregor, M. C. Polsin, D. N. Fratanduono, D. E. Celliers, P. M. Boehly, T. R. Meyerhofer, D. D. TI Measurements of the sound velocity of shock-compressed liquid silica to 1100GPa SO JOURNAL OF APPLIED PHYSICS LA English DT Article ID EQUATION-OF-STATE; HIGH-PRESSURE; HIGH-TEMPERATURE; OMEGA LASER; PHASE; SIO2; STISHOVITE; TRANSITION; INTERFEROMETER; MGO-FEO-SIO2 AB The sound velocity in a shocked material provides information about its off-Hugoniot behavior of a material at high pressures. This information can be used to extend the knowledge gained in Hugoniot experiments and to model the re-shock and release behavior. Silica is one of the most important materials for equation of state studies because of its prevalence in the earth's interior and the well-defined properties of a-quartz. This article presents the sound velocity measurements of amorphous fused silica over the range 200 to 1100GPa using laser-driven shocks and an a-quartz standard. These measurements demonstrate the technique proposed by Fratanduono et al. [J. Appl. Phys. 116, 033517 (2014)] to determine the sound velocity from the arrival of acoustic perturbations. The results compare favorably to the SESAME 7386 equation-of-state table. The Gruneisen parameter was calculated from the sound velocity data and found to be Gamma = 0: 66 +/- 0: 05 at densities above 6 g/cm(3), an increase in precision by a factor of two over previous measurements. Published by AIP Publishing. C1 [McCoy, C. A.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. [McCoy, C. A.; Gregor, M. C.; Polsin, D. N.; Boehly, T. R.] Univ Rochester, Laser Energet Lab, 250 E River Rd, Rochester, NY 14623 USA. [McCoy, C. A.] Univ Rochester, Dept Mech Engn, Rochester, NY 14627 USA. [Gregor, M. C.; Polsin, D. N.] Univ Rochester, Dept Phys & Astron, Rochester, NY 14627 USA. [Fratanduono, D. E.; Celliers, P. M.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Meyerhofer, D. D.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. RP McCoy, CA (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA.; McCoy, CA (reprint author), Univ Rochester, Laser Energet Lab, 250 E River Rd, Rochester, NY 14623 USA.; McCoy, CA (reprint author), Univ Rochester, Dept Mech Engn, Rochester, NY 14627 USA. EM camccoy@sandia.gov RI Sorokin, Aleksei/I-5980-2014 OI Sorokin, Aleksei/0000-0003-3334-3440 FU Department of Energy National Nuclear Security Administration [DE-NA0001944]; University of Rochester; New York State Energy Research and Development Authority; U.S. Department of Energy [DE-AC04-94AL85000] FX This material was based upon the work supported by the Department of Energy National Nuclear Security Administration under Award No. DE-NA0001944, the University of Rochester, and the New York State Energy Research and Development Authority. The support of DOE does not constitute an endorsement by DOE of the views expressed in this article. Sandia National Laboratories is a multi-mission laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract No. DE-AC04-94AL85000. NR 79 TC 0 Z9 0 U1 5 U2 5 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-8979 EI 1089-7550 J9 J APPL PHYS JI J. Appl. Phys. PD DEC 21 PY 2016 VL 120 IS 23 AR 235901 DI 10.1063/1.4972338 PG 11 WC Physics, Applied SC Physics GA EH3PZ UT WOS:000391685500049 ER PT J AU Agapov, A Novikov, VN Kisliuk, A Richert, R Sokolov, AP AF Agapov, A. Novikov, V. N. Kisliuk, A. Richert, R. Sokolov, A. P. TI Role of quantum fluctuations in structural dynamics of liquids of light molecules SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID GLASS-FORMING LIQUIDS; TRANSITION TEMPERATURE; NEUTRON-SCATTERING; WATER; MODEL; RELAXATION; FORMERS; SOLIDS; SCALE; HEAT AB A possible role of quantum effects, such as tunneling and zero-point energy, in the structural dynamics of supercooled liquids is studied by dielectric spectroscopy. The presented results demonstrate that the liquids, bulk 3-methyl pentane and confined normal and deuterated water, have low glass transition temperature and unusually low for their class of materials steepness of the temperature dependence of structural relaxation (fragility). Although we do not find any signs of tunneling in the structural relaxation of these liquids, their unusually low fragility can be well described by the influence of the quantum fluctuations. Confined water presents an especially interesting case in comparison to the earlier data on bulk low-density amorphous and vapor deposited water. Confined water exhibits a much weaker isotope effect than bulk water, although the effect is still significant. We show that it can be ascribed to the change of the energy barrier for relaxation due to a decrease in the zeropoint energy upon D/H substitution. The observed difference in the behavior of confined and bulk water demonstrates high sensitivity of quantum effects to the barrier heights and structure of water. Moreover, these results demonstrate that extrapolation of confined water properties to the bulk water behavior is questionable. Published by AIP Publishing. C1 [Agapov, A.; Novikov, V. N.; Sokolov, A. P.] Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. [Agapov, A.; Novikov, V. N.; Sokolov, A. P.] Univ Tennessee, Joint Inst Neutron Sci, Knoxville, TN 37996 USA. [Kisliuk, A.; Sokolov, A. P.] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. [Richert, R.] Arizona State Univ, Sch Mol Sci, Tempe, AZ 85287 USA. [Sokolov, A. P.] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. RP Agapov, A (reprint author), Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA.; Agapov, A (reprint author), Univ Tennessee, Joint Inst Neutron Sci, Knoxville, TN 37996 USA. OI Richert, Ranko/0000-0001-8503-3175 FU UT-Battelle, LLC; NSF [CHE-1213444] FX This work was supported by UT-Battelle, LLC. UT team thanks NSF for partial financial support under Grant No. CHE-1213444. NR 46 TC 0 Z9 0 U1 6 U2 6 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 23 AR 234507 DI 10.1063/1.4972008 PG 7 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EH3RG UT WOS:000391688900032 PM 28010087 ER PT J AU Fang, Y Liu, F Barber, VP Klippenstein, SJ McCoy, AB Lester, MI AF Fang, Yi Liu, Fang Barber, Victoria P. Klippenstein, Stephen J. McCoy, Anne B. Lester, Marsha I. TI Deep tunneling in the unimolecular decay of CH3CHOO Criegee intermediates to OH radical products SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID CONFORMER-DEPENDENT REACTIVITY; TRANSITION-STATE THEORY; GAS-PHASE OZONOLYSIS; CARBONYL OXIDES; WATER-VAPOR; ATMOSPHERIC CHEMISTRY; TORCH CAMPAIGN; DISSOCIATION; OZONE; DECOMPOSITION AB Unimolecular decay of Criegee intermediates produced in alkene ozonolysis is known to be a significant source of OH radicals in the troposphere. In this work, unimolecular decay of the methylsubstituted Criegee intermediate, syn-CH3CHOO, to OH products is shown to occur at energies significantly below the transition state barrier for a 1,4 hydrogen transfer that leads to these products [Y. Fang et al., J. Chem. Phys. 144, 061102 (2016)]. The rate of appearance of OH products arising from tunneling through the barrier is obtained through direct time-domain measurements following the vibrational activation of syn-CH3CHOO. IR excitation o f syn-CH3CHOO at energies nearly 2000 cm(-1) below the barrier is achievedthrough combination bands involving CH stretch and another lower frequency mode, and the resultant OH products are detected by UV laser-induced fluorescence. The observed syn-CH3CHOO combination bands in the 4100-4350 cm(-1) region are identified by comparison with the computed IR absorption spectrum. The experimental decay rates are found to be ca. 10(6) s(-1) in this deep tunneling regime, which is approximately 100-times slower than that in the vicinity of the barrier. The experimental results are consistent with statistical Rice-Ramsperger-KasselMarcus (RRKM) calculations of the microcanonical decay rates with tunneling through the barrier, and notable deviations may originate from the sparsity in the density of states for syn-CH3CHOO at lower energies. Thermal unimolecular decay of syn-CH3CHOO is predicted to have significant contribution from microcanonical rates at energies that are much below the barrier. Published by AIP Publishing. C1 [Fang, Yi; Liu, Fang; Barber, Victoria P.; Lester, Marsha I.] Univ Penn, Dept Chem, Philadelphia, PA 19104 USA. [Klippenstein, Stephen J.] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. [McCoy, Anne B.] Univ Washington, Dept Chem, Seattle, WA 98195 USA. RP Lester, MI (reprint author), Univ Penn, Dept Chem, Philadelphia, PA 19104 USA. EM milester@sas.upenn.edu FU National Science Foundation [CHE-1362835, CHE-1619660]; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences at Argonne [DE-AC02-06CH11357] FX This research was supported through the National Science Foundation under Grant Nos. CHE-1362835 (M.I.L.) and CHE-1619660 (A.B.M.). This material is also based on work supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences at Argonne under Contract No. DE-AC02-06CH11357 (S.J.K.). NR 64 TC 0 Z9 0 U1 9 U2 9 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 23 AR 234308 DI 10.1063/1.4972015 PG 9 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EH3RG UT WOS:000391688900020 PM 28010089 ER PT J AU Lackner, F Chatterley, AS Pemmaraju, CD Closser, KD Prendergast, D Neumark, DM Leone, SR Gessner, O AF Lackner, Florian Chatterley, Adam S. Pemmaraju, C. D. Closser, Kristina D. Prendergast, David Neumark, Daniel M. Leone, Stephen R. Gessner, Oliver TI Direct observation of ring-opening dynamics in strong-field ionized selenophene using femtosecond inner-shell absorption spectroscopy SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID DENSITY-FUNCTIONAL THEORY; EXCITED-STATES; PHOTOELECTRON-SPECTROSCOPY; TRANSIENT ABSORPTION; COULOMB EXPLOSION; 800 NM; IONIZATION; MOLECULES; THIOPHENE; 1,3-CYCLOHEXADIENE AB Femtosecond extreme ultraviolet transient absorption spectroscopy is used to explore strong-field ionization induced dynamics in selenophene (C4H4Se). The dynamics are monitored in real-time from the viewpoint of the Se atom by recording the temporal evolution of element-specific spectral features near the Se 3d inner-shell absorption edge (similar to 58 eV). The interpretation of the experimental results is supported by first-principles time-dependent density functional theory calculations. The experiments simultaneously capture the instantaneous population of stable molecular ions, the emergence and decay of excited cation states, and the appearance of atomic fragments. The experiments reveal, in particular, insight into the strong-field induced ring-opening dynamics in the selenophene cation, which are traced by the emergence of non-cyclic molecules as well as the liberation of Se+ ions within an overall time scale of approximately 170 fs. We propose that both products may be associated with dynamics on the same electronic surfaces but with different degrees of vibrational excitation. The time-dependent inner-shell absorption features provide direct evidence for a complex relaxation mechanism that may be approximated by a two-step model, whereby the initially prepared, excited cyclic cation decays within tau(1) = 80 +/- 30 fs into a transient molecular species, which then gives rise to the emergence of bare Se+ and ring-open cations within an additional tau(2) = 80 +/- 30 fs. The combined experimental and theoretical results suggest a close relationship between sigma* excited cation states and the observed ring-opening reactions. The findings demonstrate that the combination of femtosecond time-resolved core-level spectroscopy with ab initio estimates of spectroscopic signatures provide new insights into complex, ultrafast photochemical reactions such as ring-opening dynamics in organic molecules in real-time and with simultaneous sensitivity for electronic and structural rearrangements. Published by AIP Publishing. C1 [Lackner, Florian; Chatterley, Adam S.; Pemmaraju, C. D.; Neumark, Daniel M.; Leone, Stephen R.; Gessner, Oliver] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Lackner, Florian; Chatterley, Adam S.; Neumark, Daniel M.; Leone, Stephen R.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Pemmaraju, C. D.; Closser, Kristina D.; Prendergast, David] Lawrence Berkeley Natl Lab, Mol Foundry, Berkeley, CA 94720 USA. [Leone, Stephen R.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. RP Lackner, F (reprint author), Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA.; Lackner, F (reprint author), Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. OI Neumark, Daniel/0000-0002-3762-9473 FU U.S. Department of Energy, Office of Basic Energy Sciences, Chemical Sciences, Geosciences and Biosciences Division [DE-AC02-05CH11231]; Austrian Science Fund (FWF, Erwin Schrodinger Fellowship) [J 3580-N20] FX This work was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Chemical Sciences, Geosciences and Biosciences Division, through Contract No. DE-AC02-05CH11231. F.L. would like to acknowledge support by the Austrian Science Fund (FWF, Erwin Schrodinger Fellowship Grant No. J 3580-N20). Theoretical simulations were performed on the Cray XE6 Hopper computer at the National Energy Research Scientific Computing Center (NERSC-LBNL) and Molecular Foundry computing resources, Nano and Vulcan, managed by the High Performance Computing Services Group of LBNL. NR 55 TC 0 Z9 0 U1 8 U2 8 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 23 AR 234313 DI 10.1063/1.4972258 PG 13 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EH3RG UT WOS:000391688900025 PM 28010094 ER PT J AU Xu, WS Douglas, JF Freed, KF AF Xu, Wen-Sheng Douglas, Jack F. Freed, Karl F. TI Generalized entropy theory of glass-formation in fully flexible polymer melts SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID MOLECULAR-DYNAMICS SIMULATION; LATTICE CLUSTER THEORY; COHESIVE ENERGY; TEMPERATURE-DEPENDENCE; MODEL; RELAXATION; VISCOSITY; SYSTEMS; LIQUIDS; MOTION AB The generalized entropy theory (GET) offers many insights into how molecular parameters influence polymer glass-formation. Given the fact that chain rigidity often plays a critical role in understanding the glass-formation of polymer materials, the GET was originally developed based on models of semiflexible chains. Consequently, all previous calculations within the GET considered polymers with some degree of chain rigidity. Motivated by unexpected results from computer simulations of fully flexible polymer melts concerning the dependence of thermodynamic and dynamic properties on the cohesive interaction strength (epsilon), the present paper employs the GET to explore the influence of epsilon on glass-formation in models of polymer melts with a vanishing bending rigidity, i.e., fully flexible polymer melts. In accord with simulations, the GET for fully flexible polymer melts predicts that basic dimensionless thermodynamic properties (such as the reduced thermal expansion coefficient and isothermal compressibility) are universal functions of the temperature scaled by epsilon in the regime of low pressures. Similar scaling behavior is also found for the configurational entropy density in the GET for fully flexible polymer melts. Moreover, we find that the characteristic temperatures of glass-formation increase linearly with epsilon and that the fragility is independent of epsilon in fully flexible polymer melts, predictions that are again consistent with simulations of glass-forming polymer melts composed of fully flexible chains. Beyond an explanation of these general trends observed in simulations, the GET for fully flexible polymer melts predicts the presence of a positive residual configurational entropy at low temperatures, indicating a return to Arrhenius relaxation in the low temperature glassy state. Published by AIP Publishing. C1 [Xu, Wen-Sheng; Freed, Karl F.] Univ Chicago, James Franck Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA. [Douglas, Jack F.] NIST, Mat Sci & Engn Div, Gaithersburg, MD 20899 USA. [Freed, Karl F.] Univ Chicago, Dept Chem, 5735 S Ellis Ave, Chicago, IL 60637 USA. [Xu, Wen-Sheng] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, POB 2008, Oak Ridge, TN 37831 USA. RP Xu, WS (reprint author), Univ Chicago, James Franck Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA.; Xu, WS (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, POB 2008, Oak Ridge, TN 37831 USA. EM wsxu0312@gmail.com; jack.douglas@nist.gov; freed@uchicago.edu OI Xu, Wensheng/0000-0002-5442-8569 FU National Science Foundation (NSF) [CHE-1363012] FX This work is supported, in part, by the National Science Foundation (NSF) Grant No. CHE-1363012. NR 37 TC 1 Z9 1 U1 6 U2 6 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 23 AR 234509 DI 10.1063/1.4972412 PG 9 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EH3RG UT WOS:000391688900034 PM 28010099 ER PT J AU Bond-Lamberty, B Smith, AP Bailey, V AF Bond-Lamberty, Ben Smith, A. Peyton Bailey, Vanessa TI Temperature and moisture effects on greenhouse gas emissions from deep active-layer boreal soils SO BIOGEOSCIENCES LA English DT Article ID PERMAFROST CARBON; CLIMATE-CHANGE; FOREST SOIL; ORGANIC-MATTER; MICROBIAL COMMUNITIES; NITROGEN DEPOSITION; CH4 PRODUCTION; FIRE REGIME; RESPIRATION; SENSITIVITY AB Rapid climatic changes, rising air temperatures, and increased fires are expected to drive permafrost degradation and alter soil carbon (C) cycling in many high-latitude ecosystems. How these soils will respond to changes in their temperature, moisture, and overlying vegetation is uncertain but critical to understand given the large soil C stocks in these regions. We used a laboratory experiment to examine how temperature and moisture control CO2 and CH4 emissions from mineral soils sampled from the bottom of the annual active layer, i.e., directly above permafrost, in an Alaskan boreal forest. Gas emissions from 30 cores, subjected to two temperatures and either field moisture conditions or experimental drought, were tracked over a 100-day incubation; we also measured a variety of physical and chemical characteristics of the cores. Gravimetric water content was 0.31 +/- 0.12 (unitless) at the beginning of the incubation; cores at field moisture were unchanged at the end, but drought cores had declined to 0.06 +/- 0.04. Daily CO2 fluxes were positively correlated with incubation chamber temperature, core water content, and percent soil nitrogen. They also had a temperature sensitivity (Q(10) /of 1.3 and 1.9 for the field moisture and drought treatments, respectively. Daily CH4 emissions were most strongly correlated with percent nitrogen, but neither temperature nor water content was a significant first-order predictor of CH4 fluxes. The cumulative production of C from CO2 was over 6 orders of magnitude higher than that from CH4; cumulative CO2 was correlated with incubation temperature and moisture treatment, with drought cores producing 52-73% lower C. Cumulative CH4 production was unaffected by any treatment. These results suggest that deep active-layer soils may be sensitive to changes in soil moisture under aerobic conditions, a critical factor as discontinuous permafrost thaws in interior Alaska. Deep but unfrozen high-latitude soils have been shown to be strongly affected by long-term experimental warming, and these results provide insight into their future dynamics and feedback potential with future climate change. C1 [Bond-Lamberty, Ben] US DOE, Joint Global Change Res Inst, Pacific Northwest Natl Lab, College Pk, MD 20740 USA. [Smith, A. Peyton; Bailey, Vanessa] Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA USA. RP Bond-Lamberty, B (reprint author), US DOE, Joint Global Change Res Inst, Pacific Northwest Natl Lab, College Pk, MD 20740 USA. EM bondlamberty@pnnl.gov RI Bond-Lamberty, Ben/C-6058-2008 OI Bond-Lamberty, Ben/0000-0001-9525-4633 FU US Department of Energy, Office of Science, Biological and Environmental Research as part of the Terrestrial Ecosystem Sciences Program; DOE [DE-AC05-76RL01830] FX We are grateful to Jamie Hollingsworth for information about, and facilitating access to, the Caribou Poker Creeks Research Watershed Long-Term Ecological Research site. This research was supported by the US Department of Energy, Office of Science, Biological and Environmental Research as part of the Terrestrial Ecosystem Sciences Program. The Pacific Northwest National Laboratory is operated for DOE by Battelle Memorial Institute under contract DE-AC05-76RL01830. NR 82 TC 1 Z9 1 U1 37 U2 37 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1726-4170 EI 1726-4189 J9 BIOGEOSCIENCES JI Biogeosciences PD DEC 21 PY 2016 VL 13 IS 24 BP 6669 EP 6681 DI 10.5194/bg-13-6669-2016 PG 13 WC Ecology; Geosciences, Multidisciplinary SC Environmental Sciences & Ecology; Geology GA EH2DS UT WOS:000391578200001 ER PT J AU Li, LY Liu, HQ Wang, L Yue, SY Tong, X Zaliznyak, T Taylor, GT Wong, SS AF Li, Luyao Liu, Haiqing Wang, Lei Yue, Shiyu Tong, Xiao Zaliznyak, Tatiana Taylor, Gordon T. Wong, Stanislaus S. TI Chemical Strategies for Enhancing Activity and Charge Transfer in Ultrathin Pt Nanowires Immobilized onto Nanotube Supports for the Oxygen Reduction Reaction SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE Pt ultrathin nanowires; functionalized carbon nanotubes; noncovalent attachment; charge transfer; oxygen reduction reaction ID WALLED CARBON NANOTUBES; ONE-DIMENSIONAL NANOSTRUCTURES; MEMBRANE FUEL-CELLS; ELECTROCATALYTIC ACTIVITY; NANOPARTICLES; CATALYSTS; DURABILITY; OXIDATION; FUNCTIONALIZATION; PERFORMANCE AB Multiwalled carbon nanotubes (MWNTs) represent a promising support medium for electrocatalysts, especially Pt nanoparticles (NPs). The advantages of using MWNTs include their large surface area, high conductivity, as well as long-term stability. Surface functionalization of MWNTs with various terminal groups, such as -COOH, -SH, and -NH2, allows for rational electronic tuning of catalyst support interactions. However, several issues still need to be addressed for such systems. First, over the course of an electrochemical run, catalyst durability can decrease, due in part to metal NP dissolution, a process facilitated by the inherently high surface defect concentration within the support. Second, the covalent functionalization treatment of MWNTs adopted by most groups tends to lead to a loss of structural integrity of the nanotubes (NTs). To mitigate for all of these issues, we have utilized two different attachment approaches (i.e., covalent versus noncovalent) to functionalize the outer walls of pristine MWNTs and compared the catalytic performance of as-deposited ultrathin (<2 nm) 1D Pt nanowires with that of conventional Pt NPs toward the oxygen reduction reaction (ORR). Our results demonstrated that the electrochemical activity of Pt nanostructures immobilized onto functionalized carbon nanotube (CNT) supports could be dramatically improved by using ultrathin Pt nanowires (instead of NPs) with noncovalently (as opposed to covalently) functionalized CNT supports. Spectroscopic evidence corroborated the definitive presence of charge transfer between the metal catalysts and the underlying NT support, whose direction and magnitude are a direct function of (i) the terminal chemistry as well as (ii) the attachment methodology, both of which simultaneously impact upon the observed electrocatalytic performance. Specifically, the use of a noncovalent pi-pi stacking method coupled with a -COOH terminal moiety yielded the highest performance results, reported to date, for any similar system consisting of Pt (commercial NPs or otherwise) deposited onto carbon-based supports, a finding of broader interest toward the fabrication of high-performing electrocatalysts in general. C1 [Li, Luyao; Liu, Haiqing; Wang, Lei; Yue, Shiyu; Wong, Stanislaus S.] SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA. [Tong, Xiao] Brookhaven Natl Lab, Ctr Funct Nanomat, Bldg 735, Upton, NY 11973 USA. [Zaliznyak, Tatiana; Taylor, Gordon T.] SUNY Stony Brook, Sch Marine & Atmospher Sci, Stony Brook, NY 11794 USA. [Wong, Stanislaus S.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Div, Bldg 480, Upton, NY 11973 USA. RP Wong, SS (reprint author), SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA.; Wong, SS (reprint author), Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Div, Bldg 480, Upton, NY 11973 USA. EM stanislaus.wong@stonybrook.edu FU U.S. Department of Energy, Basic Energy Sciences, Materials Sciences and Engineering Division; NSF MRI [OCE-1336724]; [DE-SC-00112704] FX Research funding for all authors was provided by the U.S. Department of Energy, Basic Energy Sciences, Materials Sciences and Engineering Division. We thank Gerard Mattei for electrochemical data acquisition associated with the "Pt NW@COOH-CB composite" control sample. Work was conducted at Brookhaven National Laboratory, funded under Contract No. DE-SC-00112704. XPS data were collected at BNL's Center for Functional Nanomaterials, supported under Contract No. DE-SC-00112704. Raman data were acquired at Stony Brook University's Nano-Raman Molecular Imaging Laboratory (NARMIL), established with NSF MRI Grant OCE-1336724. NR 67 TC 0 Z9 0 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 21 PY 2016 VL 8 IS 50 BP 34280 EP 34294 DI 10.1021/acsami.6b07870 PG 15 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG0NG UT WOS:000390728900014 PM 27936537 ER PT J AU See, KA Wu, HL Lau, KC Shin, M Cheng, L Balasubramanian, M Gallagher, KG Curtiss, LA Gewirth, AA AF See, Kimberly A. Wu, Heng-Liang Lau, Kah Chun Shin, Minjeong Cheng, Lei Balasubramanian, Mahalingam Gallagher, Kevin G. Curtiss, Larry A. Gewirth, Andrew A. TI Effect of Hydrofluoroether Cosolvent Addition on Li Solvation in Acetonitrile-Based Solvate Electrolytes and Its Influence on S Reduction in a Li-S Battery SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE lithium-sulfur battery; solvate electrolyte; hydrofluoroether cosolvent; sulfur reduction kinetics; in situ Raman spectroscopy ID LITHIUM-SULFUR BATTERIES; NUCLEAR-MAGNETIC-RESONANCE; HIGH-ENERGY DENSITY; FLUORINATED ETHER; IONIC LIQUIDS; SUPERCONCENTRATED ELECTROLYTES; ELECTROCHEMICAL REDUCTION; RAMAN-SPECTROSCOPY; SALT ELECTROLYTE; APROTIC-SOLVENTS AB Li-S batteries are a promising next-generation battery technology. Due to the formation of soluble polysulfides during cell operation, the electrolyte composition of the cell plays an active role in directing the formation and speciation of the soluble lithium polysulfides. Recently, new classes of electrolytes termed "solvates" that contain stoichiometric quantities of salt and solvent and form a liquid at room temperature have been explored due to their sparingly solvating properties with respect to polysulfides. The viscosity of the solvate electrolytes is understandably high limiting their viability; however, hydrofluoroether cosolvents, thought to be inert to the solvate structure itself, can be introduced to reduce viscosity and enhance diffusion. Nazar and co-workers previously reported that addition of 1,1,2,2-tetrafluoroethyl 2,2,3,3-tetrafluoropropyl ether (TTE) to the LiTFSI in acetonitrile solvate, (MeCN)(2)-LiTFSI, results in enhanced capacity retention compared to the neat solvate. Here, we evaluate the effect of TTE addition on both the electrochemical behavior of the Li-S cell and the solvation structure of the (MeCN)(2)-LiTFSI electrolyte. Contrary to previous suggestions, Raman and NMR spectroscopy coupled with ab initio molecular dynamics simulations show that TTE coordinates to Li+ at the expense of MeCN coordination, thereby producing a higher content of free MeCN, a good polysulfide solvent, in the electrolyte. The electrolytes containing a higher free MeCN content facilitate faster polysulfide formation kinetics during the electrochemical reduction of S in a Li-S cell likely as a result of the solvation power of the free MeCN. C1 [See, Kimberly A.; Wu, Heng-Liang; Lau, Kah Chun; Shin, Minjeong; Cheng, Lei; Balasubramanian, Mahalingam; Gallagher, Kevin G.; Curtiss, Larry A.; Gewirth, Andrew A.] Joint Ctr Energy Storage Res, 9700 South Cass Ave, Argonne, IL 60439 USA. [See, Kimberly A.; Wu, Heng-Liang; Shin, Minjeong; Gewirth, Andrew A.] Univ Illinois, Dept Chem, Urbana, IL 61801 USA. [Lau, Kah Chun] Calif State Univ Northridge, Dept Phys & Astron, Northridge, CA 91330 USA. [Cheng, Lei; Curtiss, Larry A.] Argonne Natl Lab, Adv Photon Source, Div Mat Sci, Argonne, IL 60439 USA. [Gallagher, Kevin G.] Argonne Natl Lab, Adv Photon Source, Chem Sci & Engn Div, Argonne, IL 60439 USA. [Balasubramanian, Mahalingam] Argonne Natl Lab, Adv Photon Source, Xray Sci Div, Argonne, IL 60439 USA. RP Gewirth, AA (reprint author), Joint Ctr Energy Storage Res, 9700 South Cass Ave, Argonne, IL 60439 USA.; Gewirth, AA (reprint author), Univ Illinois, Dept Chem, Urbana, IL 61801 USA. EM agewirth@illinois.edu FU Joint Center for Energy Storage Research, an Energy Innovation Hub - U.S. Department of Energy, Office of Science, Basic Energy Sciences; St. Elmo Brady Future Faculty Fellowship; U.S. Department of Energy Office of Science laboratory [DE-AC02-06CH11357] FX This work was supported as part of the Joint Center for Energy Storage Research, an Energy Innovation Hub funded by the U.S. Department of Energy, Office of Science, Basic Energy Sciences. K.A.S. acknowledges postdoctoral funding from the St. Elmo Brady Future Faculty Fellowship. The authors thank Lingyang Zhu for assistance with T1 measurements and Paul M. Bayley for helpful discussions. K.C.L. and L.A.C. acknowledge grants of computer time through IBM BlueGene/Q computer through the Argonne Leadership Computing Facility (ALCF) and the LCRC Blues Cluster at Argonne National Laboratory. We thank Professor Scott E. Denmark and Guanqun Zhang of the Department of Chemistry at UIUC for the Karl Fisher titration measurements. The submitted manuscript has been created by UChicago Argonne, LLC, Operator of Argonne National Laboratory ("Argonne"). Argonne, a U.S. Department of Energy Office of Science laboratory, is operated under Contract No. DE-AC02-06CH11357. The U.S. Government retains for itself, and others acting on its behalf, a paid-up nonexclusive, irrevocable worldwide license in said article to reproduce, prepare derivative works, distribute copies to the public, and perform publicly and display publicly, by or on behalf of the Government. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan. http://energy.gov/downloads/doe-public-access-plan. NR 63 TC 0 Z9 0 U1 32 U2 32 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 21 PY 2016 VL 8 IS 50 BP 34360 EP 34371 DI 10.1021/acsami.6b11358 PG 12 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG0NG UT WOS:000390728900023 PM 27998132 ER PT J AU Kim, SH Bazin, N Shaw, JI Yoo, JH Worsley, MA Satcher, JH Sain, JD Kuntz, JD Kucheyev, SO Baumann, TF Hamza, AV AF Kim, Sung Ho Bazin, Nick Shaw, Jessica I. Yoo, Jae-Hyuck Worsley, Marcus A. Satcher, Joe H., Jr. Sain, John D. Kuntz, Joshua D. Kucheyev, Sergei O. Baumann, Theodore F. Hamza, Alex V. TI Synthesis of Nanostructured/Macroscopic Low-Density Copper Foams Based on Metal-Coated Polymer Core-Shell Particles SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE copper; metal foam; porous materials; core-shell particles; electroless deposition ID ELECTROLESS DEPOSITION; SENSING INDENTATION; TEMPLATE SYNTHESIS; GOLD; OXIDES; CU; MORPHOLOGY; REDUCTION; MONOLITHS; MECHANISM AB A robust, millimeter-sized low-density Cu foam with similar to 90% (v/v) porosity, similar to 30 nm thick walls, and similar to 1 mu m diameter spherical pores is prepared by the slip-casting of metal-coated polymer core shell particles followed by a thermal removal of the polymer. In this paper, we report our key findings that enable the development of the low-density Cu foams. First, we need to synthesize polystyrene (PS) particles coated with a very thin Cu layer (in the range of tens of nanometers). A simple reduction in the amount of Cu deposited onto the PS was not sufficient to form such a low-density Cu foams due to issues related to foam collapse and densification upon the subsequent polymer removal step. Precise control over the morphology of the Cu coating on the particles is essential for the synthesis of a lower density of foams. Second, improving the dispersion of PS Cu particles in a suspension used for the casting as well as careful optimization of a baking condition minimize the formation of irregular large voids, leading to Cu foams with a more uniform packing and a better connectivity of neighboring Cu hollow shells. Finally, we analyzed mechanical properties of the Cu foams with a depth-sensing indentation test. The uniform Cu foams show a significant improvement in mechanical properties (similar to 1.5 X modulus and similar to 3 X hardness) compared to those of uncontrolled foam samples with a similar foam density but irregular large voids. Higher surface areas and a good electric conductivity of the Cu foams present a great potential to future applications. C1 [Kim, Sung Ho; Shaw, Jessica I.; Yoo, Jae-Hyuck; Worsley, Marcus A.; Satcher, Joe H., Jr.; Sain, John D.; Kuntz, Joshua D.; Kucheyev, Sergei O.; Baumann, Theodore F.; Hamza, Alex V.] Lawrence Livermore Natl Lab, Nanoscale Synth & Characterizat Lab, 7000 East Ave, Livermore, CA 94550 USA. [Bazin, Nick] Atom Weap Estab, Reading RG7 4PR, Berks, England. RP Kim, SH (reprint author), Lawrence Livermore Natl Lab, Nanoscale Synth & Characterizat Lab, 7000 East Ave, Livermore, CA 94550 USA. EM kim61@llnl.gov FU U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344] FX This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. NR 41 TC 0 Z9 0 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 21 PY 2016 VL 8 IS 50 BP 34706 EP 34714 DI 10.1021/acsami.6b12320 PG 9 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG0NG UT WOS:000390728900063 PM 27998136 ER PT J AU Hoffeditz, WL Son, HJ Pellin, MJ Farha, OK Hupp, JT AF Hoffeditz, William L. Son, Ho-Jin Pellin, Michael J. Farha, Omar K. Hupp, Joseph T. TI Engendering Long-Term Air and Light Stability of a TiO2-Supported Porphyrinic Dye via Atomic Layer Deposition SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE atomic layer deposition; porphyrin dye; increased dye stability; dye enshroudment; dimethylaluminum isopropoxide; protective coating ID SENSITIZED SOLAR-CELLS; PHOTOCATALYTIC HYDROGEN-PRODUCTION; REDOX SHUTTLES; TIO2; PHOTOELECTRODES; STABILIZATION; ELECTROLYTES; DERIVATIVES; HARVESTERS; COATINGS AB Organic and porphyrin-based chromophores are prevalent in liquid-junction photovoltaic and photocatalytic solar-cell chemistry; however, their long-term air and light instability may limit their practicality in real world technologies. Here, we describe the protection of a zinc porphyrin dye, adsorbed on nanoparticulate TiO2, from air and light degradation by a protective coating of alumina grown with a previously developed post-treatment atomic layer deposition (ALD) technique. The protective Al2O3 ALD layer is deposited using dimethylaluminum isopropoxide as an Al source; in contrast to the ubiquitous ALD precursor trimethylalurninum, dimethylaluminum isopropoxide does not degrade the zinc porphyrin dye, as confirmed by UV vis measurements. The growth of this protective ALD layer around the dye can be monitored by an in-reactor quartz crystal microbalance (QCM). Furthermore, greater than 80% of porphyrin light absorption is retained over month of exposure to air and light when the protective coating is present, whereas almost complete loss of porphyrin absorption is observed in less than 2 days in the absence of the ALD protective layer. Applying the Al2O3 post-treatment technique to the TiO2-adsorbed dye allows the dye to remain in electronic contact with both the semiconductor surface and a surrounding electrolyte solution, the combination of which makes this technique promising for numerous other electrochemical photovoltaic and photocatalytic applications, especially those involving the dye-sensitized evolution of oxygen. C1 [Hoffeditz, William L.; Son, Ho-Jin; Pellin, Michael J.; Farha, Omar K.; Hupp, Joseph T.] Northwestern Univ, Dept Chem, 2145 Sheridan Rd, Evanston, IL 60208 USA. [Pellin, Michael J.; Hupp, Joseph T.] Argonne Natl Lab, Div Mat Sci, 9700 South Cass Ave, Argonne, IL 60439 USA. [Farha, Omar K.] King Abdulaziz Univ, Dept Chem, Fac Sci, Jeddah 21589, Saudi Arabia. [Son, Ho-Jin] Korea Univ, Dept Adv Mat Chem, Sejong 30019, South Korea. RP Farha, OK; Hupp, JT (reprint author), Northwestern Univ, Dept Chem, 2145 Sheridan Rd, Evanston, IL 60208 USA.; Hupp, JT (reprint author), Argonne Natl Lab, Div Mat Sci, 9700 South Cass Ave, Argonne, IL 60439 USA.; Farha, OK (reprint author), King Abdulaziz Univ, Dept Chem, Fac Sci, Jeddah 21589, Saudi Arabia. EM o-farha@northwestern.edu; j-hupp@northwestern.edu FU U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-FG02 87ER13808]; Northwestern University; Soft and Hybrid Nanotechnology Experimental (SHyNE) Resource (NSF) [NNCI-1542205]; MRSEC program (NSF) at the Materials Research Center [DMR-1121262]; International Institute for Nanotechnology (IIN); Keck Foundation; State of Illinois through IIN FX W.L.H. thanks Jason R. Avila for his contributions to QCM data collection and for useful discussions and Aaron W. Peters for collecting SEM/EDS data. We gratefully acknowledge financial support by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences (grant No. DE-FG02 87ER13808) and Northwestern University. This work made use of the EPIC and Keck-II facilities of the NUANCE Center at Northwestern University, which has received support from the Soft and Hybrid Nanotechnology Experimental (SHyNE) Resource (NSF NNCI-1542205), the MRSEC program (NSF DMR-1121262) at the Materials Research Center, the International Institute for Nanotechnology (IIN), the Keck Foundation, and the State of Illinois through the IIN. NR 37 TC 0 Z9 0 U1 11 U2 11 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 21 PY 2016 VL 8 IS 50 BP 34863 EP 34869 DI 10.1021/acsami.6b10844 PG 7 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EG0NG UT WOS:000390728900080 PM 27935694 ER PT J AU Han, Y Li, MZ Evans, JW AF Han, Yong Li, Maozhi Evans, James W. TI Capture zone area distributions for nucleation and growth of islands during submonolayer deposition SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID THIN-FILM GROWTH; SIZE DISTRIBUTIONS; ADATOM CAPTURE AB A fundamental evolution equation is developed to describe the distribution of areas of capture zones (CZs) associated with islands formed by homogeneous nucleation and growth during submonolayer deposition on perfect flat surfaces. This equation involves various quantities which characterize subtle spatial aspects of the nucleation process. These quantities in turn depend on the complex stochastic geometry of the CZ tessellation of the surface, and their detailed form determines the CZ area distribution (CZD) including its asymptotic features. For small CZ areas, behavior of the CZD reflects the critical island size, i. For large CZ areas, it may reflect the probability for nucleation near such large CZs. Predictions are compared with kinetic Monte Carlo simulation data for models with two-dimensional compact islands with i = 1 (irreversible island formation by diffusing adatom pairs) and i = 0 (adatoms spontaneously convert to stable nuclei, e.g., by exchange with the substrate). Published by AIP Publishing. C1 [Han, Yong] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [Li, Maozhi] Renmin Univ China, Dept Phys, Beijing 100872, Peoples R China. [Evans, James W.] Iowa State Univ, Dept Math, Dept Phys & Astron, Ames, IA 50011 USA. [Evans, James W.] Iowa State Univ, US DOE, Ames Lab, Ames, IA 50011 USA. RP Han, Y (reprint author), Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. OI Evans, James/0000-0002-5806-3720 FU NSF [CHE-1111500, CHE-1507223]; NSF of China [51271197]; USDOE [DE-AC02-07CH11358] FX We thank Tiago Oliveira for valuable comments on the manuscript. Y.H. and J.W.E. were supported for this work by NSF Grant Nos. CHE-1111500 and CHE-1507223. Computations utilized NSF-supported XSEDE resources. M.L. was supported by NSF of China under Grant No. 51271197. The work was performed at Ames Laboratory which is operated for the USDOE by Iowa State University under Contract No. DE-AC02-07CH11358. NR 33 TC 0 Z9 0 U1 2 U2 2 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 21 AR 211911 DI 10.1063/1.4961264 PG 12 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EF8TU UT WOS:000390603500020 ER PT J AU Han, Y Gaudry, E Oliveira, TJ Evans, JW AF Han, Yong Gaudry, Emilie Oliveira, Tiago J. Evans, James W. TI Point island models for nucleation and growth of supported nanoclusters during surface deposition SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID THIN-FILM GROWTH; CRITICAL CLUSTER-SIZE; EPITAXIAL-GROWTH; SUBMONOLAYER DEPOSITION; METAL-SURFACES; GERM-FORMATION; DISTRIBUTIONS; DIFFUSION; CAPTURE; VAPOR AB Point island models (PIMs) are presented for the formation of supported nanoclusters (or islands) during deposition on flat crystalline substrates at lower submonolayer coverages. These models treat islands as occupying a single adsorption site, although carrying a label to track their size (i.e., they suppress island structure). However, they are particularly effective in describing the island size and spatial distributions. In fact, these PIMs provide fundamental insight into the key features for homogeneous nucleation and growth processes on surfaces. PIMs are also versatile being readily adapted to treat both diffusion-limited and attachment-limited growth and also a variety of other nucleation processes with modified mechanisms. Their behavior is readily and precisely assessed by kinetic Monte Carlo simulation. Published by AIP Publishing. C1 [Han, Yong; Oliveira, Tiago J.; Evans, James W.] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [Gaudry, Emilie] Univ Lorraine, UMR CNRS 7098, Inst Jean Lamour, F-54011 Nancy, France. [Oliveira, Tiago J.] Univ Fed Vicosa, Dept Fis, BR-36570900 Vicosa, MG, Brazil. [Evans, James W.] Iowa State Univ, Dept Math, Ames, IA 50011 USA. [Evans, James W.] Iowa State Univ, US DOE, Ames Lab, Ames, IA 50011 USA. RP Han, Y (reprint author), Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. RI Oliveira, Tiago/R-5846-2016; OI Oliveira, Tiago/0000-0001-5675-7430; Evans, James/0000-0002-5806-3720 FU NSF [CHE-1111500, CHE-1507223]; USDOE [DE-AC02-07CH11358]; CNPq; FAPEMIG FX Y.H. and J.W.E. were supported for this work by NSF Grant Nos. CHE-1111500 and CHE-1507223. The work was performed at Ames Laboratory which is operated for the USDOE by Iowa State University under Contract No. DE-AC02-07CH11358. Computations utilized USDOE NERSC, OLCF, and NSF-supported XSEDE resources. E.G. was granted access for this work to the HPC resources of GENCI (Grand Equipement National de Calcul Intensif) under the allocation 96339. T.J.O. acknowledges the support from CNPq and FAPEMIG (Brazilian agencies). NR 53 TC 0 Z9 0 U1 9 U2 10 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 21 AR 211904 DI 10.1063/1.4954410 PG 14 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EF8TU UT WOS:000390603500013 ER PT J AU Kwolek, EJ Lei, HP Lii-Rosales, A Wallingford, M Zhou, YH Wang, CZ Tringides, MC Evans, JW Thiel, PA AF Kwolek, Emma J. Lei, Huaping Lii-Rosales, Ann Wallingford, Mark Zhou, Yinghui Wang, Cai-Zhuang Tringides, Michael C. Evans, James W. Thiel, Patricia A. TI Adsorption of dysprosium on the graphite (0001) surface: Nucleation and growth at 300 K SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID SCANNING-TUNNELING-MICROSCOPY; THIN-FILMS; EPITAXIAL-GROWTH; GRAPHENE; METALS; MORPHOLOGY; EVOLUTION; ISLANDS; PT(111); LAYERS AB We have studied nucleation and growth of Dy islands on the basal plane of graphite at 300 K using scanning tunneling microscopy, density functional theory (DFT) in a form that includes van der Waals interactions, and analytic theory. The interaction of atomic Dy with graphite is strong, while the diffusion barrier is small. Experiment shows that at 300 K, the density of nucleated islands is close to the value predicted for homogeneous nucleation, using critical nucleus size of 1 and the DFT-derived diffusion barrier. Homogeneous nucleation is also supported by the monomodal shape of the island size distributions. Comparison with the published island density of Dy on graphene shows that the value is about two orders of magnitude smaller on graphite, which can be attributed to more effective charge screening in graphite. The base of each island is 3 atomic layers high and atomically ordered, forming a coincidence lattice with the graphite. Islands resist coalescence, probably due to multiple rotational orientations associated with the coincidence lattice. Upper levels grow as discernible single-atom layers. Analysis of the level populations reveals significant downward interlayer transport, which facilitates growth of the base. This island shape is metastable, since more compact three-dimensional islands form at elevated growth temperature. Published by AIP Publishing. C1 [Kwolek, Emma J.; Lei, Huaping; Lii-Rosales, Ann; Wallingford, Mark; Zhou, Yinghui; Wang, Cai-Zhuang; Tringides, Michael C.; Evans, James W.; Thiel, Patricia A.] Ames Lab, Ames, IA 50011 USA. [Kwolek, Emma J.; Lii-Rosales, Ann; Thiel, Patricia A.] Iowa State Univ, Dept Chem, Ames, IA 50011 USA. [Lei, Huaping; Wang, Cai-Zhuang; Tringides, Michael C.; Evans, James W.] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [Thiel, Patricia A.] Iowa State Univ, Dept Mat Sci & Engn, Ames, IA 50011 USA. [Lei, Huaping] Chinese Acad Sci, Inst Solid State Phys, Key Lab Mat Phys, Beijing, Peoples R China. [Zhou, Yinghui] Xiamen Univ, Dept Phys, Xiamen 361005, Peoples R China. RP Thiel, PA (reprint author), Ames Lab, Ames, IA 50011 USA.; Thiel, PA (reprint author), Iowa State Univ, Dept Chem, Ames, IA 50011 USA.; Thiel, PA (reprint author), Iowa State Univ, Dept Mat Sci & Engn, Ames, IA 50011 USA. EM pthiel@iastate.edu OI Lei, Huaping/0000-0003-2911-6421; Evans, James/0000-0002-5806-3720; Kwolek, Emma/0000-0002-5244-0206 FU US Department of Energy (DOE), Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division; Iowa State University [DE-AC02-07CH11358]; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231]; National Science Foundation of China (NSFC) [11575230]; China Scholarship Council; NSF [CHE-1111500] FX The experimental and DFT components of this work (Secs. III and IV) were conducted by the following authors: E.J.K., H.L., A.L.-R., M.W., Y.Z., C.-Z.W., M.C.T., and P.A.T. Experimental and DFT effort was supported by the US Department of Energy (DOE), Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. Research was performed in part at the Ames Laboratory, which is operated by Iowa State University under Contract No. DE-AC02-07CH11358. DFT was performed, in part, with a grant of computer time at the National Energy Research Scientific Computing Centre (NERSC). NRSEC is a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. H.L.'s DFT was supported in part by the National Science Foundation of China (NSFC) Grant No. 11575230, and Y.Z.'s participation in the experimental effort was supported by the China Scholarship Council. The modeling and analyses described in Sec. V were performed by J.W.E., with support from NSF Grant No. CHE-1111500. NR 35 TC 0 Z9 0 U1 16 U2 27 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 21 AR 211902 DI 10.1063/1.4953611 PG 8 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EF8TU UT WOS:000390603500011 ER PT J AU Legg, BA De Yoreo, JJ AF Legg, Benjamin A. De Yoreo, James J. TI The energetics of prenucleation clusters in lattice solutions SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID LIQUID-LIQUID SEPARATION; ISING-MODEL; NUCLEATION THEORY; CONNECTED EMBEDDINGS; GENERATING-FUNCTIONS; STATISTICAL-THEORY; GERM-FORMATION; THERMODYNAMICS; KINETICS; SURFACE AB According to classical nucleation theory, nucleation from solution involves the formation of small atomic clusters. Most formulations of classical nucleation use continuum "droplet" approximations to describe the properties of these clusters. However, the discrete atomic nature of very small clusters may cause deviations from these approximations. Here, we present a self-consistent framework for describing the nature of these deviations. We use our framework to investigate the formation of "polycube" atomic clusters on a cubic lattice, for which we have used combinatoric data to calculate the thermodynamic properties of clusters with 17 atoms or less. We show that the classical continuum droplet model emerges as a natural approach to describe the free energy of small clusters, but with a size-dependent surface tension. However, this formulation only arises if an appropriate "site-normalized" definition is adopted for the free energy of formation. These results are independently confirmed through the use of Monte Carlo calculations. Our results show that clusters formed from sparingly soluble materials (mu M solubility range) tend to adopt compact configurations that minimize the solvent-solute interaction energy. As a consequence, there are distinct minima in the cluster-size-energy landscape that correspond to especially compact configurations. Conversely, highly soluble materials (1M) form clusters with expanded configurations that maximize configurational entropy. The effective surface tension of these clusters tends to smoothly and systematically decrease as the cluster size increases. However, materials with intermediate solubility (1 mM) are found to have a balanced behavior, with cluster energies that follow the classical "droplet" scaling laws remarkably well. (C) 2016 Author(s). All article content, except where otherwise noted, is licensed under a Creative Commons Attribution (CC BY) license (http://creativecommons.org/licenses/by/4.0/). C1 [Legg, Benjamin A.; De Yoreo, James J.] Pacific Northwest Natl Lab, Phys Sci Div, Richland, WA 99352 USA. [De Yoreo, James J.] Univ Washington, Dept Mat Sci & Engn, Seattle, WA 98195 USA. RP Legg, BA (reprint author), Pacific Northwest Natl Lab, Phys Sci Div, Richland, WA 99352 USA. EM benjamin.legg@pnnl.gov FU U.S. Department of Energy, Office of Basic Energy Sciences, Synthesis Science and Processing Program at The Pacific Northwest National Laboratory [DE-AC05-76RL01830]; Laboratory Directed Research and Development Program's Materials Synthesis and Simulation across Scales Initiative at PNNL FX The authors thank Dr. Christopher J. Mundy, Dr. Shawn M. Kathmann, and Dr. Gregory K. Schenter for their helpful advice in developing the concepts presented here. This research was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Synthesis Science and Processing Program at The Pacific Northwest National Laboratory, which is operated by Battelle for the U.S. Department of Energy under Contract No. DE-AC05-76RL01830. Conception and initial capability development was funded through the Laboratory Directed Research and Development Program's Materials Synthesis and Simulation across Scales Initiative at PNNL. NR 46 TC 0 Z9 0 U1 14 U2 14 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 21 AR 211921 DI 10.1063/1.4964489 PG 11 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EF8TU UT WOS:000390603500030 ER PT J AU Qin, ZB Hou, GL Yang, Z Valiev, M Wang, XB AF Qin, Zhengbo Hou, Gao-Lei Yang, Zheng Valiev, Marat Wang, Xue-Bin TI Negative ion photoelectron spectra of ISO3-, IS2O3-, and IS2O4- intermediates formed in interfacial reactions of ozone and iodide/sulfite aqueous microdroplets SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID CORRELATED MOLECULAR CALCULATIONS; NONMETAL REDOX KINETICS; GAS-PHASE OZONOLYSIS; GAUSSIAN-BASIS SETS; ATMOSPHERIC IMPLICATIONS; ORGANIC-COMPOUNDS; SULFURIC-ACID; SPECTROSCOPY; HYDROGEN; CLUSTERS AB Three short-lived, anionic intermediates, ISO3-, IS2O3-, and IS2O4-, are detected during reactions between ozone and aqueous iodine/ sulfur oxide microdroplets. These species may play an important role in ozone-driven inorganic aerosol formation; however their chemical properties remain largely unknown. This is the issue addressed in this work using negative ion photoelectron spectroscopy (NIPES) and ab initio modeling. The NIPE spectra reveal that all of the three anionic species are characterized by high adiabatic detachment energies (ADEs) - 4.62 +/- 0.10, 4.52 +/- 0.10, and 4.60 +/- 0.10 eV for ISO3-, IS2O3-, and IS2O4-, respectively. Vibrational progressions with frequencies assigned to the S-O symmetric stretching modes are discernable in the ground state transition features. Density functional theory calculations show the presence of several low-lying isomers involving different bonding scenarios. Further analysis based on high level CCSD(T) calculations reveal that the lowest energy structures are characterized by the formation of I-S and S-S bonds and can be structurally viewed as SO3 linked with I, IS, and ISO for ISO3-, IS2O3-, and IS2O4-, respectively. The calculated ADEs and vertical detachment energies are in excellent agreement with the experimental results, further supporting the identified minimum energy structures. The obtained intrinsic molecular properties of these anionic intermediates and neutral radicals should be useful to help understand their photochemical reactions in the atmosphere. Published by AIP Publishing. C1 [Qin, Zhengbo] Anhui Normal Univ, Optoelect Mat Sci & Technol Lab, Wuhu 241000, Anhui, Peoples R China. [Qin, Zhengbo; Hou, Gao-Lei; Yang, Zheng; Wang, Xue-Bin] Pacific Northwest Natl Lab, Phys Sci Div, POB 999,MS K8-88, Richland, WA 99352 USA. [Valiev, Marat] Pacific Northwest Natl Lab, Environm Mol Sci Lab, 902 Battelle Blvd,POB 999, Richland, WA 99352 USA. RP Wang, XB (reprint author), Pacific Northwest Natl Lab, Phys Sci Div, POB 999,MS K8-88, Richland, WA 99352 USA.; Valiev, M (reprint author), Pacific Northwest Natl Lab, Environm Mol Sci Lab, 902 Battelle Blvd,POB 999, Richland, WA 99352 USA. EM marat.valiev@pnnl.gov; xuebin.wang@pnnl.gov OI Wang, Xue-Bin/0000-0001-8326-1780 FU U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences; National Science Foundation of China [21503003]; Anhui Natural Science Foundation [1608085QA10]; Anhui University Natural Science Foundation [KJ2015A032]; Startup Foundation for Doctors of Anhui Normal University; Special Program for Applied Research on Super Computation of the NSFC-Guangdong Joint Fund FX This research was supported by the U.S. Department of Energy (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences and Biosciences (X.-B.W. and M.V.) and was performed at the EMSL, a national scientific user facility sponsored by DOE's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory. Part of the research was supported by EMSL Intramural Aerosol Science Theme Funding (Z.Q. and G.-L.H.). This work is also supported by the National Science Foundation of China (Grant No. 21503003), Anhui Natural Science Foundation (Grant No. 1608085QA10), Anhui University Natural Science Foundation (Grant No. KJ2015A032), and Startup Foundation for Doctors of Anhui Normal University. We also acknowledge additional support from Special Program for Applied Research on Super Computation of the NSFC-Guangdong Joint Fund (the second phase). NR 46 TC 0 Z9 0 U1 13 U2 13 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 21 AR 214310 DI 10.1063/1.4969076 PG 6 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EF8TU UT WOS:000390603500053 ER PT J AU Scheck, J Drechsler, M Ma, X Stockl, MT Konsek, J Schwaderer, JB Stadler, SM De Yoreo, JJ Gebauer, D AF Scheck, J. Drechsler, M. Ma, X. Stoeckl, M. T. Konsek, J. Schwaderer, J. B. Stadler, S. M. De Yoreo, J. J. Gebauer, D. TI Polyaspartic acid facilitates oxolation within iron(iii) oxide pre-nucleation clusters and drives the formation of organic-inorganic composites SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID CALCIUM-CARBONATE; HYDROLYSIS; CRYSTALLIZATION; IONS; PRECIPITATION; OXYHYDROXIDE; COLLOIDS; MATRIX; GROWTH; MODEL AB The interplay between polymers and inorganic minerals during the formation of solids is crucial for biomineralization and bio-inspired materials, and advanced material properties can be achieved with organic-inorganic composites. By studying the reaction mechanisms, basic questions on organic-inorganic interactions and their role during material formation can be answered, enabling more target-oriented strategies in future synthetic approaches. Here, we present a comprehensive study on the hydrolysis of iron(III) in the presence of polyaspartic acid. For the basic investigation of the formation mechanism, a titration assay was used, complemented by microscopic techniques. The polymer is shown to promote precipitation in partly hydrolyzed reaction solutions at the very early stages of the reaction by facilitating iron(III) hydrolysis. In unhydrolyzed solutions, no significant interactions between the polymer and the inorganic solutes can be observed. We demonstrate that the hydrolysis promotion by the polymer can be understood by facilitating oxolation in olation iron(III) pre-nucleation clusters. We propose that the adsorption of olation pre-nucleation clusters on the polymer chains and the resulting loss in dynamics and increased proximity of the reactants is the key to this effect. The resulting composite material obtained from the hydrolysis in the presence of the polymer was investigated with additional analytical techniques, namely, scanning and transmission electron microscopies, light microscopy, atomic force microscopy, zeta potential measurements, dynamic light scattering, and thermogravimetric analyses. It consists of elastic, polydisperse nanospheres, ca. 50-200 nm in diameter, and aggregates thereof, exhibiting a high polymer and water content. Published by AIP Publishing. C1 [Scheck, J.; Konsek, J.; Schwaderer, J. B.; Stadler, S. M.; Gebauer, D.] Univ Konstanz, Dept Chem, Univ Str 10, D-78457 Constance, Germany. [Drechsler, M.] Univ Bayreuth, BIMF, Lab Soft Matter Electron Microscopy, Univ Str 30, D-95440 Bayreuth, Germany. [Ma, X.] Idaho State Univ, Dept Chem, Pocatello, ID 83201 USA. [Stoeckl, M. T.] Univ Konstanz, Bioimaging Ctr, Univ Str 10, D-78457 Constance, Germany. [De Yoreo, J. J.] Pacific Northwest Natl Lab, Phys Sci Div, Richland, WA 99352 USA. [De Yoreo, J. J.] Univ Washington, Dept Mat Sci & Engn, Seattle, WA 98195 USA. RP Gebauer, D (reprint author), Univ Konstanz, Dept Chem, Univ Str 10, D-78457 Constance, Germany. EM Denis.Gebauer@uni-konstanz.de RI Gebauer, Denis/H-2408-2011 OI Gebauer, Denis/0000-0003-1612-051X FU Fonds der Chemischen Industrie; German Research Foundation (DFG) [GE 2278/6-1]; National Science Foundation (NSF) [DMR-1312697] FX D.G. is a Research Fellow of the Zukunftskolleg of the University of Konstanz. We acknowledge the support by the Fonds der Chemischen Industrie and both the German Research Foundation (DFG) within Project No. GE 2278/6-1 and the National Science Foundation (NSF) under Grant No. DMR-1312697, which are part of the NSF-DFG "MaterialsWorld Network for Particle-mediated Control Over Crystallization: From the Pre-nucleation Stage to the Final Crystal." We thank Jennifer Knaus for carrying out the TGA experiments. NR 32 TC 0 Z9 0 U1 12 U2 12 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 21 PY 2016 VL 145 IS 21 AR 211917 DI 10.1063/1.4963738 PG 8 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EF8TU UT WOS:000390603500026 ER PT J AU Pato-Doldan, B Gomez-Aguirre, LC Hansen, AP Mira, J Castro-Garcia, S Sanchez-Andujar, M Senaris-Rodriguez, MA Zapf, VS Singleton, J AF Pato-Doldan, B. Gomez-Aguirre, L. C. Hansen, A. P. Mira, J. Castro-Garcia, S. Sanchez-Andujar, M. Senaris-Rodriguez, M. A. Zapf, V. S. Singleton, J. TI Magnetic transitions and isotropic versus anisotropic magnetic behaviour of [CH3NH3][M(HCOO)(3)] M = Mn2+, Co2+, Ni2+, Cu2+ metal-organic perovskites SO JOURNAL OF MATERIALS CHEMISTRY C LA English DT Article ID PROMINENT DIELECTRIC ANOMALIES; NEGATIVE THERMAL-EXPANSION; WEAK FERROMAGNETISM; INORGANIC PEROVSKITES; NEUTRON-DIFFRACTION; FORMATE FRAMEWORKS; PHASE-TRANSITIONS; FERROELECTRICITY; SYSTEM; CHAINS AB Here we present an in-depth study of the magnetic properties of a family of metal organic perovskites ABX(3), [CH3NH3][M(HCOO)(3)] in which A = CH3NH3+ is the methylammonium cation, B = M is a divalent metal cation (Mn2+, Co2+, Ni2+ or Cu2+), and X is the formate anion (HCOO-). The magnetic properties have been measured on powdered samples and along the different orientations of mm-sized single crystals. They display spin-canted weak ferromagnetism with Neel temperatures of 8.0 K (Mn2+), 15.7 K (Co2+) and 34 K (Ni2+), which are inversely proportional to the ionic radii of the metal cations. The Cu2+ member displays low-dimensional magnetism as a result of orbital ordering of the Cu2+ d orbitals originating from a Jahn-Teller distortion. Pulsed-field magnetization experiments (fields of up to 60 T at temperatures down to 0.6 K) show that Mn2+, Co2+ and Ni2+ formates display cation-characteristic spin flop transitions. A saturation magnetization value of 5 mu(B) (at 12.5 T) was observed for Mn2+, meanwhile the Co2+ formate shows an orientation dependent quasi saturation (5.1 mu(B) at 21 T along [101] vs. 5.8 mu(B) at 26 T along [010]). The different isotropic/anisotropic behaviour can be explained by the orbital contribution to the magnetic response. C1 [Pato-Doldan, B.; Gomez-Aguirre, L. C.; Castro-Garcia, S.; Sanchez-Andujar, M.; Senaris-Rodriguez, M. A.] Univ A Coruna, Dept Fundamental Chem, Fac Sci, QuiMolMat Grp,CICA, Campus A Coruna, La Coruna 15071, Spain. [Hansen, A. P.; Zapf, V. S.; Singleton, J.] Los Alamos Natl Lab, Natl High Magnet Field Lab, Los Alamos, NM 87545 USA. [Mira, J.] Univ Santiago de Compostela, Dept Appl Phys, Santiago 15782, Spain. RP Pato-Doldan, B (reprint author), Univ A Coruna, Dept Fundamental Chem, Fac Sci, QuiMolMat Grp,CICA, Campus A Coruna, La Coruna 15071, Spain. EM Breogan.Doldan@uib.no RI Mira, Jorge/F-9077-2016; OI Mira, Jorge/0000-0002-6024-6294; Pato Doldan, Breogan/0000-0003-2302-8623; Gomez Aguirre, Lilian Claudia/0000-0001-8822-0910; Senaris-Rodriguez, M. A./0000-0002-0117-6855 FU Ministerio de Economia y Competitividad (MINECO) (Spain); EU [ENE2014-56237-C4-4-R]; Xunta de Galicia [GRC2014/042]; UDC; Fundacion Barrie; Laboratory Directed Research and Development program at LANL; U.S. National Science Foundation [DMR-1157490]; State of Florida; U.S. Department of Energy FX The Spanish authors are grateful for financial support from Ministerio de Economia y Competitividad (MINECO) (Spain) and EU under the project ENE2014-56237-C4-4-R, and Xunta de Galicia under the project GRC2014/042. L. C. G.-A. acknowledges UDC for a predoctoral fellowship and Fundacion Barrie for the research stay grant at LANL. Work at LANL, A. P. H. and B. P.-D.'s visit to LANL were funded by the Laboratory Directed Research and Development program at LANL. The NHMFL pulsed-field facility is funded by the U.S. National Science Foundation through Cooperative Grant No. DMR-1157490, the State of Florida, and the U.S. Department of Energy. NR 50 TC 0 Z9 0 U1 16 U2 16 PU ROYAL SOC CHEMISTRY PI CAMBRIDGE PA THOMAS GRAHAM HOUSE, SCIENCE PARK, MILTON RD, CAMBRIDGE CB4 0WF, CAMBS, ENGLAND SN 2050-7526 EI 2050-7534 J9 J MATER CHEM C JI J. Mater. Chem. C PD DEC 21 PY 2016 VL 4 IS 47 BP 11164 EP 11172 DI 10.1039/c6tc03992h PG 9 WC Materials Science, Multidisciplinary; Physics, Applied SC Materials Science; Physics GA EG0MB UT WOS:000390725800020 ER PT J AU Magnotti, EL Hughes, SA Dillard, RS Wang, SY Hough, L Karumbamkandathil, A Lian, TQ Wall, JS Zuo, XB Wright, ER Conticello, VP AF Magnotti, Elizabeth L. Hughes, Spencer A. Dillard, Rebecca S. Wang, Shengyuan Hough, Lillian Karumbamkandathil, Arshad Lian, Tianquan Wall, Joseph S. Zuo, Xiaobing Wright, Elizabeth R. Conticello, Vincent P. TI Self-Assembly of an alpha-Helical Peptide into a Crystalline Two-Dimensional Nanoporous Framework SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID SUPRAMOLECULAR ORGANIC FRAMEWORK; ANGSTROM RESOLUTION STRUCTURE; PACKING ANGLE PREFERENCES; COILED-COIL ASSEMBLIES; COMPUTATIONAL DESIGN; PROTEIN NANOMATERIALS; DIMERIZATION DOMAIN; COMPLEX NANOSHEET; ATP SYNTHASE; SHEETS AB Sequence-specific peptides have been demonstrated to self-assemble into structurally defined nanoscale objects including nanofibers, nanotubes, and nanosheets. The latter structures display significant promise for the construction of hybrid materials for functional devices due to their extended planar geometry. Realization of this objective necessitates the ability to control the structural features of the resultant assemblies through the peptide sequence. The design of a amphiphilic peptide, 3FD-IL, is described that comprises two repeats of a canonical 18 amino acid sequence associated with straight a-helical structures. Peptide 3FD-IL displays 3-fold screw symmetry in a helical conformation and self-assembles into nanosheets based on hexagonal packing of helices. Biophysical evidence from TEM, cryo-TEM, SAXS, AFM, and STEM measurements on the 3FD-IL nanosheets support a structural model based on a honeycomb lattice, in which the length of the peptide determines the thickness of the nanosheet and the packing of helices defines the presence of nanoscale channels that permeate the sheet. The honeycomb structure can be rationalized on the basis of geometrical packing frustration in which the channels occupy defect sites that define a periodic superlattice. The resultant 2D materials may have potential as materials for nanoscale transport and controlled release applications. C1 [Magnotti, Elizabeth L.; Hughes, Spencer A.; Wang, Shengyuan; Hough, Lillian; Karumbamkandathil, Arshad; Lian, Tianquan; Conticello, Vincent P.] Emory Univ, Dept Chem, Atlanta, GA 30322 USA. [Dillard, Rebecca S.; Wright, Elizabeth R.] Emory Univ, Sch Med, Dept Pediat, Childrens Healthcare Atlanta, Atlanta, GA 30322 USA. [Wall, Joseph S.] Brookhaven Natl Lab, POB 5000, Upton, NY 11973 USA. [Zuo, Xiaobing] Argonne Natl Lab, Xray Sci Div, 9700 South Cass Ave, Argonne, IL 60439 USA. [Magnotti, Elizabeth L.] Harvard Med Sch, Dept Canc Immunol & Virol, Dana Farber Canc Inst, Dept Med, 450 Brookline Ave, Boston, MA 02215 USA. RP Conticello, VP (reprint author), Emory Univ, Dept Chem, Atlanta, GA 30322 USA. EM vcontic@emory.edu FU National Science Foundation [0923395, CHE-1309817]; National Institutes of Health [S10 RR025679]; Robert P. Apkarian Integrated Electron Microscopy Core (RPAIEMC); Emory College of Arts and Sciences; Emory University School of Medicine; National Center for Advancing Translational Sciences of the National Institutes of Health [UL1TR000454]; U.S. D.O.E. Office of Basic Energy Sciences, Division of Material Sciences [W-31-109-Eng-38]; NSF [CHE-1012620, CHE-1412580]; Emory University; Children's Healthcare of Atlanta; Georgia Research Alliance; Center for AIDS Research at Emory University [P30 AI050409]; James B. Pendleton Charitable Trust; NIH [R01GM104540] FX The electron microscopy data described here were gathered on either a JEOL JEM-2200FS 200 kV TEM (supported by a National Science Foundation Major Research Instrumentation Grant 0923395) or on a JEOL JEM-1400 120 kV TEM (supported by a National Institutes of Health Grant S10 RR025679). This study was supported in part by the Robert P. Apkarian Integrated Electron Microscopy Core (RPAIEMC), which is subsidized by the Emory College of Arts and Sciences and the Emory University School of Medicine and is one of the Emory Integrated Core Facilities. Additional support was provided by the National Center for Advancing Translational Sciences of the National Institutes of Health under award number UL1TR000454. The content is solely the responsibility of the authors and does not necessarily reflect the official views of the National Institutes of Health. This work benefited from the use of the A.P.S. funded by U.S. D.O.E. Office of Basic Energy Sciences, Division of Material Sciences, under contract W-31-109-Eng-38. We acknowledge the assistance of Dr. Anil Mehta for the construction of the molecular model of the honeycomb structure. V.P.C. acknowledges financial support from NSF grants CHE-1012620 and CHE-1412580. T.L. acknowledges the financial support from the National Science Foundation (CHE-1309817). E.R.W. acknowledges support from Emory University, Children's Healthcare of Atlanta, the Georgia Research Alliance, the Center for AIDS Research at Emory University (P30 AI050409), the James B. Pendleton Charitable Trust, and NIH grant R01GM104540. NR 79 TC 0 Z9 0 U1 43 U2 43 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 21 PY 2016 VL 138 IS 50 BP 16274 EP 16282 DI 10.1021/jacs.6b06592 PG 9 WC Chemistry, Multidisciplinary SC Chemistry GA EG0NM UT WOS:000390729500021 PM 27936625 ER PT J AU DeVine, JA Weichman, ML Zhou, XY Ma, JY Jiang, B Guo, H Neumark, DM AF DeVine, Jessalyn A. Weichman, Marissa L. Zhou, Xueyao Ma, Jianyi Jiang, Bin Guo, Hua Neumark, Daniel M. TI Non-Adiabatic Effects on Excited States of Vinylidene Observed with Slow Photoelectron Velocity-Map Imaging SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID POTENTIAL-ENERGY SURFACE; DISCRETE VARIABLE REPRESENTATION; ACETYLENE ISOMERIZATION; UNIMOLECULAR REACTION; QUANTUM CALCULATIONS; TRIPLET VINYLIDENE; STATIONARY-POINTS; REACTION DYNAMICS; NEGATIVE-IONS; SPECTROSCOPY AB High-resolution slow photoelectron velocity-map imaging spectra of cryogenically cooled (X) over tilde B-2(2) H2CC- and D2CC- in the region of the vinylidene triplet excited states are reported. Three electronic bands are observed and, with the assistance of electronic structure calculations and quantum dynamics on ab initio-based near-equilibrium potential energy surfaces, are assigned as detachment to the (a) over tilde B-3(2) (T-1), (b) over tilde (3)A(2) (T-2), and (A) over tilde (1)A(2) (S-1) excited states of neutral vinylidene. This work provides the first experimental observation of the (A) over tilde singlet excited state of H2CC. While regular vibrational structure is observed for the (a) over tilde and (A) over tilde electronic bands, a number of irregular features are resolved in the vicinity of the (b) over tilde band vibrational origin. High-level ab initio calculations suggest that this anomalous structure arises from a conical intersection between the (a) over tilde and (b) over tilde triplet states near the (b) over tilde state minimum, which strongly perturbs the vibrational levels in the two electronic states through nonadiabatic coupling. Using the adiabatic electron affinity of H2CC previously measured to be 0.490(6) eV by Ervin and co-workers [J. Chem. Phys. 1989, 91, 5974], term energies for the excited neutral states of H2CC are found to be T-0((a) over tilde B-3(2)) = 2.064(6), T-0((b) over tilde (3)A(2)) = 2.738(6), and T-0((A) over tilde (1)A(2)) = 2.991(6) eV. C1 [DeVine, Jessalyn A.; Weichman, Marissa L.; Neumark, Daniel M.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Zhou, Xueyao; Jiang, Bin] Univ Sci & Technol China, Dept Chem Phys, Hefei 230026, Anhui, Peoples R China. [Ma, Jianyi] Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Sichuan, Peoples R China. [Guo, Hua] Univ New Mexico, Dept Chem & Chem Biol, Albuquerque, NM 87131 USA. [Neumark, Daniel M.] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. RP Neumark, DM (reprint author), Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA.; Jiang, B (reprint author), Univ Sci & Technol China, Dept Chem Phys, Hefei 230026, Anhui, Peoples R China.; Neumark, DM (reprint author), Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. EM bjiangch@ustc.edu.cn; dneumark@berkeley.edu OI Weichman, Marissa/0000-0002-2551-9146; Neumark, Daniel/0000-0002-3762-9473; Zhou, Xueyao/0000-0002-7038-9360; Guo, Hua/0000-0001-9901-053X; jiang, bin/0000-0003-2696-5436 FU Air Force Office of Scientific Research [FA9550-16-1-0097]; US Department of Energy [DE-SC0015997]; National Natural Science Foundation of China [91441107, 21573203]; National Science Foundation FX This research is funded by the Air Force Office of Scientific Research (No. FA9550-16-1-0097 to D.M.N.), by the US Department of Energy (No. DE-SC0015997 to H.G.), and by the National Natural Science Foundation of China (No. 91441107 to J.M. and No. 21573203 to B.J.). M.L.W. thanks the National Science Foundation for a graduate research fellowship. The authors thank Robert Field for many useful discussions. NR 88 TC 0 Z9 0 U1 18 U2 18 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 21 PY 2016 VL 138 IS 50 BP 16417 EP 16425 DI 10.1021/jacs.6b10233 PG 9 WC Chemistry, Multidisciplinary SC Chemistry GA EG0NM UT WOS:000390729500037 PM 27936652 ER PT J AU Bandstra, MS Aucott, TJ Brubaker, E Chivers, DH Cooper, RJ Curtis, JC Davis, JR Joshi, TH Kua, J Meyer, R Negut, V Quinlan, M Quiter, BJ Srinivasan, S Zakhor, A Zhang, R Vetter, K AF Bandstra, Mark S. Aucott, Timothy J. Brubaker, Erik Chivers, Daniel H. Cooper, Reynold J. Curtis, Joseph C. Davis, John R. Joshi, Tenzing H. Kua, John Meyer, Ross Negut, Victor Quinlan, Michael Quiter, Brian J. Srinivasan, Shreyas Zakhor, Avideh Zhang, Richard Vetter, Kai TI RadMAP: The Radiological. Multi-sensor Analysis Platform SO NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS SPECTROMETERS DETECTORS AND ASSOCIATED EQUIPMENT LA English DT Article DE Gamma-ray detection; Gamma-ray imaging; Background radiation; Data fusion; Homeland security; Radiological search ID MOBILE SPECTROSCOPY; IMAGING-SYSTEMS; RAY; ALGORITHMS; DETECTOR; SPECTRA; SEARCH AB The variability of gamma-ray and neutron background during the operation of a mobile detector system greatly limits the ability of the system to detect weak radiological and nuclear threats. The natural radiation background measured by a mobile detector system is the result of many factors, including the radioactivity of nearby materials, the geometric configuration of those materials and the system, the presence of absorbing materials, and atmospheric conditions. Background variations tend to be highly non-Poissonian, making it difficult to set robust detection thresholds using knowledge of the mean background rate alone. The Radiological Multi-sensor Analysis Platform (RadMAP) system is designed to allow the systematic study of natural radiological background variations and to serve as a development platform for emerging concepts in mobile radiation detection and imaging. To do this, RadMAP has been used to acquire extensive, systematic background measurements and correlated contextual data that can be used to test algorithms and detector modalities at low false alarm rates. By combining gamma-ray and neutron detector systems with data from contextual sensors, the system enables the fusion of data from multiple sensors into novel data products. The data are curated in a common format that allows for rapid querying across all sensors, creating detailed multi-sensor datasets that are used to study correlations between radiological and contextual data, and develop and test novel techniques in mobile detection and imaging. In this paper we will describe the instruments that comprise the RadMAP system, the effort to curate and provide access to multi-sensor data, and some initial results on the fusion of contextual and radiological data. C1 [Bandstra, Mark S.; Chivers, Daniel H.; Cooper, Reynold J.; Curtis, Joseph C.; Joshi, Tenzing H.; Kua, John; Meyer, Ross; Negut, Victor; Quinlan, Michael; Quiter, Brian J.; Vetter, Kai] Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA USA. [Aucott, Timothy J.; Curtis, Joseph C.; Davis, John R.; Srinivasan, Shreyas; Vetter, Kai] Univ Calif Berkeley, Dept Nucl Engn, Berkeley, CA 94720 USA. [Brubaker, Erik] Sandia Natl Labs, Livermore, CA USA. [Srinivasan, Shreyas; Zakhor, Avideh; Zhang, Richard] Univ Calif Berkeley, Dept Elect Engn & Comp Sci, Berkeley, CA 94720 USA. RP Bandstra, MS (reprint author), Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA USA. EM msbandstra@lbl.gov FU U.S. Department of Homeland Security Domestic Nuclear Detection Office [2011-DN-077-ARI049-03, HSHQDC-14-X-00197, IAA HSHQDC-11-X-00380]; U.S. Department of Energy by Lawrence Berkeley National Laboratory [DE-AC02-05CH11231]; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work was supported by the U.S. Department of Homeland Security Domestic Nuclear Detection Office under Grant Award 2011-DN-077-ARI049-03, HSHQDC-14-X-00197, and IAA HSHQDC-11-X-00380.; This work was also performed under the auspices of the U.S. Department of Energy by Lawrence Berkeley National Laboratory under Contract DE-AC02-05CH11231.; Data storage, processing, and the GRDC science gateway all use resources of the National Energy Research Scientific Computing Center, which is supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. This support does not constitute an express or implied endorsement on the part of the government. NR 55 TC 1 Z9 1 U1 3 U2 3 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0168-9002 EI 1872-9576 J9 NUCL INSTRUM METH A JI Nucl. Instrum. Methods Phys. Res. Sect. A-Accel. Spectrom. Dect. Assoc. Equip. PD DEC 21 PY 2016 VL 840 BP 59 EP 68 DI 10.1016/j.nima.2016.09.040 PG 10 WC Instruments & Instrumentation; Nuclear Science & Technology; Physics, Nuclear; Physics, Particles & Fields SC Instruments & Instrumentation; Nuclear Science & Technology; Physics GA EG1WV UT WOS:000390825800008 ER PT J AU Guo, XF Lipp, C Tiferet, E Lanzirotti, A Newville, M Engelhard, MH Wu, D Ilton, ES Sutton, SR Xu, HW Burns, PC Navrotsky, A AF Guo, Xiaofeng Lipp, Christian Tiferet, Eitan Lanzirotti, Antonio Newville, Matthew Engelhard, Mark H. Wu, Di Ilton, Eugene S. Sutton, Stephen R. Xu, Hongwu Burns, Peter C. Navrotsky, Alexandra TI Structure and thermodynamic stability of UTa3O10, a U(v)-bearing compound SO DALTON TRANSACTIONS LA English DT Article ID HIGH-TEMPERATURE CALORIMETRY; MIXED-OXIDE CATALYSTS; X-RAY; ACRYLONITRILE CATALYSTS; SELECTIVE OXIDATION; JAHNBERG-STRUCTURE; CRYSTAL-STRUCTURES; URANIUM; USB3O10; ENERGETICS AB Heating a mixture of uranyl(vi) nitrate and tantalum(v) oxide in the molar ratio of 2: 3 to 1400 degrees C resulted in the formation of a new compound, UTa3O10. The honey colored to yellow brown crystals of UTa3O10 crystallize in an orthorhombic structure with the space group Fddd (no. 70), lattice parameters a = 7.3947(1), b = 12.7599(2), c = 15.8156(2) angstrom, and Z = 8. Vertex sharing [TaO6](7-) octahedra of two crystallographically distinct Ta cations form a three dimensional tantalate framework. Within this framework, six membered rings of [TaO6](7-) octahedra are formed within the (001) plane. The center of these rings is occupied by the uranyl cations [UO2](+), with an oxidation state of +5 for uranium. The pentavalence of U and Ta was confirmed by X-ray photoelectron spectroscopy and X-ray adsorption spectroscopy. The enthalpy of formation of UTa3O10 from Ta2O5, beta-U3O7, and U3O8 has been determined to be 13.1 +/- 18.1 kJ mol(-1) using high temperature oxide melt solution calorimetry with sodium molybdate as the solvent at 700 degrees C. The close to zero enthalpy of formation of UTa3O10 can be explained by closely balanced structural stabilizing and destabilizing factors, which may also apply to other UM3O10 compounds. C1 [Guo, Xiaofeng; Xu, Hongwu] Los Alamos Natl Lab, Earth & Environm Sci Div, Los Alamos, NM 87545 USA. [Guo, Xiaofeng; Navrotsky, Alexandra] Univ Calif Davis, Peter A Rock Thermochem Lab, Davis, CA 95616 USA. [Guo, Xiaofeng; Navrotsky, Alexandra] Univ Calif Davis, NEAT ORU, Davis, CA 95616 USA. [Lipp, Christian; Burns, Peter C.] Univ Notre Dame, Dept Civil & Environm Engn & Earth Sci, 156 Fitzpatrick Hall, Notre Dame, IN 46556 USA. [Tiferet, Eitan] Nucl Res Ctr Negev, Israel Inst, IL-84190 Beer Sheva, Israel. [Lanzirotti, Antonio; Newville, Matthew; Sutton, Stephen R.] Univ Chicago, Ctr Adv Radiat Sources, Chicago, IL 60637 USA. [Engelhard, Mark H.] Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA 99354 USA. [Wu, Di] Washington State Univ, Gene & Linda Voiland Sch Chem Engn & Bioengn, Pullman, WA 99163 USA. [Ilton, Eugene S.] Pacific Northwest Natl Lab, Richland, WA 99352 USA. [Sutton, Stephen R.] Univ Chicago, Dept Geophys Sci, 5734 S Ellis Ave, Chicago, IL 60637 USA. [Burns, Peter C.] Univ Notre Dame, Dept Chem & Biochem, Notre Dame, IN 46556 USA. RP Navrotsky, A (reprint author), Univ Calif Davis, Peter A Rock Thermochem Lab, Davis, CA 95616 USA.; Navrotsky, A (reprint author), Univ Calif Davis, NEAT ORU, Davis, CA 95616 USA. EM anavrotsky@ucdavis.edu RI Wu, Di/A-3039-2014 OI Wu, Di/0000-0001-6879-321X FU Materials Science of Actinides, an Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DESC0001089]; Laboratory Directed Research and Development (LDRD) program, through the G. T. Seaborg Institute, of Los Alamos National Laboratory (LANL) [DE-AC52-06NA25396]; National Science Foundation - Earth Sciences [EAR-1128799]; Department of Energy - GeoSciences [DE-FG02-94ER14466]; DOE Office of Science [DE-AC02-06CH11357]; Office of Biological and Environmental Research; U.S. DOE [DE-AC06-76RLO1930] FX This paper is based on work supported as part of the Materials Science of Actinides, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences under Award Number DESC0001089. X. G was also supported by a Seaborg postdoctoral fellowship from the Laboratory Directed Research and Development (LDRD) program, through the G. T. Seaborg Institute, of Los Alamos National Laboratory (LANL), which is operated by Los Alamos National Security LLC, under DOE Contract DE-AC52-06NA25396. The XAS work was performed at GeoSoilEnviroCARS (The University of Chicago, Sector 13), Advanced Photon Source (APS), Argonne National Laboratory. GeoSoilEnviroCARS is supported by the National Science Foundation - Earth Sciences (EAR-1128799) and Department of Energy - GeoSciences (DE-FG02-94ER14466). This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract no. DE-AC02-06CH11357. The XPS analyses were performed using EMSL, a DOE Office of Science User Facility sponsored by the Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory. PNNL is operated by Battelle for the U.S. DOE under contract DE-AC06-76RLO1930. We thank Qi Liang and Mark Asta for their preliminary computational work, discussion. NR 58 TC 1 Z9 1 U1 13 U2 13 PU ROYAL SOC CHEMISTRY PI CAMBRIDGE PA THOMAS GRAHAM HOUSE, SCIENCE PARK, MILTON RD, CAMBRIDGE CB4 0WF, CAMBS, ENGLAND SN 1477-9226 EI 1477-9234 J9 DALTON T JI Dalton Trans. PD DEC 21 PY 2016 VL 45 IS 47 BP 18892 EP 18899 DI 10.1039/c6dt02843h PG 8 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EF1KE UT WOS:000390082900016 PM 27722670 ER PT J AU Zhou, YZ Yen, CH Hu, YH Wang, CM Cheng, XN Wai, CM Yang, J Lin, YH AF Zhou, Yazhou Yen, Clive H. Hu, Yun Hang Wang, Chongmin Cheng, Xiaonong Wai, Chien M. Yang, Juan Lin, Yuehe TI Making ultrafine and highly-dispersive multimetallic nanoparticles in three-dimensional graphene with supercritical fluid as excellent electrocatalyst for oxygen reduction reaction SO JOURNAL OF MATERIALS CHEMISTRY A LA English DT Article ID MEMBRANE FUEL-CELLS; 3D POROUS GRAPHENE; ONE-POT SYNTHESIS; CARBON NANOTUBES; HIGH-PERFORMANCE; BIMETALLIC NANOPARTICLES; METHANOL OXIDATION; SENSOR MATERIAL; OXIDE; CATALYST AB Three-dimensional (3D) graphene showed an advanced support for designing porous electrode materials due to its high specific surface area, large pore volume, and excellent electronic property. However, the electrochemical properties of reported porous electrode materials still need to be improved further. The current challenge is how to deposit desirable nanoparticles (NPs) with controllable structure, loading and composition in 3D graphene while maintaining the high dispersion. Herein, we demonstrate a modified supercritical fluid (SCF) technique to address this issue by controlling the SCF system. Using this superior method, a series of Pt-based/3D graphene materials with the ultrafine-sized, highly dispersive and controllable composition multimetallic NPs were successfully synthesized. Specifically, the resultant Pt40Fe60/3D graphene showed a significant enhancement in electrocatalytic performance for the oxygen reduction reaction (ORR), including a factor of 14.2 enhancement in mass activity (1.70 A mg(Pt)(-1)), a factor of 11.9 enhancement in specific activity (1.55 mA cm(-2)), and higher durability compared with that of Pt/C catalyst. After careful comparison, the Pt40Fe60/3D graphene catalyst shows the higher ORR activity than most of the reported similar 3D graphene-based catalysts. The successful synthesis of such attractive materials by this method also paves the way to develop 3D graphene in widespread applications. C1 [Zhou, Yazhou; Yang, Juan] Jiangsu Univ, Sch Mat Sci & Engn, Zhenjiang 212013, Peoples R China. [Lin, Yuehe] Washington State Univ, Sch Mech & Mat Engn, Pullman, WA 99164 USA. [Yen, Clive H.; Wai, Chien M.] Univ Idaho, Dept Chem, Moscow, ID 83844 USA. [Hu, Yun Hang] Michigan Technol Univ, Dept Mat Sci & Engn, Houghton, MI 49931 USA. [Wang, Chongmin] Pacific Northwest Natl Lab, Environm Mol Sci Lab, 902 Battelle Blvd, Richland, WA 99352 USA. RP Zhou, YZ; Yang, J (reprint author), Jiangsu Univ, Sch Mat Sci & Engn, Zhenjiang 212013, Peoples R China.; Lin, YH (reprint author), Washington State Univ, Sch Mech & Mat Engn, Pullman, WA 99164 USA. EM zhouyazhou60@gmail.com; yangjuan6347@mail.ujs.edu.cn; yuehe.lin@wsu.edu FU National Natural Science Foundation of China [51572114]; Laboratory Directed Research and Development Program as part of the Chemical Imaging Initiative at PNNL; DOE's Office of Biological and Environmental Research; DOE [DE-AC05-76RLO1830] FX We gratefully acknowledge the financial support from the National Natural Science Foundation of China (51572114). We are very grateful for the support from D. Du and C. Zhu (Washington State University, USA). We also thank Y. He for STEM measurements (Pacific Northwest National Laboratory, PNNL, USA). The microscopic study described in this study is supported by the Laboratory Directed Research and Development Program as part of the Chemical Imaging Initiative at PNNL. The work was conducted in the William R. Wiley Environmental Molecular Sciences Laboratory (EMSL), a national scientific user facility sponsored by DOE's Office of Biological and Environmental Research and located at PNNL. PNNL is operated by Battelle for the DOE under Contract DE-AC05-76RLO1830. We also thank the Franceschi Microscopy & Image Center at Washington State University for TEM measurements. NR 59 TC 1 Z9 1 U1 27 U2 27 PU ROYAL SOC CHEMISTRY PI CAMBRIDGE PA THOMAS GRAHAM HOUSE, SCIENCE PARK, MILTON RD, CAMBRIDGE CB4 0WF, CAMBS, ENGLAND SN 2050-7488 EI 2050-7496 J9 J MATER CHEM A JI J. Mater. Chem. A PD DEC 21 PY 2016 VL 4 IS 47 BP 18628 EP 18638 DI 10.1039/c6ta08508c PG 11 WC Chemistry, Physical; Energy & Fuels; Materials Science, Multidisciplinary SC Chemistry; Energy & Fuels; Materials Science GA EF1KH UT WOS:000390083200049 ER PT J AU Simmons, TJ Mortimer, JC Bernardinelli, OD Poppler, AC Brown, SP Deazevedo, ER Dupree, R Dupree, P AF Simmons, Thomas J. Mortimer, Jenny C. Bernardinelli, Oigres D. Poppler, Ann-Christin Brown, Steven P. deazevedo, Eduardo R. Dupree, Ray Dupree, Paul TI Folding of xylan onto cellulose fibrils in plant cell walls revealed by solid-state NMR SO NATURE COMMUNICATIONS LA English DT Article ID NUCLEAR-MAGNETIC-RESONANCE; CARBON-CARBON CONNECTIVITIES; NEUTRON FIBER DIFFRACTION; HYDROGEN-BONDING SYSTEM; ANGLE-SPINNING NMR; SYNCHROTRON X-RAY; ARABIDOPSIS-THALIANA; MOLECULAR ARCHITECTURE; CRYSTAL-STRUCTURE; C-13 NMR AB Exploitation of plant lignocellulosic biomass is hampered by our ignorance of the molecular basis for its properties such as strength and digestibility. Xylan, the most prevalent non-cellulosic polysaccharide, binds to cellulose microfibrils. The nature of this interaction remains unclear, despite its importance. Here we show that the majority of xylan, which forms a threefold helical screw in solution, flattens into a twofold helical screw ribbon to bind intimately to cellulose microfibrils in the cell wall. C-13 solid-state magic-angle spinning (MAS) nuclear magnetic resonance (NMR) spectroscopy, supported by in silico predictions of chemical shifts, shows both two-and threefold screw xylan conformations are present in fresh Arabidopsis stems. The twofold screw xylan is spatially close to cellulose, and has similar rigidity to the cellulose microfibrils, but reverts to the threefold screw conformation in the cellulose-deficient irx3 mutant. The discovery that induced polysaccharide conformation underlies cell wall assembly provides new principles to understand biomass properties. C1 [Simmons, Thomas J.; Mortimer, Jenny C.; Bernardinelli, Oigres D.; Dupree, Paul] Univ Cambridge, Dept Biochem, Hopkins Bldg,Downing Site, Cambridge CB2 1QW, England. [Simmons, Thomas J.; Mortimer, Jenny C.; Bernardinelli, Oigres D.; Dupree, Paul] Univ Cambridge, Leverhulme Ctr Nat Mat Innovat, Hopkins Bldg,Downing Site, Cambridge CB2 1QW, England. [Bernardinelli, Oigres D.; deazevedo, Eduardo R.] Univ Sao Paulo, Inst Fis Sao Carlos, Dept Fis & Ciencia Interdisciplinar, Caixa Postal 369, BR-13660970 Sao Paulo, Brazil. [Bernardinelli, Oigres D.; Poppler, Ann-Christin; Brown, Steven P.; Dupree, Ray] Univ Warwick, Dept Phys, Coventry CV4 7AL, W Midlands, England. [Mortimer, Jenny C.] Lawrence Berkeley Natl Lab, Joint Bioenergy Inst, Berkeley, CA 94720 USA. [Bernardinelli, Oigres D.] Univ Estadual Campinas, Inst Quim, Caixa Postal 6154, BR-13084862 Campinas, SP, Brazil. RP Dupree, P (reprint author), Univ Cambridge, Dept Biochem, Hopkins Bldg,Downing Site, Cambridge CB2 1QW, England.; Dupree, P (reprint author), Univ Cambridge, Leverhulme Ctr Nat Mat Innovat, Hopkins Bldg,Downing Site, Cambridge CB2 1QW, England.; Dupree, R (reprint author), Univ Warwick, Dept Phys, Coventry CV4 7AL, W Midlands, England. EM ray.dupree@warwick.ac.uk; pd101@cam.ac.uk RI Sao Carlos Institute of Physics, IFSC/USP/M-2664-2016; OI Dupree, Paul/0000-0001-9270-6286; Poppler, Ann-Christin/0000-0002-0624-1708 FU BBSRC Grant via BBSRC Sustainable Bioenergy Cell Wall Sugars Programme [BB/G016240/1]; CNPq [159341/2011-6, 206278/2014-4]; Royal Society; Leverhulme Trust grant for the Centre for Natural Material Innovation; EPSRC; BBSRC; University of Warwick; Birmingham Science City Advanced Materials Projects; Advantage West Midlands (AWM); European Regional Development Fund (ERDF) FX We thank Dinu Iuga, Shazeaa Ishmael, Howard Griffiths and Moritz Meyer for their help. This work was part supported by BBSRC Grant BB/G016240/1 via The BBSRC Sustainable Bioenergy Cell Wall Sugars Programme. ODB and ERdA are grateful to CNPq for financial support for this work via Grants # 159341/2011-6 and 206278/2014-4. ACP is grateful to the Royal Society for a Newton International Fellowship. PD is supported by the Leverhulme Trust grant for the Centre for Natural Material Innovation. The UK 850 MHz solid-state NMR Facility used in this research was funded by EPSRC and BBSRC, as well as the University of Warwick including via part funding through Birmingham Science City Advanced Materials Projects 1 and 2 supported by Advantage West Midlands (AWM) and the European Regional Development Fund (ERDF). (Contract reference PR140003 for work after 5 January 2015). DFT calculations of NMR parameters were performed at the Centre for Scientific Computing at the University of Warwick. NR 50 TC 0 Z9 0 U1 26 U2 26 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 21 PY 2016 VL 7 AR 13902 DI 10.1038/ncomms13902 PG 9 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF3JL UT WOS:000390220600001 PM 28000667 ER PT J AU Altmeyer, M Guterding, D Hirschfeld, PJ Maier, TA Valenti, R Scalapino, DJ AF Altmeyer, Michaela Guterding, Daniel Hirschfeld, P. J. Maier, Thomas A. Valenti, Roser Scalapino, Douglas J. TI Role of vertex corrections in the matrix formulation of the random phase approximation for the multiorbital Hubbard model SO PHYSICAL REVIEW B LA English DT Article ID IRON-BASED SUPERCONDUCTORS; CUPRATE SUPERCONDUCTORS; PAIRING MECHANISM; BAND-STRUCTURE; SYMMETRY AB In the framework of a multiorbital Hubbard model description of superconductivity, a matrix formulation of the superconducting pairing interaction that has been widely used is designed to treat spin, charge, and orbital fluctuations within a random phase approximation (RPA). In terms of Feynman diagrams, this takes into account particle-hole ladder and bubble contributions as expected. It turns out, however, that this matrix formulation also generates additional terms which have the diagrammatic structure of vertex corrections. Here we examine these terms and discuss the relationship between the matrix-RPA superconducting pairing interaction and the Feynman diagrams that it sums. C1 [Altmeyer, Michaela; Guterding, Daniel; Valenti, Roser] Goethe Univ Frankfurt, Inst Theoret Phys, Max von Laue Str 1, D-60438 Frankfurt, Germany. [Hirschfeld, P. J.] Univ Florida, Dept Phys, Gainesville, FL 32611 USA. [Maier, Thomas A.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Maier, Thomas A.] Oak Ridge Natl Lab, Div Math & Comp Sci, Oak Ridge, TN 37831 USA. [Scalapino, Douglas J.] Univ Calif Santa Barbara, Dept Phys, Santa Barbara, CA 93106 USA. RP Altmeyer, M (reprint author), Goethe Univ Frankfurt, Inst Theoret Phys, Max von Laue Str 1, D-60438 Frankfurt, Germany. OI Guterding, Daniel/0000-0003-3958-8801 FU German Research Foundation (Deutsche Forschungsgemeinschaft) [SFB/TR49, SPP1458]; Department of Energy [DE-FG02-05ER46236]; Center for Nanophase Materials Science at ORNL; Division of Scientific User Facilities, U.S. DOE; Kavli Institute for Theoretical Physics at the University of California, Santa Barbara [NSF PHY-1125915] FX We would like to thank K. Zantout, A. Romer, Y. Wang, P. Lange, P. Kopietz, and C. Gros for useful discussions. M.A., D.G., and R.V. thank the German Research Foundation (Deutsche Forschungsgemeinschaft) for support through Grants No. SFB/TR49 and No. SPP1458. P.J.H. acknowledges support through Department of Energy Grant No. DE-FG02-05ER46236. T.A.M. and D.J.S. acknowledge support through the Center for Nanophase Materials Science at ORNL, which is sponsored by the Division of Scientific User Facilities, U.S. DOE. M.A. and R.V. further acknowledge partial support by the Kavli Institute for Theoretical Physics at the University of California, Santa Barbara, under Grant No. NSF PHY-1125915. NR 35 TC 0 Z9 0 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 21 PY 2016 VL 94 IS 21 AR 214515 DI 10.1103/PhysRevB.94.214515 PG 5 WC Physics, Condensed Matter SC Physics GA EF3TS UT WOS:000390247900006 ER PT J AU Kamano, H Lee, TSH AF Kamano, H. Lee, T. -S. H. TI Toward establishing low-lying Lambda and Sigma hyperon resonances with the (K)over-bar + d -> pi plus Y plus N reaction SO PHYSICAL REVIEW C LA English DT Article AB Amodel for the (K) over bard -> pi YN reactions with Y = Lambda, Sigma is developed, aiming at establishing the low-lying Lambda and Sigma hyperon resonances through analyzing the forthcoming data from the J-PARC E31 experiment. The off-shell amplitudes generated from the dynamical coupled-channels (DCC) model, which was developed in Kamano et al. [ Phys. Rev. C 90, 065204 (2014)], are used as input to the calculations of the elementary (K) over barN -> (K) over bar N and (K) over bar N -> pi Y subprocesses in the (K) over bard -> pi YN reactions. It is shown that the cross sections for the J-PARC E31 experiment with a rather high incoming-(K) over bar momentum, vertical bar(p) over bar (K)vertical bar = 1 GeV, can be predicted reliably only when the input (K) over bar N -> (K) over bar N amplitudes are generated from a (K) over bar N model, such as the DCC model used in this investigation, which describes the data of the (K) over bar N reactions at energies far beyond the (K) over bar N threshold. We find that the data of the threefold differential cross section d sigma/(dM(pi Sigma)d Omega(pn)) for the K(-)d -> pi Sigma n reaction below the (K) over bar N threshold can be used to test the predictions of the resonance poles associated with Lambda (1405). We also find that the momentum dependence of the threefold differential cross sections for the K(-)d -> pi(-)Lambda p reaction can be used to examine the existence of a low-lying J(P) = 1/2(+) Sigma resonance with a pole mass M-R = 1457-i39 MeV, which was found from analyzing the K(-)p reaction data within the employed DCC model. C1 [Kamano, H.] KEK, High Energy Accelerator Res Org, IPNS, KEK Theory Ctr, Tsukuba, Ibaraki 3050801, Japan. [Kamano, H.] KEK, IPNS, KEK Theory Ctr, J PARC Branch, Tokai, Ibaraki 3191106, Japan. [Lee, T. -S. H.] Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. RP Kamano, H (reprint author), KEK, High Energy Accelerator Res Org, IPNS, KEK Theory Ctr, Tsukuba, Ibaraki 3050801, Japan.; Kamano, H (reprint author), KEK, IPNS, KEK Theory Ctr, J PARC Branch, Tokai, Ibaraki 3191106, Japan. FU Japan Society for the Promotion of Science (JSPS) KAKENHI Grant [JP25800149]; U.S. Department of Energy, Office of Nuclear Physics Division [DE-AC02-06CH11357] FX The authors would like to thank Dr. S. Ohnishi for illuminating discussions on his recent studies of K- d -> pi Sigma n. H.K. would also like to thank Professor H. Noumi for useful communications on the status of the J-PARC E31 experiment. This work was supported by Japan Society for the Promotion of Science (JSPS) KAKENHI Grant No. JP25800149 and by the U.S. Department of Energy, Office of Nuclear Physics Division, under Contract No. DE-AC02-06CH11357. This research used resources of the National Energy Research Scientific Computing Center and resources provided on Blues and Fusion, high-performance computing cluster operated by the Laboratory Computing Resource Center at Argonne National Laboratory. NR 43 TC 0 Z9 0 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 21 PY 2016 VL 94 IS 6 AR 065205 DI 10.1103/PhysRevC.94.065205 PG 13 WC Physics, Nuclear SC Physics GA EF3ZS UT WOS:000390264600002 ER PT J AU Tiator, L Doring, M Workman, RL Hadzimehmedovic, M Osmanovic, H Omerovic, R Stahov, J Svarc, A AF Tiator, L. Doring, M. Workman, R. L. Hadzimehmedovic, M. Osmanovic, H. Omerovic, R. Stahov, J. Svarc, A. TI Baryon transition form factors at the pole SO PHYSICAL REVIEW C LA English DT Article ID ELECTROMAGNETIC-EXCITATION; DELTA(1232) RESONANCE; SCATTERING-AMPLITUDE; DELTA TRANSITION; ELECTROPRODUCTION; NUCLEON; PION; PHOTOPRODUCTION; ISOBAR; MODEL AB Electromagnetic resonance properties are uniquely defined at the pole and do not depend on the separation of the resonance from background or the decay channel. Photon-nucleon branching ratios are nowadays often quoted at the pole, and we generalize the considerations to the case of virtual photons. We derive and compare relations for nucleon to baryon transition form factors both for the Breit-Wigner and the pole positions. Using the MAID2007 and SAID SM08 partial wave analyses of pion electroproduction data, we compare the G(M), G(E), and G(C) form factors for the Delta(1232) resonance excitation at the Breit-Wigner resonance and pole positions up to Q(2) = 5 GeV2. We also explore the E/M and S/M ratios as functions of Q(2). For pole and residue extraction, we apply the Laurent + Pietarinen method. C1 [Tiator, L.] Johannes Gutenberg Univ Mainz, Inst Kernphys, D-55099 Mainz, Germany. [Doring, M.; Workman, R. L.] George Washington Univ, Washington, DC 20052 USA. [Doring, M.] Thomas Jefferson Natl Accelerator Facil, Newport News, VA 23606 USA. [Hadzimehmedovic, M.; Osmanovic, H.; Omerovic, R.; Stahov, J.] Univ Tuzla, Fac Nat Sci & Math, Univ Ska 4, Tuzla 75000, Bosnia & Herceg. [Svarc, A.] Rudjer Boskovic Inst, Bijenicka Cesta 54,POB 180, Zagreb 10002, Croatia. RP Tiator, L (reprint author), Johannes Gutenberg Univ Mainz, Inst Kernphys, D-55099 Mainz, Germany. FU US Department of Energy Grant [DE-SC0014133]; Deutsche Forschungsgemeinschaft [SFB 1044]; RFBR [13-02-00425]; National Science Foundation (CAREER) [PHY-1452055]; National Science Foundation (PIF) [1415459]; US Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC05-06OR23177] FX This work was supported in part by US Department of Energy Grant No. DE-SC0014133, by the Deutsche Forschungsgemeinschaft (SFB 1044), and by RFBR Grant No. 13-02-00425. M.D. is supported by the National Science Foundation (CAREER Grant No. PHY-1452055 and PIF Grant No. 1415459) and by the US Department of Energy, Office of Science, Office of Nuclear Physics under Contract No. DE-AC05-06OR23177. NR 69 TC 0 Z9 0 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 21 PY 2016 VL 94 IS 6 AR 065204 DI 10.1103/PhysRevC.94.065204 PG 9 WC Physics, Nuclear SC Physics GA EF3ZS UT WOS:000390264600001 ER PT J AU Kang, ZB Wang, EK Wang, XN Xing, HX AF Kang, Zhong-Bo Wang, Enke Wang, Xin-Nian Xing, Hongxi TI Transverse momentum broadening in semi-inclusive deep inelastic scattering at next-to-leading order SO PHYSICAL REVIEW D LA English DT Article ID MULTIPLE PARTON SCATTERING; MODIFIED FRAGMENTATION FUNCTIONS; RADIATIVE ENERGY-LOSS; DRELL-YAN PROCESS; NUCLEAR MODIFICATION; P PLUS; COLLISIONS; QCD; LHC; BREMSSTRAHLUNG AB Within the framework of higher-twist collinear factorization, transverse momentum broadening for the final hadrons in semi-inclusive deeply inelastic e + A collisions is studied at the next-to-leading order (NLO) in perturbative QCD. Through explicit calculations of real and virtual corrections at twist 4, the transverse-momentum-weighted differential cross section due to double scattering is shown to factorize at NLO and can be expressed as a convolution of twist-4 nuclear parton correlation functions, the usual twist2 fragmentation functions and hard parts which are finite and free of any divergences. A QCD evolution equation is also derived for the renormalized twist-4 quark-gluon correlation function which can be applied to future phenomenological studies of transverse momentum broadening and jet quenching at NLO. C1 [Kang, Zhong-Bo; Xing, Hongxi] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. [Wang, Enke; Wang, Xin-Nian] Cent China Normal Univ, Inst Particle Phys, Wuhan 430079, Peoples R China. [Wang, Enke; Wang, Xin-Nian] Cent China Normal Univ, Key Lab Lepton & Quark Phys MOE, Wuhan 430079, Peoples R China. [Wang, Xin-Nian] Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA 94720 USA. [Xing, Hongxi] Argonne Natl Lab, Div High Energy Phys, Argonne, IL 60439 USA. [Xing, Hongxi] Northwestern Univ, Dept Phys & Astron, Evanston, IL 60208 USA. [Kang, Zhong-Bo] Univ Calif Los Angeles, Dept Phys & Astron, Los Angeles, CA 90095 USA. RP Kang, ZB (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA.; Kang, ZB (reprint author), Univ Calif Los Angeles, Dept Phys & Astron, Los Angeles, CA 90095 USA. EM zkang@lanl.gov; wangek@mail.ccnu.edu.cn; xnwang@lbl.gov; hxing@northwestern.edu RI Kang, Zhongbo/P-3645-2014 FU U.S. Department of Energy, Office of Science, Office of High Energy and Nuclear Physics, Division of Nuclear Physics [DE-AC52-06NA25396, DE-AC02-05CH11231]; JET Collaboration; National Science Foundation of China [11221504, 10825523]; China Ministry of Science and Technology [2014DFG02050]; Major State Basic Research Development Program in China [2014CB845404] FX This work is supported by the U.S. Department of Energy, Office of Science, Office of High Energy and Nuclear Physics, Division of Nuclear Physics, under Contract No. DE-AC52-06NA25396 and No. DE-AC02-05CH11231, and within the framework of the JET Collaboration, the National Science Foundation of China under Grants No. 11221504 and No. 10825523, China Ministry of Science and Technology under Grant No. 2014DFG02050, and the Major State Basic Research Development Program in China (No. 2014CB845404). NR 88 TC 0 Z9 0 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 21 PY 2016 VL 94 IS 11 AR 114024 DI 10.1103/PhysRevD.94.114024 PG 20 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF4BJ UT WOS:000390269200005 ER PT J AU Zhang, M Biswas, S Deng, WB Yu, HJ AF Zhang, Min Biswas, Sangita Deng, Wenbin Yu, Hongjun TI The Crystal Structure of Monovalent Streptavidin SO SCIENTIFIC REPORTS LA English DT Article ID CORE STREPTAVIDIN; BINDING; IMMUNOGENICITY; SYSTEM; MODEL AB The strong interaction between streptavidin (SA) and biotin is widely utilized in biotechnological applications. A SA variant, monovalent SA, was developed with a single and high affinity biotin-binding site within the intact tetramer. However, its structural characterization remains undetermined. Here, we seek to determine the crystal structure of monovalent SA at 1.7-angstrom resolution . We show that, in contrast to its 'close-state' in the only wild-type subunit, the L3,4 loops of three Dead SA subunits are free from crystal packing and remain in an 'open state', stabilized by a consistent H-bonding network involving S52. This H-bonding network also applies to the previously reported open state of the wildtype apo-SA. These results suggest that specific substitutions (N23A/S27D/S45A) at biotin-binding sites stabilize the open state of SA L3,4 loop, thereby further reducing biotin-binding affinity. The general features of the 'open state' SA among different SA variants may facilitate its rational design. The structural information of monovalent SA will be valuable for its applications across a wide range of biotechnological areas. C1 [Zhang, Min] Hubei Univ Arts & Sci, Coll Med, Xiangyang, Hubei, Peoples R China. [Zhang, Min; Biswas, Sangita; Deng, Wenbin] Univ Calif Davis, Sch Med, Dept Biochem & Mol Med, Davis, CA 95616 USA. [Yu, Hongjun] Brookhaven Natl Lab, Dept Biol, Upton, NY 11973 USA. RP Deng, WB (reprint author), Univ Calif Davis, Sch Med, Dept Biochem & Mol Med, Davis, CA 95616 USA.; Yu, HJ (reprint author), Brookhaven Natl Lab, Dept Biol, Upton, NY 11973 USA. EM wbdeng@ucdavis.edu; yuhongjun05@gmail.com FU Foundation of Hubei Provincial Department of education, China [B2016168]; Doctoral Research Fund of Hubei University of Arts and Science; Project for Discipline Groups Construction of Food New-type Industrialization of Hubei University of Arts and Science; National Institutes of Health [R01NS061983, R01HD087566]; National Multiple Sclerosis Society; Shriners Hospitals for Children FX This research was supported by the Foundation of Hubei Provincial Department of education, China (B2016168), the Doctoral Research Fund of Hubei University of Arts and Science, and the Project for Discipline Groups Construction of Food New-type Industrialization of Hubei University of Arts and Science. W.D. was supported by grants from National Institutes of Health (R01NS061983 and R01HD087566), the National Multiple Sclerosis Society, and Shriners Hospitals for Children. NR 23 TC 0 Z9 0 U1 1 U2 1 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 21 PY 2016 VL 6 AR 35915 DI 10.1038/srep35915 PG 7 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF3CB UT WOS:000390201000001 PM 28000673 ER PT J AU Barkholtz, HM Chong, L Kaiser, ZB Xu, T Liu, DJ AF Barkholtz, Heather M. Chong, Lina Kaiser, Zachary B. Xu, Tao Liu, Di-Jia TI Enhanced performance of non-PGM catalysts in air operated PEM-fuel cells SO INTERNATIONAL JOURNAL OF HYDROGEN ENERGY LA English DT Article; Proceedings Paper CT Conference on Electrolysis and Fuel Cell Discussions (EFCD) - Challenges Towards Zero Platinum for Oxygen Reduction CY SEP 13-16, 2015 CL La Grande Motte, FRANCE DE Oxygen reduction reaction; Fuel cell; Non-platinum group metal; MOF; Fe-N-C catalyst ID OXYGEN REDUCTION REACTION; ZEOLITIC IMIDAZOLATE FRAMEWORK; METAL-ORGANIC FRAMEWORKS; GAS-DIFFUSION ELECTRODES; NITROGEN-DOPED CARBON; NAFION CONTENT; LAYER; ELECTROCATALYSTS; IRON; OPTIMIZATION AB A non-platinum group metal (non-PGM) oxygen reduction catalyst was prepared from "support-free" zeolitic imidazolate framework (ZIF) precursor and tested in the proton exchange membrane fuel cell with air as the cathode feed. The iron nitrogen and carbon composite (Fe-N-C) based catalyst has high specific surface area decorated uniformly with active sites, which redefines the triple phase boundary (TPB) and requires re-optimization of the cathodic membrane electrode fabrication to ensure efficient mass and charge transports to the catalyst surface. This study reports an effort in optimizing catalytic ink formulation for the membrane electrode preparation and its impact to the fuel cell performance under air. Through optimization, the fuel cell areal current density as high as 115.2 mA/cm(2) at 0.8 V or 147.6 mA/cm(2) at 0.8 ViR-free has been achieved under one bar air. Impacts on fuel cell internal impedance and the water formation are also investigated. (C) 2016 Hydrogen Energy Publications LLC. Published by Elsevier Ltd. All rights reserved. C1 [Barkholtz, Heather M.; Chong, Lina; Kaiser, Zachary B.; Liu, Di-Jia] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Lemont, IL 60439 USA. [Barkholtz, Heather M.; Xu, Tao] Northern Illinois Univ, Dept Chem & Biochem, 1425 W Lincoln Hwy, De Kalb, IL 60115 USA. RP Liu, DJ (reprint author), Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Lemont, IL 60439 USA. EM djliu@anl.gov NR 35 TC 0 Z9 0 U1 28 U2 28 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0360-3199 EI 1879-3487 J9 INT J HYDROGEN ENERG JI Int. J. Hydrog. Energy PD DEC 21 PY 2016 VL 41 IS 47 BP 22598 EP 22604 DI 10.1016/j.ijhydene.2016.08.193 PG 7 WC Chemistry, Physical; Electrochemistry; Energy & Fuels SC Chemistry; Electrochemistry; Energy & Fuels GA EE7HM UT WOS:000389786500073 ER PT J AU Vinitsky, EA Muramatsu, T Somayazulu, M Wanene, WK Liu, ZX Chandra, D Hemley, RJ AF Vinitsky, Eugene A. Muramatsu, Takaki Somayazulu, Maddury Wanene, Wilson K. Liu, Zhenxian Chandra, Dhanesh Hemley, Russell J. TI Structural, vibrational, and electronic properties of BaReH9 under pressure SO JOURNAL OF PHYSICS-CONDENSED MATTER LA English DT Article DE hydride superconductors; hydrogen-rich compounds; pressure-induced disorder ID METALLIC HYDROGEN; SUPERCONDUCTIVITY; DIFFRACTION; CALIBRATION AB We present a study of the high-pressure behavior of BaReH9, a novel hydrogen-rich compound, using optical, Raman, and infrared spectroscopy as well as synchrotron x-ray diffraction. The x-ray diffraction measurements demonstrate that BaReH9 retains its hexagonal structure on room temperature compression up to 40 GPa. Optical absorption shows the absence of a gap closure to 80 GPa. Raman and IR spectra reveal the pressure evolution of a newly observed phonon peak, and large peak broadening with increasing pressure. These data constrain the disorder present in the material following the P-T paths explored. C1 [Vinitsky, Eugene A.; Muramatsu, Takaki; Somayazulu, Maddury; Liu, Zhenxian] Carnegie Inst Sci, Geophys Lab, Washington, DC 20015 USA. [Wanene, Wilson K.; Chandra, Dhanesh] Univ Nevada, Dept Chem & Mat Engn, Reno, NV 89557 USA. [Hemley, Russell J.] George Washington Univ, Dept Civil & Environm Engn, Washington, DC 20052 USA. [Hemley, Russell J.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. RP Hemley, RJ (reprint author), Carnegie Inst Sci, Geophys Lab, Washington, DC 20015 USA. EM rhemley@gwu.edu FU EFree, an Energy Frontier Research Center - U.S. Department of Energy (DOE) Office of Science, Basic Energy Sciences (BES) [DESC0001057]; DOE-BES [DEFG02-06ER46280, DE-FG02-99ER45775]; DOE-NNSA [DE-NA-0002006, DE-NA0001974]; NSF; Argonne National Laboratory [DE-AC02-06CH11357]; U.S. DOE [DE-AC52-07NA27344]; COMPRES; Consortium for Materials Properties Research in Earth Sciences, under NSF [EAR01-35554]; US. DOE/NNSA (CDAC) FX This research was supported by EFree, an Energy Frontier Research Center funded by the U.S. Department of Energy (DOE) Office of Science, Basic Energy Sciences (BES), under Award DESC0001057. The synthesis of BaReH9 was undertaken as part of the research funded by DOE-BES (DEFG02-06ER46280). The infrastructure and facilities used are supported by the DOE-NNSA (DE-NA-0002006, CDAC). Portions of this work were performed at HPCAT (Sector 16), Advanced Photon Source (APS), Argonne National Laboratory. HPCAT operations are supported by DOE-NNSA under Award DE-NA0001974 and by DOE-BES under Award DE-FG02-99ER45775, with partial instrumentation funding by the NSF. The Advanced Photon Source is a DOE, Office of Science User Facility operated by Argonne National Laboratory under Contract DE-AC02-06CH11357. Work at LLNL was performed under the auspices of the U.S. DOE under Contract No. DE-AC52-07NA27344. The U2A beamline was supported by COMPRES, the Consortium for Materials Properties Research in Earth Sciences, under NSF Cooperative Agreement Grant No. EAR01-35554 and the US. DOE/NNSA (CDAC). NR 22 TC 0 Z9 0 U1 13 U2 13 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0953-8984 EI 1361-648X J9 J PHYS-CONDENS MAT JI J. Phys.-Condes. Matter PD DEC 21 PY 2016 VL 28 IS 50 AR 505701 DI 10.1088/0953-8984/28/50/505701 PG 7 WC Physics, Condensed Matter SC Physics GA EB4JS UT WOS:000387338200001 PM 27792668 ER PT J AU Pandey, TP Seifert, S Yang, Y Yang, Y Knauss, DM Liberatore, MW Herring, AM AF Pandey, Tara P. Seifert, Soenke Yang, Yating Yang, Yuan Knauss, Daniel M. Liberatore, Matthew W. Herring, Andrew M. TI Novel Processing of a Poly(phenyleneoxide) -b-Poly (vinylbenzyltrimethylammonium) Copolymer Anion Exchange Membrane; The Effect On Mechanical And Transport Properties SO ELECTROCHIMICA ACTA LA English DT Article DE Fuel cells; Anion exchange membranes; alkaline conductivity; poly(2,6 dimethyl 1,4-phenylene oxide); benzyl trimethyl ammonim cations ID ELECTROLYTE FUEL-CELLS; WATER-UPTAKE; QUATERNARY AMMONIUM; ALKALINE STABILITY; HYDROXIDE; PERFORMANCE; IONOMER; CONDUCTIVITY; BENZYLTRIMETHYLAMMONIUM; DEGRADATION AB A poly(2,6 dimethyl 1,4-phenylene oxide)-b-poly(vinyl benzyl) chloride copolymer membranes was processed by solvent casting followed by melt pressing (SCMP) to provide uniformly thin films, 25 +/- 5 mu m, with improved conductivity, mechanical strength, water uptake, dimensional swelling, and chemical stability under 1 M KOH and 80 degrees C. These properties depended strongly on the length of the melt-pressing time. The solvent cast membranes melt pressing time was optimized to provided highly conductive membranes (high OH- conductivity of 75 +/- 25 mS cm(-1) for an IEC of 1.8 mmol g(-1) at room temperature in water). Membranes that were only solvent cast and not melt-pressed swelled excessively and had insufficient mechanical integrity for detailed study. When the copolymer powder was melt pressed (without prior solvent casting) at 240 degrees C and ca. 30 MPa for 20 minutes, membranes with high mechanical strength (tensile stress at break of 32 +/- 6 MPa at 25% RH and 29 +/- 3 MPa when 95% RH at 60 degrees C), high conductivity (Cl conductivity of 80 mS/cm at 90 degrees C and 95% RH), and lower water uptake were formed. However, melt pressing alone did not give larger then 5 cm x 5 cm area films, homogeneously thin (< 60 mu m), or mechanical defect-free membranes. The SCMP membranes were uniformly thin, and thermally crosslinked. The mass loss via dehydrochlorination indicated by TGA and elemental analysis confirmed the crosslinking via thermal melt pressing. The SCMP membranes thickness could be reduced by more than 50% (25 +/- 5 mu m) compared to melt pressing alone, and the Cl conductivity increased by 44% at 90 degrees C and 95% RH. The tensile stress at break of the SCMP membranes, however, was reduced by 50% at 25% RH. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Pandey, Tara P.; Herring, Andrew M.] Colorado Sch Mines, Dept Chem & Biol Engn, 1500 Illinois St, Golden, CO 80401 USA. [Seifert, Soenke] Argonne Natl Lab, Xray Sci Div Adv Photon Source, 9700 South Cass Ave, Argonne, IL 60439 USA. [Yang, Yating; Yang, Yuan; Knauss, Daniel M.] Colorado Sch Mines, Dept Chem & Geochem, 1500 Illinois St, Golden, CO 80401 USA. [Liberatore, Matthew W.] Univ Toledo, Dept Chem & Environm Engn, 1801 W Banscroft St MS305, Toledo, OH 43606 USA. RP Herring, AM (reprint author), Colorado Sch Mines, Dept Chem & Biol Engn, 1500 Illinois St, Golden, CO 80401 USA.; Liberatore, MW (reprint author), Univ Toledo, Dept Chem & Environm Engn, 1801 W Banscroft St MS305, Toledo, OH 43606 USA. EM Matthew.Liberatore@utoledo.edu; aherring@mines.edu FU Army Research Office (MURI) [W911NF-11-1-0462]; Army Research Office (DURIP) [W911NF-11-1-0306 ARES, W911NF-11-1-0462 FTIR]; National Science Foundation under an MRI grant [CHE-0923537]; DOE Office of Science by Argonne National Laboratory [DE-AC02-06CH11357] FX The authors would like to thank the Army Research Office for support of this research under the (MURI Grant No. W911NF-11-1-0462, DURIP Grant No. W911NF-11-1-0306 ARES, and DURIP Grant No. W911NF-11-1-0462 FTIR Microscope) and The Colorado School of Mines NMR facility funded by National Science Foundation under an MRI grant CHE-0923537. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. NR 52 TC 0 Z9 0 U1 5 U2 5 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0013-4686 EI 1873-3859 J9 ELECTROCHIM ACTA JI Electrochim. Acta PD DEC 20 PY 2016 VL 222 BP 1545 EP 1554 DI 10.1016/j.electacta.2016.11.137 PG 10 WC Electrochemistry SC Electrochemistry GA EM6SZ UT WOS:000395443700067 ER PT J AU Moore, CM Jenkins, RW Janicke, MT Kubic, WL Polikarpov, E Semelsberger, TA Sutton, AD AF Moore, Cameron M. Jenkins, Rhodri W. Janicke, Michael T. Kubic, William L., Jr. Polikarpov, Evgueni Semelsberger, Troy A. Sutton, Andrew D. TI Synthesis of Acetone-Derived C-6, C-9, and C-12 Carbon Scaffolds for Chemical and Fuel Applications SO CHEMSUSCHEM LA English DT Article DE biofuels; bioproducts; catalysis; condensation; hydrodeoxygenation ID OXYGENATED HYDROCARBONS; TRANSPORTATION FUELS; METHYL KETONES; BIOMASS; CONDENSATION; HYDRODEOXYGENATION; FERMENTATION; CONVERSION; CATALYSTS; ALKANES AB A simple, inexpensive catalyst system (Amberlyst 15 and Ni/SiO2-Al2O3) is described for the upgrading of acetone to a range of chemicals and potential fuels. Stepwise hydrodeoxygenation of the produced ketones can yield branched alcohols, alkenes, and alkanes. An analysis of these products is provided, which demonstrates that this approach can provide a product profile of valuable bioproducts and potential biofuels. C1 [Moore, Cameron M.; Jenkins, Rhodri W.; Janicke, Michael T.; Sutton, Andrew D.] Los Alamos Natl Lab, Div Chem, MS K558, Los Alamos, NM 87544 USA. [Kubic, William L., Jr.] Los Alamos Natl Lab, Appl Engn & Technol Div, MS E548, Los Alamos, NM 87544 USA. [Polikarpov, Evgueni] Pacific Northwest Natl Lab, Appl Mat & Performance, Richland, WA 99352 USA. [Semelsberger, Troy A.] Los Alamos Natl Lab, Mat Phys Applicat Div, MS K793, Los Alamos, NM 87544 USA. RP Sutton, AD (reprint author), Los Alamos Natl Lab, Div Chem, MS K558, Los Alamos, NM 87544 USA. EM adsutton@lanl.gov OI Sutton, Andrew/0000-0001-7984-1715 FU Los Alamos National Laboratory LDRD program [LDRD20160095ER]; Office of Energy Efficiency & Renewable Energy (EERE) Bioenergy Technology Office (BETO); LANL LDRD program for a Director's Postdoctoral Fellowship; Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy [DE-AC5206A25396] FX We thank the Los Alamos National Laboratory LDRD program (LDRD20160095ER) and the Office of Energy Efficiency & Renewable Energy (EERE) Bioenergy Technology Office (BETO) for financial support. Additionally, we thank the LANL LDRD program for a Director's Postdoctoral Fellowship to CMM. Los Alamos National Laboratory is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC5206A25396. Additionally, we would like to thank W. Kirk Hollis for assistance with GC-MS analysis. NR 37 TC 0 Z9 0 U1 3 U2 3 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1864-5631 EI 1864-564X J9 CHEMSUSCHEM JI ChemSusChem PD DEC 20 PY 2016 VL 9 IS 24 BP 3382 EP 3386 DI 10.1002/cssc.201600936 PG 5 WC Chemistry, Multidisciplinary; GREEN & SUSTAINABLE SCIENCE & TECHNOLOGY SC Chemistry; Science & Technology - Other Topics GA EL4DI UT WOS:000394571500003 PM 27933751 ER PT J AU Liu, F Parkinson, BA Divan, R Roberts, J Liang, YP AF Liu, Fei Parkinson, B. A. Divan, Ralu Roberts, John Liang, Yanping TI Quantitative Analysis of Homogeneous Electrocatalytic Reactions at IDA Electrodes: The Example of [Ni(p(2)(Ph)N(2)(Bn))(2)](2+) SO ELECTROCHIMICA ACTA LA English DT Article DE Interdigitated array (IDA) electrodes; EC' reaction; mechanism; quantitative analysis ID INTERDIGITATED ARRAY ELECTRODES; DIFFUSION-CONTROLLED CURRENTS; MICROELECTRODE ARRAYS; DIGITAL-SIMULATION; ELECTROCHEMICAL IMMUNOASSAY; MICROARRAY ELECTRODES; DIFFERENT GEOMETRIES; SELECTIVE DETECTION; OXYGEN REDUCTION; BAND ELECTRODE AB Interdigitated array (IDA) electrodes have been applied to study the EC' (electron transfer reaction followed by a catalytic reaction) reactions and a new method of quantitative analysis of IDA results was developed. In this new method, currents on IDA generator and collector electrodes for an EC' mechanism are derived from the number of redox cycles and the contribution of non-catalytic current. And the fractions of bipotential recycling species and catalytic-active species are calculated, which helps understanding the catalytic reaction mechanism. The homogeneous hydrogen evolution reaction catalyzed by [Ni(p(2)(Ph)N(2)(Bn))(2)](2+) (where p(2)(Ph)N(2)(Bn) is 1,5-dibenzyl-3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) electrocatalyst was examined and analyzed with IDA electrodes. Besides, the existence of reaction intermediates in the catalytic cycle is inferred from the electrochemical behavior of a glassy carbon disk electrodes and carbon IDA electrodes. This quantitative analysis of IDA electrode cyclic voltammetry currents can be used as a simple and straightforward method for determining reaction mechanism in other catalytic systems as well. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Liu, Fei; Liang, Yanping] Xidian Univ, Sch Adv Mat & Nanotechnol, Xian 710126, Peoples R China. [Parkinson, B. A.] Univ Wyoming, Sch Energy Resources, Dept Chem, Laramie, WY 82071 USA. [Divan, Ralu] Argonne Natl Lab, Ctr Nanoscale Mat, Lemont, IL 60439 USA. [Roberts, John] Pacific Northwest Natl Lab, Ctr Mol Electrocatalysis, POB 999,K2-57, Richland, WA 99352 USA. EM fliu@xidian.edu.cn FU Center for Molecular Electrocatalysis, an Energy Frontier Research Center - Department of Energy, Office of Science, Office of Basic Energy Sciences; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-AC02-06CH11357] FX This work was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for DOE. Use of the Center for Nanoscale Materials, an Office of Science user facility, was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract No. DE-AC02-06CH11357. The authors would also like to thank Daniel Rosenmann and Suzanne C. Miller for help with carbon IDA electrodes fabrication. NR 53 TC 0 Z9 0 U1 1 U2 1 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0013-4686 EI 1873-3859 J9 ELECTROCHIM ACTA JI Electrochim. Acta PD DEC 20 PY 2016 VL 222 BP 323 EP 330 DI 10.1016/j.electacta.2016.10.176 PG 8 WC Electrochemistry SC Electrochemistry GA EI5WE UT WOS:000392566200036 ER PT J AU Wu, LM Wen, YH Zhang, J AF Wu, Linmin Wen, Youhai Zhang, Jing TI Three-Dimensional Finite Element Study on Li Diffusion Induced Stress in FIB-SEM Reconstructed LiCoO2 Half Cell SO ELECTROCHIMICA ACTA LA English DT Article DE Diffusion induced stress; FIB-SEM; LiCoO2; Finite element; Microstructure ID LITHIUM-ION BATTERIES; INTERCALATION-INDUCED STRESS; NUMERICAL-SIMULATION; HEAT-GENERATION; INSERTION CELL; ELECTRODE; PARTICLES; MODEL; DISCHARGE; EVOLUTION AB In this study, the diffusion induced stress of LiCoO2 half cell with a realistic 3D microstructure has been studied using finite element method. The electrochemical properties under various C rates were studied. The discharged curves under various C rates were simulated. Results show that the potential drops significantly with the increase of C rates. The lithium ion concentration distribution under high discharging rates shows strong inhomogeneity. At high C rates, the small LiCoO2 particles near the separator have higher lithium ion concentration because of the shorter lithium migration and diffusion paths. The diffusion induced stress inside LiCoO2 particles was calculated coupled with lithium diffusion. The results show that the stress near the concave and convex regions is the highest. The neck regions of the connected particles will break first and form several isolated particles. For isolated particles, cracks are more likely to form on the surface rather than inside the particle. Failure may occur in large grains ahead of small grains. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Wu, Linmin; Zhang, Jing] Indiana Univ Purdue Univ, Dept Mech Engn, Indianapolis, IN 46202 USA. [Wen, Youhai] Natl Energy Technol Lab, Albany, OR 97321 USA. EM jz29@iupui.edu NR 32 TC 0 Z9 0 U1 13 U2 13 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0013-4686 EI 1873-3859 J9 ELECTROCHIM ACTA JI Electrochim. Acta PD DEC 20 PY 2016 VL 222 BP 814 EP 820 DI 10.1016/j.electacta.2016.11.042 PG 7 WC Electrochemistry SC Electrochemistry GA EI5WE UT WOS:000392566200091 ER PT J AU Bellissima, S De Panfilis, S Bafile, U Cunsolo, A Gonzalez, MA Guarini, E Formisano, F AF Bellissima, Stefano De Panfilis, Simone Bafile, Ubaldo Cunsolo, Alessandro Gonzalez, Miguel Angel Guarini, Eleonora Formisano, Ferdinando TI The hydrogen-bond collective dynamics in liquid methanol SO SCIENTIFIC REPORTS LA English DT Article ID INELASTIC NEUTRON-SCATTERING; 1ST COORDINATION SHELL; NORMAL-MODE ANALYSIS; MOLECULAR-DYNAMICS; STRUCTURAL MOTIFS; ORGANIC LIQUIDS; AMBIENT WATER; HEAVY-WATER; FAST SOUND; EXCITATIONS AB The relatively simple molecular structure of hydrogen-bonded (HB) systems is often belied by their exceptionally complex thermodynamic and microscopic behaviour. For this reason, after a thorough experimental, computational and theoretical scrutiny, the dynamics of molecules in HB systems still eludes a comprehensive understanding. Aiming at shedding some insight into this topic, we jointly used neutron Brillouin scattering and molecular dynamics simulations to probe the dynamics of a prototypical hydrogen-bonded alcohol, liquid methanol. The comparison with the most thoroughly investigated HB system, liquid water, pinpoints common behaviours of their THz microscopic dynamics, thereby providing additional information on the role of HB dynamics in these two systems. This study demonstrates that the dynamic behaviour of methanol is much richer than what so far known, and prompts us to establish striking analogies with the features of liquid and supercooled water. In particular, based on the strong differences between the structural properties of the two systems, our results suggest that the assignment of some dynamical properties to the tetrahedral character of water structure should be questioned. We finally highlight the similarities between the characteristic decay times of the time correlation function, as obtained from our data and the mean lifetime of hydrogen bond known in literature. C1 [Bellissima, Stefano; Guarini, Eleonora] Univ Florence, Dipartimento Fis, I-50019 Sesto Fiorentino, Italy. [De Panfilis, Simone] Ist Italiano Tecnol, Ctr Life Nanosci, I-00161 Rome, Italy. [Bafile, Ubaldo] CNR, Ist Sistemi Complessi, I-50019 Sesto Fiorentino, Italy. [Cunsolo, Alessandro] Brookhaven Natl Lab, Natl Synchrotron Light Source 2, Upton, NY 11973 USA. [Gonzalez, Miguel Angel] Inst Laue Langevin, F-38042 Grenoble, France. [Formisano, Ferdinando] CNR, Ist Off Mat, Operat Grp Grenoble, F-38042 Grenoble, France. RP Formisano, F (reprint author), CNR, Ist Off Mat, Operat Grp Grenoble, F-38042 Grenoble, France. EM formisano@ill.eu FU DOE Office of Science [DE-SC0012704] FX We warmly acknowledge J. Teixeira for useful and stimulating discussions. We are grateful to ILL for availability of neutron beam time. This research used resources of the National Synchrotron Light Source II, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Brookhaven National Laboratory under Contract No. DE-SC0012704. NR 63 TC 1 Z9 1 U1 15 U2 15 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 20 PY 2016 VL 6 AR 39533 DI 10.1038/srep39533 PG 10 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE9WB UT WOS:000389975900002 PM 27996056 ER PT J AU Rubin, D Hayden, B AF Rubin, D. Hayden, B. TI IS THE EXPANSION OF THE UNIVERSE ACCELERATING? ALL SIGNS POINT TO YES SO ASTROPHYSICAL JOURNAL LETTERS LA English DT Article DE cosmological parameters; cosmology: observations; dark energy ID EQUATION-OF-STATE; IA SUPERNOVAE; COSMOLOGICAL PARAMETERS; UNCERTAINTIES; LUMINOSITIES; LAMBDA; OMEGA AB The accelerating expansion of the universe is one of the most profound discoveries in modern cosmology, suggesting a universe in which 70% of the mass-energy density has an unknown form spread uniformly across the universe. This result has been well established using a combination of cosmological probes, resulting in a "standard model" of modern cosmology that is a combination of a cosmological constant with cold dark matter and baryons. The first compelling evidence for the acceleration came in the late 1990s, when two independent teams studying Type Ia supernovae discovered that distant SNe Ia were dimmer than expected. The combined analysis of modern cosmology experiments, including SNe Ia, the Hubble constant, baryon acoustic oscillations, and the cosmic microwave background, has now measured the contributions of matter and the cosmological constant to the energy density of the universe to better than 0.01, providing a secure measurement of acceleration. A recent study has claimed that the evidence for acceleration from SNe Ia is "marginal." Here we demonstrate errors in that analysis that reduce the acceleration significance from SNe Ia, and further demonstrate that conservative constraints on the curvature or matter density of the universe increase the significance even more. Analyzing the Joint Light-curve Analysis supernova sample, we find 4.2 sigma evidence for acceleration with SNe Ia alone, and 11.2 sigma in a flat universe. With our improved supernova analysis and. not rejecting all other cosmological constraints, we find that acceleration is quite secure. C1 [Rubin, D.] Space Telescope Sci Inst, 3700 San Martin Dr, Baltimore, MD 21218 USA. [Rubin, D.; Hayden, B.] EO Lawrence Berkeley Natl Lab, 1 Cyclotron Road, Berkeley, CA 94720 USA. [Hayden, B.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. RP Rubin, D (reprint author), Space Telescope Sci Inst, 3700 San Martin Dr, Baltimore, MD 21218 USA.; Rubin, D (reprint author), EO Lawrence Berkeley Natl Lab, 1 Cyclotron Road, Berkeley, CA 94720 USA. EM drubin@stsci.edu OI Hayden, Brian/0000-0001-9200-8699 FU Office of Science, Office of High Energy Physics, of the U.S. Department of Energy [DE-AC02-05CH11231]; NASA ROSES-14 WFIRST Preparatory Science program [14-WPS14-0050] FX We appreciate the feedback we received from Greg Aldering, Peter Nugent, Saurabh Jha, Saul Perlmutter, Alex Kim, Peter Garnavich, and Mike Hobson. Support was provided by the Director, Office of Science, Office of High Energy Physics, of the U.S. Department of Energy under contract No. DE-AC02-05CH11231 and NASA ROSES-14 WFIRST Preparatory Science program 14-WPS14-0050. NR 24 TC 0 Z9 0 U1 2 U2 2 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 2041-8205 EI 2041-8213 J9 ASTROPHYS J LETT JI Astrophys. J. Lett. PD DEC 20 PY 2016 VL 833 IS 2 AR L30 DI 10.3847/2041-8213/833/2/L30 PG 5 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EH2OU UT WOS:000391607900005 ER PT J AU Pohlker, ML Pohlker, C Ditas, F Klimach, T de Angelis, IH Araujo, A Brito, J Carbone, S Cheng, YF Chi, XG Ditz, R Gunthe, SS Kesselmeier, J Konemann, T Lavric, JV Martin, ST Mikhailov, E Moran-Zuloaga, D Rose, D Saturno, J Su, H Thalman, R Walter, D Wang, J Wolff, S Barbosa, HMJ Artaxo, P Andreae, MO Poschl, U AF Poehlker, Mira L. Poehlker, Christopher Ditas, Florian Klimach, Thomas de Angelis, Isabella Hrabe Araujo, Alessandro Brito, Joel Carbone, Samara Cheng, Yafang Chi, Xuguang Ditz, Reiner Gunthe, Sachin S. Kesselmeier, Juergen Koenemann, Tobias Lavric, Jost V. Martin, Scot T. Mikhailov, Eugene Moran-Zuloaga, Daniel Rose, Diana Saturno, Jorge Su, Hang Thalman, Ryan Walter, David Wang, Jian Wolff, Stefan Barbosa, Henrique M. J. Artaxo, Paulo Andreae, Meinrat O. Poeschl, Ulrich TI Long-term observations of cloud condensation nuclei in the Amazon rain forest - Part 1: Aerosol size distribution, hygroscopicity, and new model parametrizations for CCN prediction SO ATMOSPHERIC CHEMISTRY AND PHYSICS LA English DT Article ID SECONDARY ORGANIC AEROSOL; SEA-SURFACE TEMPERATURES; BIOMASS BURNING SMOKE; MEGA-CITY GUANGZHOU; DRY-SEASON; TRACE GASES; WET SEASON; SUBMICROMETER AEROSOL; RESOLVED MEASUREMENTS; CHEMICAL-COMPOSITION AB Size-resolved long-term measurements of atmospheric aerosol and cloud condensation nuclei (CCN) concentrations and hygroscopicity were conducted at the remote Amazon Tall Tower Observatory (ATTO) in the central Amazon Basin over a 1-year period and full seasonal cycle (March 2014-February 2015). The measurements provide a climatology of CCN properties characteristic of a remote central Amazonian rain forest site. The CCN measurements were continuously cycled through 10 levels of supersaturation (S = 0.11 to 1.10 %) and span the aerosol particle size range from 20 to 245 nm. The mean critical diameters of CCN activation range from 43 nm at S = 1.10% to 172 nm at S = 0.11 %. The particle hygroscopicity exhibits a pronounced size dependence with lower values for the Aitken mode (kappa(Ait) = 0.14 +/- 0.03), higher values for the accumulation mode (kappa(Acc) = 0.22 +/- 0.05), and an overall mean value of kappa(mean) = 0.17 +/- 0.06, consistent with high fractions of organic aerosol. The hygroscopicity parameter, kappa, exhibits remarkably little temporal variability: no pronounced diurnal cycles, only weak seasonal trends, and few short-term variations during long-range transport events. In contrast, the CCN number concentrations exhibit a pronounced seasonal cycle, tracking the pollution-related seasonality in total aerosol concentration. We find that the variability in the CCN concentrations in the central Amazon is mostly driven by aerosol particle number concentration and size distribution, while variations in aerosol hygroscopicity and chemical composition matter only during a few episodes. For modeling purposes, we compare different approaches of predicting CCN number concentration and present a novel parametrization, which allows accurate CCN predictions based on a small set of input data. C1 [Poehlker, Mira L.; Poehlker, Christopher; Ditas, Florian; Klimach, Thomas; de Angelis, Isabella Hrabe; Cheng, Yafang; Chi, Xuguang; Ditz, Reiner; Kesselmeier, Juergen; Koenemann, Tobias; Moran-Zuloaga, Daniel; Saturno, Jorge; Su, Hang; Walter, David; Wolff, Stefan; Andreae, Meinrat O.; Poeschl, Ulrich] Max Planck Inst Chem, Multiphase Chem Dept, D-55020 Mainz, Germany. [Poehlker, Mira L.; Poehlker, Christopher; Ditas, Florian; Klimach, Thomas; de Angelis, Isabella Hrabe; Cheng, Yafang; Chi, Xuguang; Ditz, Reiner; Kesselmeier, Juergen; Koenemann, Tobias; Moran-Zuloaga, Daniel; Saturno, Jorge; Su, Hang; Walter, David; Wolff, Stefan; Andreae, Meinrat O.; Poeschl, Ulrich] Max Planck Inst Chem, Biogeochem Dept, D-55020 Mainz, Germany. [Araujo, Alessandro] Empresa Brasileira Pesquisa Agr EMBRAPA, BR-66095100 Belem, PA, Brazil. [Brito, Joel; Carbone, Samara; Barbosa, Henrique M. J.; Artaxo, Paulo] Univ Sao Paulo, Inst Phys, BR-05508900 Sao Paulo, Brazil. [Gunthe, Sachin S.] Indian Inst Technol, Dept Civil Engn, EWRE Div, Madras 600036, Tamil Nadu, India. [Lavric, Jost V.] Max Planck Inst Biogeochem, Dept Biogeochem Syst, D-07701 Jena, Germany. [Martin, Scot T.] Harvard Univ, Sch Engn & Appl Sci, Cambridge, MA 02138 USA. [Mikhailov, Eugene] St Petersburg State Univ, 7-9 Univ Skaya Nab, St Petersburg 199034, Russia. [Rose, Diana] Goethe Univ Frankfurt Main, Inst Atmospher & Environm Res, D-60438 Frankfurt, Germany. [Thalman, Ryan; Wang, Jian] Brookhaven Natl Lab, Biol Environm & Climate Sci Dept, Upton, NY 11973 USA. [Wolff, Stefan] INPA, BR-69083000 Manaus, Amazonas, Brazil. [Andreae, Meinrat O.] Univ Calif San Diego, Scripps Inst Oceanog, La Jolla, CA 92037 USA. [Brito, Joel] Univ Blaise Pascal, Lab Meteorol Phys, Clermont Ferrand, France. [Carbone, Samara] Univ Fed Uberlandia, BR-38408100 Uberlandia, MG, Brazil. [Chi, Xuguang] Nanjing Univ, Inst Climate & Global Change Res, Nanjing 210093, Jiangsu, Peoples R China. [Chi, Xuguang] Nanjing Univ, Sch Atmospher Sci, Nanjing 210093, Jiangsu, Peoples R China. [Thalman, Ryan] Snow Coll, Dept Chem, Richfield, UT 84701 USA. RP Pohlker, ML (reprint author), Max Planck Inst Chem, Multiphase Chem Dept, D-55020 Mainz, Germany.; Pohlker, ML (reprint author), Max Planck Inst Chem, Biogeochem Dept, D-55020 Mainz, Germany. EM m.pohlker@mpic.de RI Mikhailov, Eugene/F-9452-2010; Su, Hang/A-6226-2010; Andreae, Meinrat/B-1068-2008; Cheng, Yafang/F-9362-2010; Wang, Jian/G-9344-2011; OI Mikhailov, Eugene/0000-0001-5736-0996; Su, Hang/0000-0003-4889-1669; Andreae, Meinrat/0000-0003-1968-7925; Cheng, Yafang/0000-0003-4912-9879; Saturno, Jorge/0000-0002-3761-3957 FU Max Planck Society (MPG); Max Planck Graduate Center; Johannes Gutenberg University Mainz (MPGC); German Federal Ministry of Education and Research (BMBF) [01LB1001A]; Brazilian Ministerio da Ciencia, Tecnologia e Inovacao (MCTI/FINEP) [01.11.01248.00]; Amazon State University (UEA); FAPEAM; LBA/INPA; SDS/CEUC/RDS-Uatuma; St. Petersburg state University, Russia [11.37.220.2016]; EU FP7 project BACCHUS [603445]; Instituto Nacional de Pesquisas da Amazonia (INPA) FX This work has been supported by the Max Planck Society (MPG) and the Max Planck Graduate Center with the Johannes Gutenberg University Mainz (MPGC). For the operation of the ATTO site, we acknowledge the support by the German Federal Ministry of Education and Research (BMBF contract 01LB1001A) and the Brazilian Ministerio da Ciencia, Tecnologia e Inovacao (MCTI/FINEP contract 01.11.01248.00) and the Amazon State University (UEA), FAPEAM, LBA/INPA and SDS/CEUC/RDS-Uatuma, and the St. Petersburg state University, Russia (project 11.37.220.2016) as well as the EU FP7 project BACCHUS (project no. 603445). This paper contains results of research conducted under the Technical/Scientific Cooperation Agreement between the National Institute for Amazonian Research, the State University of Amazonas, and the Max Planck Gesellschaft e.V.; the opinions expressed are the entire responsibility of the authors and not of the participating institutions. We highly acknowledge the support by the Instituto Nacional de Pesquisas da Amazonia (INPA). We would like to especially thank all the people involved in the technical, logistical, and scientific support of the ATTO project, in particular Matthias Sorgel, Thomas Disper, Andrew Crozier, Uwe Schulz, Steffen Schmidt, Antonio Ocimar Manzi, Alcides Camargo Ribeiro, Hermes Braga Xavier, Elton Mendes da Silva, Nagib Alberto de Castro Souza, Adi Vasconcelos Brandao, Amaury Rodrigues Pereira, Antonio Huxley Melo Nascimento, Thiago de Lima Xavier, Josue Ferreira de Souza, Roberta Pereira de Souza, Bruno Takeshi, and Wallace Rabelo Costa. Further, we thank the GoAmazon2014/5 team for the fruitful collaboration and discussions. We acknowledge technical support by the DMT and Grimm Aerosol Technik teams in the course of the experiments. Moreover, we thank Qiaoqiao Wang, Bettina Weber, Nina Ruckteschler, Bruna Amorim Holanda, Kathrin Reinmuth-Selzle, J. Alex Huffman, Ramon Braga, and Daniel Rosenfeld for support and stimulating discussions. NR 100 TC 0 Z9 0 U1 18 U2 18 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1680-7316 EI 1680-7324 J9 ATMOS CHEM PHYS JI Atmos. Chem. Phys. PD DEC 20 PY 2016 VL 16 IS 24 BP 15709 EP 15740 DI 10.5194/acp-16-15709-2016 PG 32 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA EH1VL UT WOS:000391555600001 ER PT J AU Boorman, PG Gandhi, P Alexander, DM Annuar, A Ballantyne, DR Bauer, F Boggs, SE Brandt, WN Brightman, M Christensen, FE Craig, WW Farrah, D Hailey, CJ Harrison, FA Honig, SF Koss, M LaMassa, SM Masini, A Ricci, C Risaliti, G Stern, D Zhang, WW AF Boorman, Peter G. Gandhi, P. Alexander, D. M. Annuar, A. Ballantyne, D. R. Bauer, F. Boggs, S. E. Brandt, W. N. Brightman, M. Christensen, F. E. Craig, W. W. Farrah, D. Hailey, C. J. Harrison, F. A. Honig, S. F. Koss, M. LaMassa, S. M. Masini, A. Ricci, C. Risaliti, G. Stern, D. Zhang, W. W. TI IC 3639-A NEW BONA FIDE COMPTON-THICK AGN UNVEILED BY NuSTAR SO ASTROPHYSICAL JOURNAL LA English DT Article DE galaxies: active; galaxies: nuclei; galaxies: Seyfert; techniques: spectroscopic; X-rays: galaxies; X-rays: individual (IC 3639) ID ACTIVE GALACTIC NUCLEI; SEYFERT 2 GALAXIES; X-RAY CORRELATION; SUBARCSECOND MIDINFRARED VIEW; K-ALPHA EMISSION; XMM-NEWTON; MU-M; EXTREME ABSORPTION; IRON LINES; BLACK-HOLE AB We analyze high-quality NuSTAR observations of the local (z = 0.011) Seyfert 2 active galactic nucleus (AGN) IC 3639, in conjunction with archival Suzaku and Chandra data. This provides the first broadband X-ray spectral analysis of the source, spanning nearly two decades in energy (0.5-30 keV). Previous X-ray observations of the source below 10 keV indicated strong reflection/obscuration on the basis of a pronounced iron fluorescence line at 6.4 keV. The hard X-ray energy coverage of NuSTAR, together with self-consistent toroidal reprocessing models, enables direct broadband constraints on the obscuring column density of the source. We find the source to be heavily Compton-thick (CTK) with an obscuring column in excess of 3.6 x 10(24) cm(-2), unconstrained at the upper end. We further find an intrinsic 2-10 keV luminosity of log(10) (L2-10keV[erg s(-1)] = 43.4(-1.1)(+0.6) to 90% confidence, almost 400 times the observed flux, and consistent with various multiwavelength diagnostics. Such a high ratio of intrinsic to observed flux, in addition to an Fe-K alpha fluorescence line equivalent width exceeding 2 keV, is extreme among known bona fide CTK AGNs, which we suggest are both due to the high level of obscuration present around IC 3639. Our study demonstrates that broadband spectroscopic modeling with NuSTAR enables large corrections for obscuration to be carried out robustly and emphasizes the need for improved modeling of AGN tori showing intense iron fluorescence. C1 [Boorman, Peter G.; Gandhi, P.; Honig, S. F.] Univ Southampton, Fac Phys Sci & Engn, Dept Phys & Astron, Southampton SO17 1BJ, Hants, England. [Alexander, D. M.; Annuar, A.] Univ Durham, Dept Phys, Ctr Extragalact Astron, South Rd, Durham DH1 3LE, England. [Ballantyne, D. R.] Georgia Inst Technol, Sch Phys, Ctr Relativist Astrophys, Atlanta, GA 30332 USA. [Bauer, F.; Ricci, C.] Pontificia Univ Catolica Chile, Fac Fis, Inst Astrofis, Casilla 306, Santiago 22, Chile. [Bauer, F.; Ricci, C.] Pontificia Univ Catolica Chile, Fac Fis, Ctr Astroingn, Casilla 306, Santiago 22, Chile. [Bauer, F.] Millennium Inst Astrophys MAS, Nuncio Monsenor Sotero Sanz 100, Santiago, Chile. [Bauer, F.] Space Sci Inst, 4750 Walnut St,Suite 205, Boulder, CO 80301 USA. [Boggs, S. E.] Univ Calif Berkeley, Space Sci Lab, Berkeley, CA 94720 USA. [Brandt, W. N.] Penn State Univ, Davey Lab 525, Dept Astron & Astrophys, University Pk, PA 16802 USA. [Brandt, W. N.] Penn State Univ, Inst Gravitat & Cosmos, University Pk, PA 16802 USA. [Brandt, W. N.] Penn State Univ, Dept Phys, Davey Lab 104, University Pk, PA 16802 USA. [Brightman, M.] CALTECH, Cahill Ctr Astron & Astrophys, Pasadena, CA 91125 USA. [Christensen, F. E.; Craig, W. W.] Tech Univ Denmark, DTU Space Natl Space Inst, Elektrovej 327, DK-2800 Lyngby, Denmark. [Craig, W. W.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Craig, W. W.] Dept Phys, Virginia Tech, Blacksburg, VA 24061 USA. [Farrah, D.] Dept Phys, Virginia Tech, Blacksburg, VA 24061 USA. [Hailey, C. J.] Columbia Univ, Columbia Astrophys Lab, New York, NY 10027 USA. [Koss, M.] Swiss Fed Inst Technol, Inst Astron, Dept Phys, Wolfgang Pauli Str 27, CH-8093 Zurich, Switzerland. [Harrison, F. A.] NASA Postdoctoral Program Fellow, NASA Goddard Space Flight Ctr, Code 665, Greenbelt, MD 20771 USA. [Masini, A.] Univ Bologna, Dipartimento Fis Astron DIFA, Viale Berti Pichat 6-2, I-40127 Bologna, Italy. [Risaliti, G.] INAFArcetri Observ, Largo Fermi 5, I-50126 Florence, Italy. [Stern, D.] CALTECH, Jet Prop Lab, Pasadena, CA 91109 USA. [Stern, D.] NASA Goddard Space Flight Ctr, X Ray Astrophys Lab, Greenbelt, MD 20771 USA. RP Boorman, PG (reprint author), Univ Southampton, Fac Phys Sci & Engn, Dept Phys & Astron, Southampton SO17 1BJ, Hants, England. EM p.g.boorman@soton.ac.uk OI Ballantyne, David/0000-0001-8128-6976 FU National Aeronautics and Space Administration; STFC [ST/J003697/2]; RAS; Majlis Amanah Rakyat (MARA), Malaysia; Caltech NuSTAR [44A-1092750]; European Research Council [ERC-2015-StG-677117]; Swiss National Science Foundation (SNSF) [PZOOP2_154799/1]; NASA; ASI/INAF grant [I/037/12/0-011/13]; NASA NuSTAR A01 Award [NNX15AV27G]; CONICYT-Chile [Basal-CATA PFB-06/2007]; FONDECYT Regular [1141218, 1151408]; China-CONICYT; Ministry of Economy, Development, and Tourism's Millennium Science Initiative [IC120009] FX We thank the anonymous referee for the invaluable comments that helped to improve this paper. This work made use of data from the NuSTAR mission, a project led by the California Institute of Technology, managed by the Jet Propulsion Laboratory, and funded by the National Aeronautics and Space Administration. We thank the NuSTAR Operations, Software, and Calibration teams for support with the execution and analysis of these observations. This research has made use of the NuSTAR Data Analysis Software (NuSTARDAS) jointly developed by the ASI Science Data Center (ASDC, Italy) and the California Institute of Technology (USA). The scientific results reported in this article are based on observations made by the ChandraX-ray Observatory.; This publication makes use of data products from the Wide field Infrared Survey Explorer, which is a joint project of the University of California, Los Angeles, and the Jet Propulsion Laboratory/California Institute of Technology, funded by the National Aeronautics and Space Administration.; P.B. thanks STFC and the RAS for funding.; P.G. thanks STFC for support (grant reference ST/J003697/2).; A.A. acknowledges financial support from Majlis Amanah Rakyat (MARA), Malaysia.; W.N.B. acknowledges Caltech NuSTAR subcontract 44A-1092750 and the VM Willaman Endowment.; S.F.H. acknowledges support from the European Research Council under Horizon 2020 grant ERC-2015-StG-677117.; M.K. acknowledges support from the Swiss National Science Foundation (SNSF) through the Ambizione fellowship grant PZOOP2_154799/1.; S.M.L. acknowledges support by an appointment to the NASA Postdoctoral Program at the NASA Goddard Space Flight Center, administered by the Universities Space Research Association under contract with NASA.; A.M. acknowledges support from the ASI/INAF grant I/037/12/0-011/13.; F.E.B. and C.R. acknowledge support from NASA NuSTAR A01 Award NNX15AV27G, CONICYT-Chile grants Basal-CATA PFB-06/2007, FONDECYT Regular 1141218 and 1151408, "EMBIGGEN" Anillo ACT1101, the China-CONICYT, and the Ministry of Economy, Development, and Tourism's Millennium Science Initiative through grant IC120009, awarded to The Millennium Institute of Astrophysics, MAS. NR 89 TC 1 Z9 1 U1 3 U2 3 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 20 PY 2016 VL 833 IS 2 AR 245 DI 10.3847/1538-4357/833/2/245 PG 18 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG6PY UT WOS:000391169600120 ER PT J AU Kaurov, AA Hooper, D Gnedin, NY AF Kaurov, Alexander A. Hooper, Dan Gnedin, Nickolay Y. TI THE EFFECTS OF DARK MATTER ANNIHILATION ON COSMIC REIONIZATION SO ASTROPHYSICAL JOURNAL LA English DT Article DE cosmology: theory; dark ages, reionization, first stars; dark matter ID INTERGALACTIC MEDIUM; EARLY UNIVERSE; 1ST STRUCTURES; GALAXIES; CONSTRAINTS; IONIZATION; ELECTRONS; IMPACT; SIMULATIONS; DEPENDENCE AB We revisit the possibility of constraining the properties of dark matter (DM) by studying the epoch of cosmic reionization. Previous studies have shown that DM annihilation was unlikely to have provided a large fraction of the photons which ionized the universe, but instead played a subdominant role relative to stars and quasars. The DM might, however, have begun to efficiently annihilate with the formation of primordial microhalos at z similar to 100-200, much earlier than the formation of the first stars. Therefore, if DM annihilation ionized the universe at even the percent level over the interval z similar to 20-100, it could leave a significant imprint on the global optical depth, tau. Moreover, we show that cosmic microwave background polarization data and future 21 cm measurements will enable us to more directly probe the DM contribution to the optical depth. In order to compute the annihilation rate throughout the epoch of reionization, we adopt the latest results from structure formation studies and explore the impact of various free parameters on our results. We show that future measurements could make it possible to place constraints on the DM's annihilation cross-sections, which are at a level comparable to those obtained from the observations of dwarf galaxies, cosmic-ray measurements, and studies of recombination. C1 [Kaurov, Alexander A.; Hooper, Dan; Gnedin, Nickolay Y.] Univ Chicago, Dept Astron & Astrophys, Chicago, IL 60637 USA. [Hooper, Dan; Gnedin, Nickolay Y.] Fermilab Natl Accelerator Lab, Ctr Particle Astrophys, Batavia, IL 60510 USA. [Hooper, Dan; Gnedin, Nickolay Y.] Univ Chicago, Kavli Inst Cosmol Phys, Chicago, IL 60637 USA. [Hooper, Dan; Gnedin, Nickolay Y.] Univ Chicago, Enrico Fermi Inst, Chicago, IL 60637 USA. RP Kaurov, AA (reprint author), Univ Chicago, Dept Astron & Astrophys, Chicago, IL 60637 USA. EM kaurov@uchicago.edu OI Kaurov, Alexander/0000-0003-0255-1204 FU United States Department of Energy [DE-AC02-07CH11359]; NSF [AST-1211190] FX Fermilab is operated by Fermi Research Alliance, LLC, under Contract No. DE-AC02-07CH11359 with the United States Department of Energy. This work was also supported in part by the NSF grant AST-1211190. NR 57 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 20 PY 2016 VL 833 IS 2 AR 162 DI 10.3847/1538-4357/833/2/162 PG 7 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG6PY UT WOS:000391169600037 ER PT J AU Kim, JH Agertz, O Teyssier, R Butler, MJ Ceverino, D Choi, JH Feldmann, R Keller, BW Lupi, A Quinn, T Revaz, Y Wallace, S Gnedin, NY Leitner, SN Shen, S Smith, BD Thompson, R Turk, MJ Abel, T Arraki, KS Benincasa, SM Chakrabarti, S DeGraf, C Dekel, A Goldbaum, NJ Hopkins, PF Hummels, CB Klypin, A Li, H Madau, P Mandelker, N Mayer, L Nagamine, K Nickerson, S O'Shea, BW Primack, JR Roca-Fabrega, S Semenov, V Shimizu, I Simpson, CM Todoroki, K Wadsley, JW Wise, JH AF Kim, Ji-Hoon Agertz, Oscar Teyssier, Romain Butler, Michael J. Ceverino, Daniel Choi, Jun-Hwan Feldmann, Robert Keller, Ben W. Lupi, Alessandro Quinn, Thomas Revaz, Yves Wallace, Spencer Gnedin, Nickolay Y. Leitner, Samuel N. Shen, Sijing Smith, Britton D. Thompson, Robert Turk, Matthew J. Abel, Tom Arraki, Kenza S. Benincasa, Samantha M. Chakrabarti, Sukanya DeGraf, Colin Dekel, Avishai Goldbaum, Nathan J. Hopkins, Philip F. Hummels, Cameron B. Klypin, Anatoly Li, Hui Madau, Piero Mandelker, Nir Mayer, Lucio Nagamine, Kentaro Nickerson, Sarah O'Shea, Brian W. Primack, Joel R. Roca-Fabrega, Santi Semenov, Vadim Shimizu, Ikkoh Simpson, Christine M. Todoroki, Keita Wadsley, James W. Wise, John H. CA AGORA Collaboration TI THE AGORA HIGH-RESOLUTION GALAXY SIMULATIONS COMPARISON PROJECT. II. ISOLATED DISK TEST SO ASTROPHYSICAL JOURNAL LA English DT Article DE cosmology: theory; galaxies: evolution; galaxies: formation; galaxies: kinematics and dynamics; ISM: structure; methods: numerical ID SMOOTHED-PARTICLE HYDRODYNAMICS; ADAPTIVE MESH REFINEMENT; STAR-FORMATION LAW; SELF-GRAVITATIONAL HYDRODYNAMICS; PIECEWISE PARABOLIC METHOD; N-BODY SIMULATIONS; STELLAR FEEDBACK; COSMOLOGICAL HYDRODYNAMICS; MOLECULAR-HYDROGEN; RADIATIVE-TRANSFER AB Using an isolated Milky Way-mass galaxy simulation, we compare results from nine state-of-the-art gravitohydrodynamics codes widely used in the numerical community. We utilize the infrastructure we have built for the AGORA High-resolution Galaxy Simulations Comparison Project. This includes the common disk initial conditions, common physics models (e. g., radiative cooling and UV background by the standardized package GRACKLE) and common analysis toolkit yt, all of which are publicly available. Subgrid physics models such as Jeans pressure floor, star formation, supernova feedback energy, and metal production are carefully constrained across code platforms. With numerical accuracy that resolves the disk scale height, we find that the codes overall agree well with one another in many dimensions including: gas and stellar surface densities, rotation curves, velocity dispersions, density and temperature distribution functions, disk vertical heights, stellar clumps, star formation rates, and Kennicutt-Schmidt relations. Quantities such as velocity dispersions are very robust (agreement within a few tens of percent at all radii) while measures like newly formed stellar clump mass functions show more significant variation (difference by up to a factor of similar to 3). Systematic differences exist, for example, between mesh-based and particle-based codes in the low-density region, and between more diffusive and less diffusive schemes in the high-density tail of the density distribution. Yet intrinsic code differences are generally small compared to the variations in numerical implementations of the common subgrid physics such as supernova feedback. Our experiment reassures that, if adequately designed in accordance with our proposed common parameters, results of a modern high-resolution galaxy formation simulation are more sensitive to input physics than to intrinsic differences in numerical schemes. C1 [Kim, Ji-Hoon] SLAC Natl Accelerator Lab, Kavli Inst Particle Astrophys & Cosmol, Menlo Pk, CA 94025 USA. [Kim, Ji-Hoon] Stanford Univ, Dept Phys, Stanford, CA 94305 USA. [Kim, Ji-Hoon] CALTECH, Dept Astron, Pasadena, CA 91125 USA. [Agertz, Oscar] Univ Surrey, Dept Phys, Guildford GU2 7XH, Surrey, England. [Agertz, Oscar] Lund Univ, Dept Astron & Theoret Phys, Lund Observ, SE-22100 Lund, Sweden. [Teyssier, Romain] Univ Zurich, Inst Computat Sci, Ctr Theoret Astrophys & Cosmol, CH-8057 Zurich, Switzerland. [Butler, Michael J.] Max Planck Inst Astron, D-69117 Heidelberg, Germany. [Ceverino, Daniel] Heidelberg Univ, Inst Theoret Astrophys, Zentrum Astron, D-69120 Heidelberg, Germany. [Choi, Jun-Hwan] Univ Texas Austin, Dept Astron, Austin, TX 78712 USA. [Feldmann, Robert] Univ Calif Berkeley, Dept Astron, Berkeley, CA 94720 USA. [Feldmann, Robert] McMaster Univ, Dept Phys & Astron, Hamilton, ON L8S 4M1, Canada. [Keller, Ben W.] UPMC Univ Paris 6, Sorbonne Univ, Inst Astrophys Paris, F-75014 Paris, France. [Lupi, Alessandro] Univ Washington, Dept Astron, Seattle, WA 98195 USA. [Quinn, Thomas] Ecole Polytechn Federale Lausanne, Inst Phys, Lab Astrophys, CH-1015 Lausanne, Switzerland. [Revaz, Yves] Ctr Particle Astrophys, Fermi Natl Accelerator Lab, Batavia, IL 60510 USA. [Gnedin, Nickolay Y.] Univ Chicago, Dept Astron & Astrophys, Chicago, IL 60637 USA. [Gnedin, Nickolay Y.] Univ Chicago, Kavli Inst Cosmol Phys, Chicago, IL 60637 USA. [Gnedin, Nickolay Y.] Univ Maryland, Dept Astron, College Pk, MD 20742 USA. [Gnedin, Nickolay Y.] Univ Cambridge, Kavli Inst Cosmol, Cambridge CB3 0HA, England. [Leitner, Samuel N.] Univ Edinburgh, Inst Astron, Royal Observ, Edinburgh EH9 3HJ, Midlothian, Scotland. [Shen, Sijing] Univ Illinois, Natl Ctr Supercomp Applicat, Urbana, IL 61801 USA. [Smith, Britton D.] Univ Illinois, Sch Informat Sci, Dept Astron, Urbana, IL 61801 USA. [Thompson, Robert] New Mexico State Univ, Dept Astron, Las Cruces, NM 88001 USA. [Turk, Matthew J.] Rochester Inst Technol, Sch Phys & Astron, Rochester, NY 14623 USA. [Arraki, Kenza S.] Hebrew Univ Jerusalem, Racah Inst Phys, Ctr Astrophy & Planetary Sci, IL-91904 Jerusalem, Israel. [Benincasa, Samantha M.] Univ Michigan, Dept Astron, Ann Arbor, MI 48109 USA. [Dekel, Avishai] Univ Calif Santa Cruz, Dept Astron & Astrophys, Santa Cruz, CA 95064 USA. [Li, Hui] Yale Univ, Dept Astron, New Haven, CT 06520 USA. [Madau, Piero] Osaka Univ, Grad Sch Sci, Dept Earth & Space Sci, Toyonaka, Osaka 5600043, Japan. [Mandelker, Nir] Univ Nevada, Dept Phys & Astron, Las Vegas, NV 89154 USA. [Nagamine, Kentaro] Michigan State Univ, Dept Computat Math, Dept Phys & Astron, Natl Supercond Cyclotron Lab, Lansing, MI 48824 USA. [Nagamine, Kentaro] Univ Calif Santa Cruz, Dept Phys, Santa Cruz, CA 95064 USA. [O'Shea, Brian W.] Heidelberger Inst Theoret Studien, D-69118 Heidelberg, Germany. [Primack, Joel R.] Univ Kansas, Dept Phys & Astron, Lawrence, KS 66045 USA. [Wise, John H.] Georgia Inst Technol, Sch Phys, Ctr Relativist Astrophys, Atlanta, GA 30332 USA. RP Kim, JH (reprint author), SLAC Natl Accelerator Lab, Kavli Inst Particle Astrophys & Cosmol, Menlo Pk, CA 94025 USA.; Kim, JH (reprint author), Stanford Univ, Dept Phys, Stanford, CA 94305 USA.; Kim, JH (reprint author), CALTECH, Dept Astron, Pasadena, CA 91125 USA. EM me@jihoonkim.org OI Feldmann, Robert/0000-0002-1109-1919; Turk, Matthew/0000-0002-5294-0198; Keller, Ben/0000-0002-9642-7193 FU University of California High-Performance AstroComputing Center (UC-HiPACC); Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231]; NASA through an Einstein Postdoctoral Fellowship [PF4-150147]; Moore Center for Theoretical Cosmology and Physics at Caltech; National Science Foundation (NSF) [ACI-1053575]; STFC consolidated grant [ST/M000990/1]; Swedish Research Council [2014-5791]; European Research Council (ERC) via the ERC Advanced Grant STARLIGHT Project [339177]; NASA through Hubble Fellowship grant [HF2-51304.001-A]; Space Telescope Science Institute; Association of Universities for Research in Astronomy, Inc., for NASA [NAS 5-26555]; NASA ATP grant [12-ATP-120183]; ERC Project [267117]; NSF [AST-1514868, AST-1311956, ACI-1535651, AST-1517488, AST-1229745, AST-1333360, AST-1614333]; NASA Hubble grant [HST-AR-13264]; Gordon and Betty Moore Foundation's Data-Driven Discovery Initiative [GBMF4561]; Kavli Foundation; NASA [NNX12AF87G, NNX12AC98G, NNX15AP39G]; JSPS KAKENHI [JP26247022]; NASA Hubble theory grants [HST-AR-13261.01-A, HST-AR-14315.001-A, HST-AR-13895, HST-AR-14326]; STScI [HST-GO-12060.12-A-004]; ERC under ERC-StG grant [EXAGAL-308037]; Klaus Tschira Foundation; computational team at SLAC National Accelerator Laboratory FX The authors of this paper thank the members of the AGORA Collaboration who are not on the author list but have provided helpful suggestions throughout the progress of the paper, including John Forbes. We also thank Volker Springel for providing the original versions of GADGET-3 and MAKEDISK to be used in the AGORA Project. We gratefully acknowledge the financial and logistical support from the University of California High-Performance AstroComputing Center (UC-HiPACC) during the annual AGORA Workshops held at the University of California Santa Cruz from 2012 to 2016. This research also used resources of the National Energy Research Scientific Computing Center (NERSC), a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. The publicly available ENZO and yt codes used in this work are the products of collaborative efforts by many independent scientists from numerous institutions around the world. Their commitment to open science has helped make this work possible. Ji-hoon Kim acknowledges support from NASA through an Einstein Postdoctoral Fellowship, grant PF4-150147, and support from the Moore Center for Theoretical Cosmology and Physics at Caltech. A part of his computing time was provided by Extreme Science and Engineering Discovery Environment (XSEDE) allocation TG-AST140064. XSEDE is supported by National Science Foundation (NSF) grant No. ACI-1053575. He is also grateful for the support from the computational team at SLAC National Accelerator Laboratory during the usage of the clusters for the simulation analysis. Oscar Agertz acknowledges support from STFC consolidated grant ST/M000990/1 and the Swedish Research Council grant 2014-5791. Daniel Ceverino acknowledges support from the European Research Council (ERC) via the ERC Advanced Grant STARLIGHT Project No. 339177. Robert Feldmann acknowledges support in part by NASA through Hubble Fellowship grant HF2-51304.001-A awarded by the Space Telescope Science Institute, which is operated by the Association of Universities for Research in Astronomy, Inc., for NASA, under contract NAS 5-26555, in part by the Theoretical Astrophysics Center at UC Berkeley, and by NASA ATP grant 12-ATP-120183. Alessandro Lupi acknowledges support by the ERC Project No. 267117 (PI J. Silk). Tom Quinn acknowledges partial support by the NSF through grants No. AST-1514868 and AST-1311956 and NASA Hubble grant HST-AR-13264. CHANGA simulations where run on resources provided by XSEDE and NASA Pleiades. Robert Thompson, Matthew Turk and Nathan Goldbaum acknowledge support by the Gordon and Betty Moore Foundation's Data-Driven Discovery Initiative through grant GBMF4561 (PI M. Turk), and by the NSF through grant No. ACI-1535651. Tom Abel acknowledges partial support by the Kavli Foundation. Sukanya Chakrabarti acknowledges support by the NSF through grant No. AST-1517488. Piero Madau acknowledges support by the NSF through grant No. AST-1229745 and by NASA through grant NNX12AF87G. Kentaro Nagamine and Ikkoh Shimizu acknowledge support from the JSPS KAKENHI grant No. JP26247022. Some of the GADGET-3 simulations were carried out on the XC30 machine at the Center for Computational Astrophysics, National Astronomical Observatory of Japan. Brian O'Shea acknowledges support from NASA through grants NNX12AC98G, NNX15AP39G, and NASA Hubble theory grants HST-AR-13261.01-A and HST-AR-14315.001-A.; He was also supported in part by the sabbatical visitor program at the Michigan Institute for Research in Astrophysics at the University of Michigan in Ann Arbor, and gratefully acknowledges their hospitality. Joel Primack acknowledges support from STScI through grant HST-GO-12060.12-A-004, and NASA Advanced Supercomputing for Pleiades time on which ART-I simulations were run. Christine Simpson acknowledges support from the ERC under ERC-StG grant EXAGAL-308037 and from the Klaus Tschira Foundation. John Wise acknowledges support by the NSF through grants No. AST-1333360 and AST-1614333 and NASA Hubble theory grants HST-AR-13895 and HST-AR-14326. NR 104 TC 0 Z9 0 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 20 PY 2016 VL 833 IS 2 AR 202 DI 10.3847/1538-4357/833/2/202 PG 34 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG6PY UT WOS:000391169600077 ER PT J AU Mumpower, MR McLaughlin, GC Surman, R Steiner, AW AF Mumpower, Matthew R. McLaughlin, Gail C. Surman, Rebecca Steiner, Andrew W. TI THE LINK BETWEEN RARE-EARTH PEAK FORMATION AND THE ASTROPHYSICAL SITE OF THE R PROCESS SO ASTROPHYSICAL JOURNAL LA English DT Article DE nuclear reactions; nucleosynthesis; abundances ID NEUTRON-STAR MERGERS; PROCESS NUCLEOSYNTHESIS; EARLY GALAXY; PROCESS ELEMENTS; REACTION-RATES; DWARF GALAXY; ABUNDANCES; EVOLUTION; EJECTA; SIMULATIONS AB The primary astrophysical source of the rare-earth elements is the rapid neutron capture process (r process). The rare-earth peak that is seen in the solar r-process residuals has been proposed to originate as a pile-up of nuclei during the end of the r process. We introduce a new method utilizing Monte Carlo studies of nuclear masses in the rare-earth region, that includes self-consistently adjusting beta-decay rates and neutron capture rates, to find the mass surfaces necessary for the formation of the rare-earth peak. We demonstrate our method with two types of astrophysical scenario, one corresponding to conditions typical of hot winds from core-collapse supernovae and stellar-mass accretion disks, and one corresponding to conditions typical of the ejection of the material from the tidal tails of neutron star mergers. In each type of astrophysical condition, this method successfully locates a region of enhanced stability in the mass surface that is responsible for the rare-earth peak. For each scenario, we find that the change in the mass surface has qualitatively different features, thus future measurements can shed light on the type of environment in which the r process occurred. C1 [Mumpower, Matthew R.] Los Alamos Natl Lab, Div Theory, Los Alamos, NM 87544 USA. [Mumpower, Matthew R.; Surman, Rebecca] Univ Notre Dame, Dept Phys, Notre Dame, IN 46556 USA. [McLaughlin, Gail C.] North Carolina State Univ, Dept Phys, Raleigh, NC 27695 USA. [Steiner, Andrew W.] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. [Steiner, Andrew W.] Oak Ridge Natl Lab, Div Phys, Oak Ridge, TN 37831 USA. RP Mumpower, MR (reprint author), Los Alamos Natl Lab, Div Theory, Los Alamos, NM 87544 USA.; Mumpower, MR (reprint author), Univ Notre Dame, Dept Phys, Notre Dame, IN 46556 USA. EM matthew@mumpower.net FU National Science Foundation [PHY1554876]; Joint Institute for Nuclear Astrophysics grant [PHY0822648, PHY1419765]; U.S. Department of Energy [DE-SC0013039, DE-FG02-02ER41216]; National Nuclear Security Administration of the U.S. Department of Energy at Los Alamos National Laboratory [DE-AC52-06NA25396] FX This work was supported in part by the National Science Foundation through grant number PHY1554876 (A.W.S.) and the Joint Institute for Nuclear Astrophysics grant numbers PHY0822648 and PHY1419765 (M.M.), and the U.S. Department of Energy under grant numbers DE-SC0013039 (R.S.) and DE-FG02-02ER41216 (G.C.M.). A portion of this work was also carried out under the auspices of the National Nuclear Security Administration of the U.S. Department of Energy at Los Alamos National Laboratory under Contract No. DE-AC52-06NA25396 (M.M.). NR 53 TC 2 Z9 2 U1 5 U2 5 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 20 PY 2016 VL 833 IS 2 AR 282 DI 10.3847/1538-4357/833/2/282 PG 6 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG6PY UT WOS:000391169600157 ER PT J AU Reisenfeld, DB Bzowski, M Funsten, HO Fuselier, SA Galli, A Janzen, PH Karna, N Kubiak, MA McComas, DJ Schwadron, NA Sokol, JM AF Reisenfeld, D. B. Bzowski, M. Funsten, H. O. Fuselier, S. A. Galli, A. Janzen, P. H. Karna, N. Kubiak, M. A. McComas, D. J. Schwadron, N. A. Sokol, J. M. TI TRACKING THE SOLAR CYCLE THROUGH IBEX OBSERVATIONS OF ENERGETIC NEUTRAL ATOM FLUX VARIATIONS AT THE HELIOSPHERIC POLES SO ASTROPHYSICAL JOURNAL LA English DT Article DE ISM: general; magnetohydrodynamics (MHD); plasmas; solar wind; Sun: heliosphere ID INTERSTELLAR-BOUNDARY-EXPLORER; 1ST 5 YEARS; TERMINATION SHOCK; OUTER HELIOSPHERE; MAGNETIC-FIELD; WIND; HELIOSHEATH; RIBBON; HYDROGEN; SPECTRA AB With seven years of Interstellar Boundary Explorer (IBEX) observations, from 2009 to 2015, we can now trace the time evolution of heliospheric energetic neutral atoms (ENAs) through over half a solar cycle. At the north and south ecliptic poles, the spacecraft attitude allows for continuous coverage of the ENA flux; thus, signal from these regions has much higher statistical accuracy and time resolution than anywhere else in the sky. By comparing the solar wind dynamic pressure measured at 1 au with the heliosheath plasma pressure derived from the observed ENA fluxes, we show that the heliosheath pressure measured at the poles correlates well with the solar cycle. The analysis requires time-shifting the ENA measurements to account for the travel time out and back from the heliosheath, which allows us to estimate the scale size of the heliosphere in the polar directions. We arrive at an estimated distance to the center of the ENA source region in the north of 220 au. and in the south. a distance of 190 au. We also find a good correlation between the solar cycle and the ENA energy spectra at the poles. In particular, the ENA flux for the highest IBEX energy channel (4.3 keV) is quite closely correlated with the areas of the polar coronal holes, in both the north and south, consistent with the notion that polar ENAs at this energy originate from pickup ions of the very high speed wind (similar to 700 km s(-1)) that emanates from polar coronal holes. C1 [Reisenfeld, D. B.; Janzen, P. H.] Univ Montana, Missoula, MT 59812 USA. [Bzowski, M.; Kubiak, M. A.; Sokol, J. M.] Polish Acad Sci CBK PAN, Space Res Ctr, Bartycka 18A, PL-00716 Warsaw, Poland. [Funsten, H. O.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Fuselier, S. A.] Southwest Res Inst, San Antonio, TX 78228 USA. [Fuselier, S. A.] Univ Texas San Antonio, San Antonio, TX 78228 USA. [Galli, A.] Univ Bern, Inst Phys, CH-3012 Bern, Switzerland. [Karna, N.] George Mason Univ, Fairfax, VA 22306 USA. [Karna, N.] NASA, Goddard Space Flight Ctr, Greenbelt, MD USA. [McComas, D. J.] Princeton Univ, Peyton Hall, Princeton, NJ 08544 USA. [Schwadron, N. A.] Univ New Hampshire, Ctr Space Sci, Durham, NH 03824 USA. RP Reisenfeld, DB (reprint author), Univ Montana, Missoula, MT 59812 USA. EM dan.reisenfeld@umontana.edu; bzowski@cbk.waw.pl; hfunsten@lanl.gov; sfuselier@swri.edu; andre.galli@space.unibe.ch; paul.janzen@umontana.edu; nkarna@masonlive.gmu.edu; mkubiak@cbk.waw.pl; dmccomas@prineeton.edu; n.schwadron@unh.edu; jsokol@cbk.waw.pl RI Sokol, Justyna/K-2892-2015; OI Galli, Andre/0000-0003-2425-3793 FU NASA's Explorer Program; US Department of Energy; National Science Center, Poland [2015-19-B-ST9-01328]; Schlumberger Foundation Faculty for the Future Program FX We give our sincere thanks to all of the outstanding professionals who have made the IBEX mission a success. We would also like to thank Dr. John Steinberg for productive conversations regarding the latitude dependence of the ENA energy spectra, and the reviewer for very substantive and thoughtful comments. This work was carried out as part of NASA's IBEX Mission, with support from NASA's Explorer Program. Work at Los Alamos was performed under the auspices of the US Department of Energy. M.B., M.A.K. and J.M.S. acknowledge the support by the grant 2015-19-B-ST9-01328 from the National Science Center, Poland. N.K. is supported by the Schlumberger Foundation Faculty for the Future Program. NR 60 TC 1 Z9 1 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 20 PY 2016 VL 833 IS 2 AR 277 DI 10.3847/1538-4357/833/2/277 PG 15 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG6PY UT WOS:000391169600152 ER PT J AU Wilson, ML Zabludoff, AT Ammons, SM Momcheva, IG Williams, KA Keetons, CR AF Wilson, Michelle L. Zabludoff, Ann T. Ammons, S. Mark Momcheva, Ivelina G. Williams, Kurtis A. Keetons, Charles R. TI A SPECTROSCOPIC SURVEY OF THE FIELDS OF 28 STRONG GRAVITATIONAL LENSES: THE GROUP CATALOG SO ASTROPHYSICAL JOURNAL LA English DT Article DE catalogs; galaxies: groups: general; gravitational lensing: strong ID DIGITAL SKY SURVEY; GALAXY GROUP CONNECTION; DISTANT CLUSTER SURVEY; REDSHIFT SURVEY; COSMIC TELESCOPES; SAMPLE DEFINITION; DATA RELEASE; MASS; SDSS; ENVIRONMENTS AB With a large, unique spectroscopic survey in the fields of 28 galaxy-scale strong gravitational lenses, we identify groups of galaxies in the 26 adequately sampled fields. Using a group-finding algorithm, we find 210 groups with at least 5 member galaxies; the median number of members is 8. Our sample spans redshifts of 0.04 <= z(grp) <= 0.76 with a median of 0.31, including 174 groups with 0.1 < z(grp) < 0.6 The groups have radial velocity dispersions of 60 <= sigma(grp) <= 1200 km s(-1) with a median of 350 km s(-1). We also discover a supergroup in field B0712+472 at z = 0.29 that consists of three main groups. We recover groups similar to similar to 85% of those previously reported in these fields within our redshift range of sensitivity and find 187 new groups with at least five members. The properties of our group catalog, specifically, (1) the distribution of sgrp, (2) the fraction of all sample galaxies that are group members, and (3) the fraction of groups with significant substructure, are consistent with those for other catalogs. The distribution of group virial masses agrees well with theoretical expectations. Of the lens galaxies, 12 of 26 (46%) (B1422+231, B1600+434, B2114+022, FBQS J0951+2635, HE0435-1223, HST J14113+5211, MG0751+2716, MGJ1654+1346, PG 1115+080, Q ER 0047-2808, RXJ1131-1231, and WFI J2033-4723) are members of groups with at least five galaxies, and one more (B0712+472) belongs to an additional, visually identified group candidate. There are groups not associated with the lens that still are likely to affect the lens model; in six of 25 (24%) fields (excluding the supergroup), there is at least one massive (sigma(grp) >= 500 km s(-1)) group or group candidate projected within 2' of the lens. C1 [Wilson, Michelle L.; Zabludoff, Ann T.] Univ Arizona, Steward Observ, 933 North Cherry Ave, Tucson, AZ 85721 USA. [Ammons, S. Mark] Lawrence Livermore Natl Lab, Phys Div L-210,7000 East Ave, Livermore, CA 94550 USA. [Momcheva, Ivelina G.] Space Telescope Sci Inst, 3700 San Martin Dr, Baltimore, MD 21218 USA. [Williams, Kurtis A.] Texas A&M Univ Commerce, Dept Phys & Astron, Commerce, TX 75428 USA. [Keetons, Charles R.] Rutgers State Univ, Dept Phys & Astron, 136 Frelinghuysen Rd, Piscataway, NJ 08854 USA. RP Wilson, ML (reprint author), Univ Arizona, Steward Observ, 933 North Cherry Ave, Tucson, AZ 85721 USA. OI Williams, Kurtis/0000-0002-1413-7679 FU NASA [ADP-NNX10AD476, ADP-NNX10AE88G, NAS5-26555]; NSF [AST-0908280, AST-1211385]; Technology and Research Initiative Fund (TRIF) Imaging Fellowship program; NASA from the Space Telescope Science Institute [HST-HF-51250.01-A]; U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344] FX We thank the anonymous referee for helpful comments. We also thank Dan Marrone, George Rieke, Dennis Zaritsky, and K. Decker French for helpful discussions. M.L.W. and A.I.Z. acknowledge support from NASA grants ADP-NNX10AD476 and ADP-NNX10AE88G, as well as NSF grant AST-0908280. M.L.W. also thanks the Technology and Research Initiative Fund (TRIF) Imaging Fellowship program for its support. S.M.A. thanks NASA through Hubble Fellowship grant HST-HF-51250.01-A from the Space Telescope Science Institute, which is operated by the Association of Universities for Research in Astronomy, Incorporated under NASA contract NAS5-26555. Portions of this work were performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. C.R.K. acknowledges support from NSF grant AST-1211385. NR 80 TC 1 Z9 1 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 20 PY 2016 VL 833 IS 2 AR 194 DI 10.3847/1538-4357/833/2/194 PG 23 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG6PY UT WOS:000391169600069 ER PT J AU Ibrahim, YM Garimella, SVB Prost, SA Wojcik, R Norheim, RV Baker, ES Rusyn, I Smith, RD AF Ibrahim, Yehia M. Garimella, Sandilya V. B. Prost, Spencer A. Wojcik, Roza Norheim, Randolph V. Baker, Erin S. Rusyn, Ivan Smith, Richard D. TI Development of an Ion Mobility Spectrometry-Orbitrap Mass Spectrometer Platform SO ANALYTICAL CHEMISTRY LA English DT Article ID PLASMA CHROMATOGRAPHY; FIELD; PETROLEOMICS; INSTRUMENT; PROTEOMICS; IMS AB Complex samples benefit from multidimensional measurements where higher resolution enables more complete characterization of biological and environmental systems. To address this challenge, we developed a drift tube-based ion mobility spectrometry-Orbitrap mass spectrometer (IMS-Orbitrap MS) platform. To circumvent the time scale disparity between the fast IMS separation and the much slower Orbitrap MS acquisition, we utilized a dual gate and pseudorandom sequences to multiplex the injection of ions and allow operation in signal averaging (SA), single multiplexing (SM), and double multiplexing (DM) IMS modes to optimize the signal-to-noise ratio of the measurements. For the SM measurements, a previously developed algorithm was used to reconstruct the IMS data. A new algorithm was developed for the DM analyses involving a two-step process that first recovers the SM data and then decodes the SM data. The algorithm also performs multiple refining procedures to minimize demultiplexing artifacts. The new IMS-Orbitrap MS platform was demonstrated by the analysis of proteomic and petroleum samples, where the integration of IMS and high mass resolution proved essential for accurate assignment of molecular formulas. C1 [Ibrahim, Yehia M.; Garimella, Sandilya V. B.; Prost, Spencer A.; Wojcik, Roza; Norheim, Randolph V.; Baker, Erin S.; Smith, Richard D.] Pacific Northwest Natl Lab, Biol Sci Div, POB 999, Richland, WA 99352 USA. [Rusyn, Ivan] Texas A&M Univ, Dept Vet Integrat Biosci, College Stn, TX 77843 USA. RP Ibrahim, YM (reprint author), Pacific Northwest Natl Lab, Biol Sci Div, POB 999, Richland, WA 99352 USA. EM yehia.ibrahim@pnnl.gov RI Smith, Richard/J-3664-2012; OI Smith, Richard/0000-0002-2381-2349; Garimella, Sandilya Venkata Bhaskara/0000-0001-6649-9842 FU Laboratory Directed Research and Development Program at Pacific Northwest National Laboratory; U.S. Department of Energy Office of Biological and Environmental Research Genome Sciences Program under Panomics Program; National Institutes of Health (NIH) NIGMS Proteomics Research Resource [P41 GM103493]; NIEHS [R01 ES022190]; DOE [DE-AC05-76RL0 1830] FX We would like to thank Drs. Satendra Prasad, Jean-Jacques Dunyach, and Alexander Makarov from Thermo Scientific for their help in the integration with the Exactive Orbitrap MS, and David Stranz from Sierra Analytics, Inc. for allowing us to utilize the Composer software. This research was partially supported by the Laboratory Directed Research and Development Program at Pacific Northwest National Laboratory, and by the U.S. Department of Energy Office of Biological and Environmental Research Genome Sciences Program under the Panomics Program, National Institutes of Health (NIH) NIGMS Proteomics Research Resource under grant P41 GM103493, and NIEHS (R01 ES022190). Work was performed at the W. R. Wiley Environmental Molecular Sciences Laboratory (EMSL), a DOE national scientific user facility at the Pacific Northwest National Laboratory (PNNL). PNNL is operated by Battelle for the DOE under contract DE-AC05-76RL0 1830. NR 40 TC 0 Z9 0 U1 10 U2 10 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0003-2700 EI 1520-6882 J9 ANAL CHEM JI Anal. Chem. PD DEC 20 PY 2016 VL 88 IS 24 BP 12152 EP 12160 DI 10.1021/acs.analchem.6b03027 PG 9 WC Chemistry, Analytical SC Chemistry GA EF8ZR UT WOS:000390621000027 PM 28193022 ER PT J AU Gates, SD Cassata, WS AF Gates, Sean D. Cassata, William S. TI Application of the Uranium-Helium Chronometer to the Analysis of Nuclear Forensic Materials SO ANALYTICAL CHEMISTRY LA English DT Article ID HEAT-TRANSFER AGENTS; STOPPING DISTANCES; INERT-GASES; SOLUBILITY; DIFFUSION AB Radiochronometers are used to constrain the manufacturing and processing history of actinide materials for nuclear forensic investigations. This paper describes U He ages and He diffusion kinetics obtained from a metallic, highly enriched uranium sample. The average U He age is 8% older than the known casting date, which indicates that excess He is present and is likely due to incomplete degassing of pre-existing He during the casting process. Although the U He age is older than expected, the accuracy is comparable to other chronometers that have been applied to this material. Diffusion kinetics obtained from the uranium metal indicate that He is quantitatively retained under plausible storage conditions. C1 [Gates, Sean D.; Cassata, William S.] Lawrence Livermore Natl Lab, Nucl & Chem Sci Div, Livermore, CA 94551 USA. RP Gates, SD (reprint author), Lawrence Livermore Natl Lab, Nucl & Chem Sci Div, Livermore, CA 94551 USA. EM gates24@llnl.gov FU U.S. Department of Energy [DE-AC52-07NA27344]; Laboratory Directed Research and Development funding [16FS025] FX This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under contract DE-AC52-07NA27344 with Laboratory Directed Research and Development funding (16FS025). NR 23 TC 0 Z9 0 U1 6 U2 6 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0003-2700 EI 1520-6882 J9 ANAL CHEM JI Anal. Chem. PD DEC 20 PY 2016 VL 88 IS 24 BP 12310 EP 12315 DI 10.1021/acs.analchem.6b03502 PG 6 WC Chemistry, Analytical SC Chemistry GA EF8ZR UT WOS:000390621000048 PM 28193025 ER PT J AU Bingol, K Li, DW Zhang, B Bruschweiler, R AF Bingol, Kerem Li, Da-Wei Zhang, Bo Bruschweiler, Rafael TI Comprehensive Metabolite Identification Strategy Using Multiple Two-Dimensional NMR Spectra of a Complex Mixture Implemented in the COLMARm Web Server SO ANALYTICAL CHEMISTRY LA English DT Article ID NUCLEAR-MAGNETIC-RESONANCE; METABOLOMICS DATABASE; CORRELATION SPECTROSCOPY; QUANTITATIVE-ANALYSIS; COHERENCE TRANSFER; BLOOD-PLASMA; STANDARDS; URINE; SERUM; TOCSY AB Identification of metabolites in complex mixtures represents a key step in metabolomics. A new strategy is introduced, which is implemented in a new public web server, COLMARm, that permits the coanalysis of up to three two-dimensional (2D) NMR spectra, namely, C-13-H-1 HSQC (heteronuclear single quantum coherence spectroscopy), H-1-H-1 TOCSY (total correlation spectroscopy), and C-13-H-1 HSQC-TOCSY, for the comprehensive, accurate, and efficient performance of this task. The highly versatile and interactive nature of COLMARm permits its application to a wide range of metabolomics samples independent of the magnetic field. Database query is performed using the HSQC spectrum, and the top metabolite hits are then validated against the TOCSY-type experiment(s) by superimposing the expected cross-peaks on the mixture spectrum. In this way the user can directly accept or reject candidate metabolites by taking advantage of complementary spectral information offered by these experiments and their different sensitivities. The power of COLMARm is demonstrated for a human serum sample uncovering the existence of 14 metabolites that hitherto were not identified by NMR. C1 [Bingol, Kerem] Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA 99354 USA. [Li, Da-Wei; Bruschweiler, Rafael] Ohio State Univ, Campus Chem Instrument Ctr, Columbus, OH 43210 USA. [Zhang, Bo; Bruschweiler, Rafael] Ohio State Univ, Dept Chem & Biochem, Columbus, OH 43210 USA. [Bruschweiler, Rafael] Ohio State Univ, Dept Biol Chem & Pharmacol, Columbus, OH 43210 USA. RP Bruschweiler, R (reprint author), Ohio State Univ, Campus Chem Instrument Ctr, Columbus, OH 43210 USA.; Bruschweiler, R (reprint author), Ohio State Univ, Dept Chem & Biochem, Columbus, OH 43210 USA.; Bruschweiler, R (reprint author), Ohio State Univ, Dept Biol Chem & Pharmacol, Columbus, OH 43210 USA. EM bruschweiler.1@osu.edu RI Li, Da-Wei/F-7233-2010 OI Li, Da-Wei/0000-0002-3266-5272 FU National Institutes of Health [R01 GM 066041]; National Institutes of Health [SECIM (Southeast Center for Integrated Metabolomics)] [U24 DK097209-01A1] FX This work was supported by the National Institutes of Health [Grant R01 GM 066041 and SECIM (Southeast Center for Integrated Metabolomics) Grant U24 DK097209-01A1]. NR 45 TC 0 Z9 0 U1 7 U2 7 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0003-2700 EI 1520-6882 J9 ANAL CHEM JI Anal. Chem. PD DEC 20 PY 2016 VL 88 IS 24 BP 12411 EP 12418 DI 10.1021/acs.analchem.6b03724 PG 8 WC Chemistry, Analytical SC Chemistry GA EF8ZR UT WOS:000390621000061 PM 28193069 ER PT J AU Bewg, WP Poovaiah, C Lan, W Ralph, J Coleman, HD AF Bewg, William P. Poovaiah, Charleson Lan, Wu Ralph, John Coleman, Heather D. TI RNAi downregulation of three key lignin genes in sugarcane improves glucose release without reduction in sugar production SO BIOTECHNOLOGY FOR BIOFUELS LA English DT Article DE Lignin biosynthesis; Ferulate 5-hydroxylase; Caffeic acid O-methyltransferase; Caffeoyl-CoA O-methyltransferase; Sugarcane; RNAi ID ALFALFA MEDICAGO-SATIVA; A O-METHYLTRANSFERASE; CAFFEIC ACID 3-O-METHYLTRANSFERASE; CELL-WALL COMPOSITION; BROWN-MIDRIB MUTANTS; BIOFUEL PRODUCTION; 5-HYDROXYCONIFERYL ALCOHOL; MONOLIGNOL BIOSYNTHESIS; REDUCES RECALCITRANCE; TRANSGENIC POPLARS AB Background: Sugarcane is a subtropical crop that produces large amounts of biomass annually. It is a key agricultural crop in many countries for the production of sugar and other products. Residual bagasse following sucrose extraction is currently underutilized and it has potential as a carbohydrate source for the production of biofuels. As with all lignocellulosic crops, lignin acts as a barrier to accessing the polysaccharides, and as such, is the focus of transgenic efforts. In this study, we used RNAi to individually reduce the expression of three key genes in the lignin biosynthetic pathway in sugarcane. These genes, caffeoyl-CoA O-methyltransferase (CCoAOMT), ferulate 5-hydroxylase (F5H) and caffeic acid O-methyltransferase (COMT), impact lignin content and/or composition. Results: For each RNAi construct, we selected three events for further analysis based on qRT-PCR results. For the CCoAOMT lines, there were no lines with a reduction in lignin content and only one line showed improved glucose release. For F5H, no lines had reduced lignin, but one line had a significant increase in glucose release. For COMT, one line had reduced lignin content, and this line and another released higher levels of glucose during enzymatic hydrolysis. Two of the lines with improved glucose release (F5H-2 and COMT-2) also had reduced S:G ratios. Conclusions: Along with improvements in bagasse quality for the production of lignocellulosic-based fuels, there was only one line with reduction in juice sucrose extraction, and three lines with significantly improved sucrose production, providing evidence that the alteration of sugarcane for improved lignocellulosic ethanol production can be achieved without negatively impacting sugar production and perhaps even enhancing it. C1 [Bewg, William P.] Queensland Univ Technol, Brisbane, Qld 4000, Australia. [Poovaiah, Charleson; Coleman, Heather D.] Syracuse Univ, Dept Biol, Syracuse, NY 13244 USA. [Lan, Wu] Univ Wisconsin, Dept Biol Syst Engn, Madison, WI USA. [Lan, Wu; Ralph, John] Univ Wisconsin, US DOE, GLBRC, Wisconsin Energy Inst, Madison, WI 53726 USA. [Ralph, John] Univ Wisconsin, Dept Biochem, Madison, WI 53726 USA. RP Coleman, HD (reprint author), Syracuse Univ, Dept Biol, Syracuse, NY 13244 USA. EM hcoleman@syr.edu OI Coleman, Heather/0000-0002-4923-601X; Poovaiah, Charleson/0000-0001-7157-5176 FU Australian Research Council Discovery Program; Natural Sciences Engineering and Research Council; Sugar Research and Development Corporation (Sugar Research Australia) Scholarship Program; DOE Great Lakes Bioenergy Research Center (DOE BER Office of Science) [DE-FC02-07ER64494] FX This study was funded by the Australian Research Council Discovery Program (HDC), the Natural Sciences Engineering and Research Council (HDC) and the Sugar Research and Development Corporation (Sugar Research Australia) Scholarship Program (WPB). WL and JR were funded by the DOE Great Lakes Bioenergy Research Center (DOE BER Office of Science DE-FC02-07ER64494). NR 72 TC 0 Z9 0 U1 2 U2 2 PU BIOMED CENTRAL LTD PI LONDON PA 236 GRAYS INN RD, FLOOR 6, LONDON WC1X 8HL, ENGLAND SN 1754-6834 J9 BIOTECHNOL BIOFUELS JI Biotechnol. Biofuels PD DEC 20 PY 2016 VL 9 AR 270 DI 10.1186/s13068-016-0683-y PG 13 WC Biotechnology & Applied Microbiology; Energy & Fuels SC Biotechnology & Applied Microbiology; Energy & Fuels GA EG0IZ UT WOS:000390716700001 PM 28031745 ER PT J AU Lux, M Kruger, J Rinke, C Maus, I Schluter, A Woyke, T Sczyrba, A Hammer, B AF Lux, Markus Krueger, Jan Rinke, Christian Maus, Irena Schlueter, Andreas Woyke, Tanja Sczyrba, Alexander Hammer, Barbara TI acdc - Automated Contamination Detection and Confidence estimation for single-cell genome data SO BMC BIOINFORMATICS LA English DT Article DE Single-cell sequencing; Contamination detection; Machine learning; Clustering; Binning; Quality control ID T-SNE; BACTERIA; SEQUENCE AB Background: A major obstacle in single-cell sequencing is sample contamination with foreign DNA. To guarantee clean genome assemblies and to prevent the introduction of contamination into public databases, considerable quality control efforts are put into post-sequencing analysis. Contamination screening generally relies on reference-based methods such as database alignment or marker gene search, which limits the set of detectable contaminants to organisms with closely related reference species. As genomic coverage in the tree of life is highly fragmented, there is an urgent need for a reference-free methodology for contaminant identification in sequence data. Results: We present acdc, a tool specifically developed to aid the quality control process of genomic sequence data. By combining supervised and unsupervised methods, it reliably detects both known and de novo contaminants. First, 16S rRNA gene prediction and the inclusion of ultrafast exact alignment techniques allow sequence classification using existing knowledge from databases. Second, reference-free inspection is enabled by the use of state-of-the-art machine learning techniques that include fast, non-linear dimensionality reduction of oligonucleotide signatures and subsequent clustering algorithms that automatically estimate the number of clusters. The latter also enables the removal of any contaminant, yielding a clean sample. Furthermore, given the data complexity and the ill-posedness of clustering, acdc employs bootstrapping techniques to provide statistically profound confidence values. Tested on a large number of samples from diverse sequencing projects, our software is able to quickly and accurately identify contamination. Results are displayed in an interactive user interface. Acdc can be run from the web as well as a dedicated command line application, which allows easy integration into large sequencing project analysis workflows. Conclusions: Acdc can reliably detect contamination in single-cell genome data. In addition to database-driven detection, it complements existing tools by its unsupervised techniques, which allow for the detection of de novo contaminants. Our contribution has the potential to drastically reduce the amount of resources put into these processes, particularly in the context of limited availability of reference species. As single-cell genome data continues to grow rapidly, acdc adds to the toolkit of crucial quality assurance tools. C1 [Lux, Markus] Univ Bielefeld, Computat Methods Anal Div & Dynam Genomes, Univ Str 25, D-33615 Bielefeld, Germany. [Krueger, Jan; Maus, Irena; Schlueter, Andreas; Sczyrba, Alexander] Univ Bielefeld, Ctr Biotechnol CeBiTec, Univ Str 27, D-33615 Bielefeld, Germany. [Woyke, Tanja] DOE Joint Genome Inst, 2800 Mitchell Dr, Walnut Creek, CA 94598 USA. [Hammer, Barbara] Univ Bielefeld, CITEC Ctr Excellence, Inspirat 1, D-33619 Bielefeld, Germany. [Rinke, Christian] Univ Queensland, Australian Ctr Ecogen, St Lucia, Qld 4072, Australia. RP Lux, M (reprint author), Univ Bielefeld, Computat Methods Anal Div & Dynam Genomes, Univ Str 25, D-33615 Bielefeld, Germany. EM mlux@techfak.uni-bielefeld.de FU U.S. Department of Energy Joint Genome Institute, a DOE Office of Science User Facility [DE-AC02-05CH11231] FX This contribution has been made possible through the German-Canadian DFG international research training group "Computational Methods for the Analysis of the Diversity and Dynamics of Genomes" (DiDy) GRK 1906/1. The work conducted by the U.S. Department of Energy Joint Genome Institute, a DOE Office of Science User Facility, is supported under Contract No. DE-AC02-05CH11231. NR 45 TC 0 Z9 0 U1 12 U2 12 PU BIOMED CENTRAL LTD PI LONDON PA 236 GRAYS INN RD, FLOOR 6, LONDON WC1X 8HL, ENGLAND SN 1471-2105 J9 BMC BIOINFORMATICS JI BMC Bioinformatics PD DEC 20 PY 2016 VL 17 AR 543 DI 10.1186/s12859-016-1397-7 PG 11 WC Biochemical Research Methods; Biotechnology & Applied Microbiology; Mathematical & Computational Biology SC Biochemistry & Molecular Biology; Biotechnology & Applied Microbiology; Mathematical & Computational Biology GA EG2YA UT WOS:000390908800002 PM 27998267 ER PT J AU Carriger, JF Barron, MG Newnian, MC AF Carriger, John F. Barron, Mace G. Newnian, Michael C. TI Bayesian Networks Improve Causal Environmental Assessments for Evidence-Based Policy SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID ECOLOGICAL RISK-ASSESSMENT; INFLUENCE DIAGRAMS; BELIEF NETWORKS; WIND FARMS; MANAGEMENT; PROBABILITY; UNCERTAINTY; JUDGMENT; CARCASS; OIL AB Rule-based weight of evidence approaches to ecological risk assessment may not account for uncertainties and generally lack probabilistic integration of lines of evidence. Bayesian networks allow causal inferences to be made from evidence by including causal knowledge about the problem, using this knowledge with probabilistic calculus to combine multiple lines of evidence, and minimizing biases in predicting or diagnosing causal relationships. Too often, sources of uncertainty in conventional weight of evidence approaches are ignored that can be accounted for with Bayesian networks. Specifying and propagating uncertainties improve the ability of models to incorporate strength of the evidence in the risk management phase of an assessment. Probabilistic inference from a Bayesian network allows evaluation of changes in uncertainty for variables from the evidence. The network structure and probabilistic framework of a Bayesian approach provide advantages over qualitative approaches in weight of evidence for capturing the impacts of multiple sources of quantifiable uncertainty on predictions of ecological risk. Bayesian networks can facilitate the development of evidence-based policy under conditions of uncertainty by incorporating analytical inaccuracies or the implications of imperfect information, structuring and communicating causal issues through qualitative directed graph formulations, and quantitatively comparing the causal power of multiple stressors on valued ecological resources. These aspects are demonstrated through hypothetical problem scenarios that explore some major benefits of using Bayesian networks for reasoning and making inferences in evidence-based policy. C1 [Carriger, John F.] US EPA, Oak Ridge Inst Sci & Educ, Off Res & Dev, Natl Hlth & Environm Effects Res Lab,Gulf Ecol Di, 1 Sabine Isl Dr, Gulf Breeze, FL 32561 USA. [Barron, Mace G.] US EPA, Off Res & Dev, Natl Hlth & Environm Effects Res Lab, Gulf Ecol Div, 1 Sabine Isl Dr, Gulf Breeze, FL 32561 USA. [Newnian, Michael C.] Virginia Inst Marine Sci, Coll William & Mary, POB 1346,Route 1208 Greate Rd, Gloucester Point, VA 23062 USA. RP Carriger, JF (reprint author), US EPA, Oak Ridge Inst Sci & Educ, Off Res & Dev, Natl Hlth & Environm Effects Res Lab,Gulf Ecol Di, 1 Sabine Isl Dr, Gulf Breeze, FL 32561 USA. EM carriger.john@epa.gov FU U.S. Environmental Protection Agency; U.S. Department of Energy FX This article is dedicated to Bonnie Carriger. This research was supported in part by an appointment to the ORISE participant research program through an interagency agreement between the U.S. Environmental Protection Agency and the U.S. Department of Energy. The views expressed in this article are those of the authors and do not necessarily reflect the views or policies of the U.S. Environmental Protection Agency. M.C. Newman was the A. Marshall Acuff Jr. Professor of Marine Science during the tenure of this study. NR 54 TC 0 Z9 0 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 20 PY 2016 VL 50 IS 24 BP 13195 EP 13205 DI 10.1021/acs.est.6b03220 PG 11 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EF8ZQ UT WOS:000390620900004 PM 27993076 ER PT J AU Liu, YR Lu, X Zhao, LD An, J He, JZ Pierce, EM Johs, A Gu, BH AF Liu, Yu-Rong Lu, Xia Zhao, Linduo An, Jing He, Ji-Zheng Pierce, Eric M. Johs, Alexander Gu, Baohua TI Effects of Cellular Sorption on Mercury Bioavailability and Methylmercury Production by Desulfovibrio desulfuricans ND132 SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID GEOBACTER-SULFURREDUCENS PCA; SULFATE-REDUCING BACTERIA; ANAEROBIC-BACTERIA; METHYLATION RATES; ORGANIC-MATTER; PORE WATERS; THIOLS; REDUCTION; HG(II); ENVIRONMENTS AB Microbial conversion of inorganic mercury (IHg) to methyl mercury (MeHg) is a significant environmental concern because of the bioaccumulation and biomagnification of toxic MeHg in the food web. Laboratory incubation studies have shown that, despite the presence of large quantities of IHg in cell cultures, MeHg biosynthesis often reaches a plateau or a maximum within hours or a day by an as yet unexplained mechanism. Here we report that mercuric Hg(II) can be taken up rapidly by cells of Desulfovibrio desulfuricans ND132, but a large fraction of the Hg(II) is unavailable for methylation because of strong cellular sorption. Thiols, such as cysteine, glutathione, and penicillamine, added either simultaneously with Hg(II) or after cells have been exposed to Hg(II), effectively desorb or mobilize the bound Hg(II), leading to a substantial increase in MeHg production. The amount of thiol-desorbed Hg(II) is strongly correlated to the amount of MeHg produced (r = 0.98). However, cells do not preferentially take up Hg(II)-thiol complexes, but Hg(II)-ligand exchange between these complexes and the cell-associated proteins likely constrains Hg(II) uptake and methylation. We suggest that, aside from aqueous chemical speciation of Hg(II), binding and exchange of Hg(II) between cells and complexing ligands such as thiols and naturally dissolved organics in solution is an important controlling mechanism of Hg(II) bioavailability, which should be considered when predicting MeHg production in the environment. C1 [Liu, Yu-Rong; He, Ji-Zheng] Chinese Acad Sci, Res Ctr Ecoenvironm Sci, State Key Lab Urban & Reg Ecol, Beijing 100085, Peoples R China. [Liu, Yu-Rong; Lu, Xia; Zhao, Linduo; An, Jing; Pierce, Eric M.; Johs, Alexander; Gu, Baohua] Oak Ridge Natl Lab, Div Environm Sci, POB 2008, Oak Ridge, TN 37831 USA. [He, Ji-Zheng] Univ Melbourne, Dept Vet & Agr Sci, Melbourne, Vic 3010, Australia. RP Gu, BH (reprint author), Oak Ridge Natl Lab, Div Environm Sci, POB 2008, Oak Ridge, TN 37831 USA. EM gub1@ornl.gov RI Pierce, Eric/G-1615-2011; OI Pierce, Eric/0000-0002-4951-1931; Liu, Yu-Rong/0000-0003-1112-4255 FU U.S. Department of Energy (DOE) Office of Science, Office of Biological and Environmental Research, as part of the Mercury Science Focus Area at Oak Ridge National Laboratory (ORNL); DOE [DE-AC05-00OR22725]; Chinese Scholarship Council (CSC) of China; DOE Public Access Plan FX We thank Xiangping Yin for her assistance with the mercury and methylmercury analyses. This research was sponsored by the U.S. Department of Energy (DOE) Office of Science, Office of Biological and Environmental Research, as part of the Mercury Science Focus Area at Oak Ridge National Laboratory (ORNL), which is managed by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with DOE. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a nonexclusive, paid-up, irrevocable, worldwide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes. DOE will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan (http://energy.gov/downloads/doe-public-access-plan). Y.L. was supported in part by the Chinese Scholarship Council (CSC) of China. NR 35 TC 0 Z9 0 U1 25 U2 25 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 20 PY 2016 VL 50 IS 24 BP 13335 EP 13341 DI 10.1021/acs.est.6b04041 PG 7 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EF8ZQ UT WOS:000390620900020 PM 27993064 ER PT J AU Tournassat, C Davis, JA Chiaberge, C Grangeon, S Bourg, IC AF Tournassat, Christophe Davis, James A. Chiaberge, Christophe Grangeon, Sylvain Bourg, Ian C. TI Modeling the Acid-Base Properties of Montmorillonite Edge Surfaces SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID ELECTRICAL DOUBLE-LAYER; MOLECULAR-DYNAMICS SIMULATIONS; MINERAL-WATER INTERFACE; ATOMIC-SCALE STRUCTURES; NA-MONTMORILLONITE; CLAY-MINERALS; ZERO CHARGE; MECHANISTIC DESCRIPTION; TEMPERATURE-DEPENDENCE; DISSOLUTION KINETICS AB The surface reactivity of clay minerals remains challenging to characterize because of a duality of adsorption surfaces and mechanisms that does not exist in the case of simple oxide surfaces: edge surfaces of clay minerals have a variable proton surface charge arising from hydroxyl functional groups, whereas basal surfaces have a permanent negative charge arising from isomorphic substitutions. Hence, the relationship between surface charge and surface potential on edge surfaces cannot be described using the Gouy-Chapman relation, because of a spillover of negative electrostatic potential from the basal surface onto the edge surface. While surface complexation models can be modified to account for these features, a predictive fit of experimental data was not possible until recently, because of uncertainty regarding the densities and intrinsic pK(a) values of edge functional groups. Here, we reexamine this problem in light of new knowledge on intrinsic pK(a) values obtained over the past decade using ab initio molecular dynamics simulations, and we propose a new formalism to describe edge functional groups. Our simulation results yield reasonable predictions of the best available experimental acid-base titration data. C1 [Tournassat, Christophe] Univ Orleans, CNRS INSU, BRGM, Inst Sci Terre Orleans,UMR 7327, F-45071 Orleans, France. [Tournassat, Christophe; Davis, James A.] Lawrence Berkeley Natl Lab, Earth & Environm Sci Div, Berkeley, CA 94720 USA. [Tournassat, Christophe; Chiaberge, Christophe; Grangeon, Sylvain] French Geol Survey, BRGM, F-45100 Orleans, France. [Bourg, Ian C.] Princeton Univ, Dept Civil & Environm Engn, Princeton, NJ 08544 USA. [Bourg, Ian C.] Princeton Univ, Princeton Environm Inst, Princeton, NJ 08544 USA. RP Tournassat, C (reprint author), Univ Orleans, CNRS INSU, BRGM, Inst Sci Terre Orleans,UMR 7327, F-45071 Orleans, France.; Tournassat, C (reprint author), Lawrence Berkeley Natl Lab, Earth & Environm Sci Div, Berkeley, CA 94720 USA.; Tournassat, C (reprint author), French Geol Survey, BRGM, F-45100 Orleans, France. EM c.tournassat@brgm.fr FU French Radioactive Waste Management Agency (Andra); L'Institut Carnot; U.S. Department of Energy under Office of Nuclear Energy, Used Fuel Disposition program [DE-AC02-05CH11231]; U.S. Department of Energy through the Office of Science, Office of Basic Energy Sciences, Geosciences program [DE-AC02-05CH11231] FX This work was supported by the French Radioactive Waste Management Agency (Andra) in the framework of the Andra-BRGM scientific partnership (CTEC project). J.A.D. acknowledges funding from L'Institut Carnot for his visit to the BRGM and from the U.S. Department of Energy under Contract DE-AC02-05CH11231 under the auspices of the Office of Nuclear Energy, Used Fuel Disposition program. I.C.B. was supported by the U.S. Department of Energy under Contract DE-AC02-05CH11231 through the Office of Science, Office of Basic Energy Sciences, Geosciences program. NR 110 TC 0 Z9 0 U1 19 U2 19 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 20 PY 2016 VL 50 IS 24 BP 13436 EP 13445 DI 10.1021/acs.est.6b04677 PG 10 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EF8ZQ UT WOS:000390620900031 PM 27993078 ER PT J AU Pan, ZZ Giammar, DE Mehta, V Troyer, LD Catalano, JG Wang, ZM AF Pan, Zezhen Giammar, Daniel E. Mehta, Vrajesh Troyer, Lyndsay D. Catalano, Jeffrey G. Wang, Zheming TI Phosphate-Induced Immobilization of Uranium in Hanford Sediments SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID CONTAMINATED SEDIMENTS; ADSORPTION; U(VI); ZONE; SPECTROSCOPY; DESORPTION; SPECIATION; TRANSPORT; AQUIFER; XAFS AB Phosphate can be added to subsurface environments to immobilize U(VI) contamination. The efficacy of immobilization depends on the site-specific groundwater chemistry and aquifer sediment properties. Batch and column experiments were performed with sediments from the Hanford 300 Area in Washington State and artificial groundwater prepared to emulate the conditions at the site. Batch experiments revealed enhanced U(VI) sorption with increasing phosphate addition. X-ray absorption spectroscopy measurements of samples from the batch experiments found that U(VI) was predominantly adsorbed at conditions relevant to the column experiments and most field sites (low U(VI) loadings, <25 mu M), and U(VI) phosphate precipitation occurred only at high initial U(VI) (>25 mu M) and phosphate loadings. While batch experiments showed the transition of U(VI) uptake from adsorption to precipitation, the column study was more directly relevant to the subsurface environment because of the high solid:water ratio in the column and the advective flow of water. In column experiments, nearly six times more U(VI) was retained in sediments when phosphate containing groundwater was introduced to U(VI)-loaded sediments than when the groundwater did not contain phosphate. This enhanced retention persisted for at least one month after cessation of phosphate addition to the influent fluid. Sequential extractions and laser-induced fluorescence spectroscopy of sediments from the columns suggested that the retained U(VI) was primarily in adsorbed forms. These results indicate that in situ remediation of groundwater by phosphate addition provides lasting benefit beyond the treatment period via enhanced U(VI) adsorption to sediments. C1 [Pan, Zezhen; Giammar, Daniel E.; Mehta, Vrajesh] Washington Univ, Dept Energy Environm & Chem Engn, St Louis, MO 63130 USA. [Troyer, Lyndsay D.; Catalano, Jeffrey G.] Washington Univ, Dept Earth & Planetary Sci, St Louis, MO 63130 USA. [Wang, Zheming] Pacific Northwest Natl Lab, Dept Fundamental & Computat Sci Directorate, Richland, WA 99352 USA. RP Giammar, DE (reprint author), Washington Univ, Dept Energy Environm & Chem Engn, St Louis, MO 63130 USA. EM giammar@wustl.edu RI Catalano, Jeffrey/A-8322-2013 OI Catalano, Jeffrey/0000-0001-9311-977X FU U.S. Department of Energy (DOE) Subsurface Biogeochemical Research program [DE-SC0006857]; U.S. Department of Energy's Office of Biological and Environmental Research; DOE Office of Science by Argonne National Laboratory [DE-AC02-06CH11357] FX This work was supported by the U.S. Department of Energy (DOE) Subsurface Biogeochemical Research program (No. DE-SC0006857). ICP-MS analysis was performed at the Nano Research Facility (NRF) at Washington University. The fluorescence spectroscopy measurements were performed at the Environmental Molecular Sciences Laboratory (EMSL), a national scientific user facility sponsored by the U.S. Department of Energy's Office of Biological and Environmental Research and located at the Pacific Northwest National Laboratory, operated for the Department of Energy by Battelle. EXAFS spectra were collected at the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. Sediments were provided by Dr. John Zachara from Pacific Northwest National Laboratory. We appreciate the comments of Associate Editor David Waite and three anonymous reviewers that helped us improve the presentation and interpretation of our study. NR 41 TC 0 Z9 0 U1 31 U2 31 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 20 PY 2016 VL 50 IS 24 BP 13486 EP 13494 DI 10.1021/acs.est.6b02928 PG 9 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EF8ZQ UT WOS:000390620900037 PM 27993066 ER PT J AU Paasch-Colberg, T Kruchinin, SY Saglam, O Kapser, S Cabrini, S Muehlbrandt, S Reichert, J Barth, JV Ernstorfer, R Kienberger, R Yakovlev, VS Karpowicz, N Schiffrin, A AF Paasch-Colberg, Tim Kruchinin, Stanislav Yu Saglam, Oezge Kapser, Stefan Cabrini, Stefano Muehlbrandt, Sascha Reichert, Joachim Barth, Johannes V. Ernstorfer, Ralph Kienberger, Reinhard Yakovlev, Vladislav S. Karpowicz, Nicholas Schiffrin, Agustin TI Sub-cycle optical control of current in a semiconductor: from the multiphoton to the tunneling regime SO OPTICA LA English DT Article ID FIELD; IONIZATION; SILICON; DEVICE AB Nonlinear interactions between ultrashort optical waveforms and solids can be used to induce and steer electric currents on femtosecond (fs) timescales, holding promise for electronic signal processing at PHz (10(15) Hz) frequencies [Nature 493, 70 (2013)]. So far, this approach has been limited to insulators, requiring extreme peak electric fields (> 1 V/angstrom) and intensities (> 10(13) W/cm(2)). Here, we show all-optical generation and control of electric currents in a semiconductor relevant for high-speed and high-power (opto) electronics, gallium nitride (GaN), within an optical cycle and on a timescale shorter than 2 fs, at intensities at least an order of magnitude lower than those required for dielectrics. Our approach opens the door to PHz electronics and metrology, applicable to lowpower (non-amplified) laser pulses, and may lead to future applications in semiconductor and (photonic) integrated circuit technologies. (C) 2016 Optical Society of America C1 [Paasch-Colberg, Tim; Kruchinin, Stanislav Yu; Kapser, Stefan; Muehlbrandt, Sascha; Kienberger, Reinhard; Yakovlev, Vladislav S.; Karpowicz, Nicholas; Schiffrin, Agustin] Max Planck Inst Quantum Opt, Hans Kopfermann Str 1, D-85748 Garching, Germany. [Saglam, Oezge; Reichert, Joachim; Barth, Johannes V.; Kienberger, Reinhard] Tech Univ Munich, Dept Phys, James Franck Str, D-85748 Garching, Germany. [Cabrini, Stefano] Lawrence Berkeley Natl Lab, Mol Foundry, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Ernstorfer, Ralph] Max Planck Gesell, Fritz Haber Inst, Faradayweg 4-6, D-14195 Berlin, Germany. [Yakovlev, Vladislav S.] Ludwig Maximilians Univ Munchen, Coulombwall 1, D-85748 Garching, Germany. [Schiffrin, Agustin] Monash Univ, Sch Phys & Astron, Clayton, Vic 3800, Australia. [Paasch-Colberg, Tim] TOPTICA Photon AG, Lochhamer Schlag 19, D-82166 Graefelfing, Germany. RP Schiffrin, A (reprint author), Max Planck Inst Quantum Opt, Hans Kopfermann Str 1, D-85748 Garching, Germany.; Schiffrin, A (reprint author), Monash Univ, Sch Phys & Astron, Clayton, Vic 3800, Australia. EM agustin.schiffrin@monash.edu RI BARTH, Johannes/E-4060-2013 OI BARTH, Johannes/0000-0002-6270-2150 FU Deutsche Forschungsgemeinschaft (DFG) Cluster of Excellence; Munich-Centre for Advanced Photonics (MAP); Max-Planck-Gesellschaft (MPG); Alexander von Humboldt Foundation; Swiss National Science Foundation (SNF); Marie Curie Fellowship (NANOULOP) [302157]; European Research Council (ERC) (AEDMOS); Integrated Initiative LASERLAB-Europe; Australian Research Council (ARC) Future Fellowship; BaCaTeC; U.S. Department of Energy (DOE) [DE-AC02-05CH11231] FX Deutsche Forschungsgemeinschaft (DFG) Cluster of Excellence; Munich-Centre for Advanced Photonics (MAP); Max-Planck-Gesellschaft (MPG); Alexander von Humboldt Foundation; Swiss National Science Foundation (SNF); Marie Curie Fellowship (NANOULOP, 302157); European Research Council (ERC) (AEDMOS); Integrated Initiative LASERLAB-Europe; Australian Research Council (ARC) Future Fellowship; BaCaTeC; U.S. Department of Energy (DOE) (DE-AC02-05CH11231). NR 24 TC 0 Z9 0 U1 3 U2 3 PU OPTICAL SOC AMER PI WASHINGTON PA 2010 MASSACHUSETTS AVE NW, WASHINGTON, DC 20036 USA SN 2334-2536 J9 OPTICA JI Optica PD DEC 20 PY 2016 VL 3 IS 12 BP 1358 EP 1361 DI 10.1364/OPTICA.3.001358 PG 4 WC Optics SC Optics GA EG1LM UT WOS:000390793900011 ER PT J AU Burghoff, D Yang, Y Reno, JL Hu, Q AF Burghoff, David Yang, Yang Reno, John L. Hu, Qing TI Dispersion dynamics of quantum cascade lasers SO OPTICA LA English DT Article ID GROUP-VELOCITY DISPERSION; FREQUENCY COMBS; SEMICONDUCTOR-LASER; GAIN; SPECTROSCOPY; EMISSION; SPECTRA; DESIGN AB A key parameter underlying the efficacy of any nonlinear optical process is group velocity dispersion. In quantum cascade lasers (QCLs), there have been several recent demonstrations of devices exploiting nonlinearities in both the mid-infrared and the terahertz. Though the gain of QCLs has been well studied, the dispersion has been much less investigated, and several questions remain about its dynamics and precise origin. In this work, we use time-domain spectroscopy to investigate the dispersion of broadband terahertz QCLs, and demonstrate that contributions from both the material and the intersubband transitions are relevant. We show that in contrast to the laser gain-which is clamped to a fixed value above lasing threshold-the dispersion changes with bias even above threshold, which is a consequence of shifting intersubband populations. We also examine the role of higher-order dispersion in QCLs and discuss the ramifications of our result for devices utilizing nonlinear effects, such as frequency combs. (C) 2016 Optical Society of America C1 [Burghoff, David; Yang, Yang; Hu, Qing] MIT, Dept Elect Engn & Comp Sci, Elect Res Lab, Cambridge, MA 02139 USA. [Reno, John L.] Sandia Natl Labs, Ctr Integrated Nanotechnol, Albuquerque, NM 87123 USA. RP Burghoff, D (reprint author), MIT, Dept Elect Engn & Comp Sci, Elect Res Lab, Cambridge, MA 02139 USA. EM burghoff@mit.edu FU Defense Advanced Research Projects Agency (DARPA) [W31P4Q-16-1-0001]; National Science Foundation (NSF); Sandia National Laboratories; U.S. Department of Energy (DOE) [DE-AC04-94AL85000] FX Defense Advanced Research Projects Agency (DARPA) (W31P4Q-16-1-0001); National Science Foundation (NSF); Sandia National Laboratories; U.S. Department of Energy (DOE) (DE-AC04-94AL85000). NR 35 TC 0 Z9 0 U1 14 U2 14 PU OPTICAL SOC AMER PI WASHINGTON PA 2010 MASSACHUSETTS AVE NW, WASHINGTON, DC 20036 USA SN 2334-2536 J9 OPTICA JI Optica PD DEC 20 PY 2016 VL 3 IS 12 BP 1362 EP 1365 DI 10.1364/OPTICA.3.001362 PG 4 WC Optics SC Optics GA EG1LM UT WOS:000390793900012 ER PT J AU Wang, L Kruk, S Tang, HZ Li, T Kravchenko, I Neshev, DN Kivshar, YS AF Wang, Lei Kruk, Sergey Tang, Hanzhi Li, Tao Kravchenko, Ivan Neshev, Dragomir N. Kivshar, Yuri S. TI Grayscale transparent metasurface holograms SO OPTICA LA English DT Article ID DIELECTRIC METASURFACES; POLARIZATION AB We demonstrate transparent metaholograms based on silicon metasurfaces that allow high-resolution grayscale images to be encoded. The holograms feature the highest diffraction and transmission efficiencies, and operate over a broad spectral range. (C) 2016 Optical Society of America C1 [Wang, Lei; Kruk, Sergey; Tang, Hanzhi; Neshev, Dragomir N.; Kivshar, Yuri S.] Australian Natl Univ, Res Sch Phys & Engn, Nonlinear Phys Ctr, Canberra, ACT 2601, Australia. [Tang, Hanzhi; Li, Tao] Nanjing Univ, Coll Engn & Appl Sci, Natl Lab Solid State Microstruct, Nanjing 210093, Jiangsu, Peoples R China. [Kravchenko, Ivan] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA. RP Kruk, S (reprint author), Australian Natl Univ, Res Sch Phys & Engn, Nonlinear Phys Ctr, Canberra, ACT 2601, Australia. EM Sergey.Kruk@anu.edu.au RI Kravchenko, Ivan/K-3022-2015 OI Kravchenko, Ivan/0000-0003-4999-5822 FU Australian Research Council (ARC) FX Australian Research Council (ARC). NR 14 TC 0 Z9 0 U1 9 U2 9 PU OPTICAL SOC AMER PI WASHINGTON PA 2010 MASSACHUSETTS AVE NW, WASHINGTON, DC 20036 USA SN 2334-2536 J9 OPTICA JI Optica PD DEC 20 PY 2016 VL 3 IS 12 BP 1504 EP 1505 DI 10.1364/OPTICA.3.001504 PG 2 WC Optics SC Optics GA EG1LM UT WOS:000390793900034 ER PT J AU Brumm, PJ Gowda, K Robb, FT Mead, DA AF Brumm, Phillip J. Gowda, Krishne Robb, Frank T. Mead, David A. TI The Complete Genome Sequence of Hyperthermophile Dictyoglomus turgidum DSM 6724 (TM) Reveals a Specialized Carbohydrate Fermentor SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE Dictyoglomus turgidum; thermophile; biomass degradation; phage; Dictyoglomi; DNA polymerase; glucanase; reverse gyrase ID THERMOPHILUM RT46B.1; HOT-SPRINGS; SP-NOV; PATHWAY/GENOME DATABASES; ANAEROBIC THERMOPHILE; BIOCYC COLLECTION; UZON CALDERA; RNA GENES; DNA; EXPRESSION AB Here we report the complete genome sequence of the chemoorganotrophic, extremely thermophilic bacterium, Dictyoglomus turgidum, which is a Gram negative, strictly anaerobic bacterium. D. turgidum and D. thermophilum together form the Dictyoglomi phylum. The two Dictyoglomus genomes are highly syntenic, and both are distantly related to Caldicellulosiruptor spp. D. turgidum is able to grow on a wide variety of polysaccharide substrates due to significant genomic commitment to glycosyl hydrolases, 16 of which were cloned and expressed in our study. The GH5, GH10, and GH42 enzymes characterized in this study suggest that D. turgidum can utilize most plant-based polysaccharides except crystalline cellulose. The DNA polymerase I enzyme was also expressed and characterized. The pure enzyme showed improved amplification of long PCR targets compared to Taq polymerase. The genome contains a full complement of DNA modifying enzymes, and an unusually high copy number (4) of a new, ancestral family of polB type nucleotidyltransferases designated as MNT (minimal nucleotidyltransferases). Considering its optimal growth at 72 degrees C, D. turgidum has an anomalously low G+C content of 39.9% that may account for the presence of reverse gyrase, usually associated with hyperthermophiles. C1 [Brumm, Phillip J.] C5 6 Technol LLC, Fitchburg, WI 53711 USA. [Brumm, Phillip J.; Gowda, Krishne; Mead, David A.] Univ Wisconsin Madison, DOE Great Lakes Bioenergy Res Ctr, Madison, WI 53706 USA. [Gowda, Krishne] Lucigen Corp, Middleton, WI USA. [Robb, Frank T.] Univ Maryland, Dept Microbiol & Immunol, Inst Marine & Environm Technol, Baltimore, MD 21201 USA. [Mead, David A.] Varigen Biosci Corp, Madison, WI USA. RP Brumm, PJ (reprint author), C5 6 Technol LLC, Fitchburg, WI 53711 USA.; Brumm, PJ (reprint author), Univ Wisconsin Madison, DOE Great Lakes Bioenergy Res Ctr, Madison, WI 53706 USA. EM pbrumm@c56technologies.com FU DOE Great Lakes Bioenergy Research Center (DOE BER Office of Science) [DE-FC02-07ER64494]; DOE Great Lakes Bioenergy Research Center (DOE OBP Office of Energy Efficiency and Renewable Energy) [DE-AC05-76RL01830]; NASA Exobiology Program FX This work was completely funded by the DOE Great Lakes Bioenergy Research Center (DOE BER Office of Science DE-FC02-07ER64494 and DOE OBP Office of Energy Efficiency and Renewable Energy DE-AC05-76RL01830). FR acknowledges support from the NASA Exobiology Program. NR 76 TC 0 Z9 0 U1 13 U2 13 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 20 PY 2016 VL 7 AR 1979 DI 10.3339/fmicb.2016.01979 PG 20 WC Microbiology SC Microbiology GA EF2LZ UT WOS:000390157400001 PM 28066333 ER PT J AU Hahnke, RL Meier-Kolthoff, JP Garcia-Lopez, M Mukherjee, S Huntemann, M Lvanova, NN Woyke, T Kyrpides, NC Klenk, HP Goker, M AF Hahnke, Richard L. Meier-Kolthoff, Jan P. Garcia-Lopez, Marina Mukherjee, Supratim Huntemann, Marcel Lvanova, Natalia N. Woyke, Tanja Kyrpides, Nikos C. Klenk, Hans-Peter Goeker, Markus TI Genome-Based Taxonomic Classification of Bacteroidetes SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE G plus C content; genome BLAST distance phylogeny; gliding motility; gut microbiome; marine microbiology; one thousand microbial genomes project; phylogenetic classification; Bacteroidaeota-Rhodothermaeota-Balneolaeota-Chlorobaeota superphylum ID 16S RIBOSOMAL-RNA; CYTOPHAGA-FLAVOBACTERIUM-BACTEROIDES; DNA-DNA HYBRIDIZATION; FERMENTANS GEN. NOV.; GINSENGISOLI SP-NOV.; HUMAN ORAL-CAVITY; ET-AL. 2006; URCHIN STRONGYLOCENTROTUS-INTERMEDIUS; GRAM-NEGATIVE BACTERIUM; PSYCHROTOLERANS SP NOV. AB The bacterial phylum Bacteroidetes, characterized by a distinct gliding motility, occurs in a broad variety of ecosystems, habitats, life styles, and physiologies. Accordingly, taxonomic classification of the phylum, based on a limited number of features, proved difficult and controversial in the past, for example, when decisions were based on unresolved phylogenetic trees of the 16S rRNA gene sequence. Here we use a large collection of type-strain genomes from Bacteroidetes and closely related phyla for assessing their taxonomy based on the principles of phylogenetic classification and trees inferred from genome-scale data. No significant conflict between 16S rRNA gene and whole-genome phylogenetic analysis is found, whereas many but not all of the involved taxa are supported as monophyletic groups, particularly in the genome-scale trees. Phenotypic and phylogenomic features support the separation of Balneolaceae as new phylum Balneolaeota from Rhodothermaeota and of Saprospiraceae as new class Saprospiria from Chitinophagia. Epilithonithonas is nested within the older genus Chryseobacterium and without significant phenotypic differences; thus merging the two genera is proposed. Similarly, Vitellibacter is proposed to be included in Aequorivita. Flexibacter is confirmed as being heterogeneous and dissected, yielding six distinct genera. Haliella seregens is a later heterotypic synonym of Prevotella dentalis. Compared to values directly calculated from genome sequences, the G+C content mentioned in many species descriptions is too imprecise; moreover, corrected G+C content values have a significantly better fit to the phylogeny. Corresponding emendations of species descriptions are provided where necessary. Whereas most observed conflict with the current classification of Bacteroidetes is already visible in 16S rRNA gene trees, as expected whole-genome phylogenies are much better resolved. C1 [Hahnke, Richard L.; Meier-Kolthoff, Jan P.; Garcia-Lopez, Marina; Goeker, Markus] Leibniz Inst DSMZ German Collect Microorconisms C, Dept Microorganisms, Braunschweig, Germany. [Mukherjee, Supratim; Huntemann, Marcel; Lvanova, Natalia N.; Woyke, Tanja; Kyrpides, Nikos C.] Dept Energy Joint Genome Inst DOE JGI, Walnut Creek, CA USA. [Kyrpides, Nikos C.] King Abdulaziz Univ, Fac Sci, Dept Biol Sci, Jeddah, Saudi Arabia. [Klenk, Hans-Peter] Newcastle Univ, Sch Biol, Newcastle Upon Tyne, Tyne & Wear, England. RP Goker, M (reprint author), Leibniz Inst DSMZ German Collect Microorconisms C, Dept Microorganisms, Braunschweig, Germany. EM markus.goeker@dsmz.de RI Faculty of, Sciences, KAU/E-7305-2017; Fac Sci, KAU, Biol Sci Dept/L-4228-2013; OI Meier-Kolthoff, Jan Philipp/0000-0001-9105-9814 FU US Department of Energy's Office of Science, Biological and Environmental Research Program; University of California, Lawrence Berkeley National Laboratory [DE-AC02-05C1411231]; German Bundesministerium fur Ernahrung und Landwirtschaft [22016812] FX This work was performed under the auspices of the US Department of Energy's Office of Science, Biological and Environmental Research Program, and by the University of California, Lawrence Berkeley National Laboratory under contract No. DE-AC02-05C1411231. RH was supported by the German Bundesministerium fur Ernahrung und Landwirtschaft, grant No. 22016812 for Brian J. Tindall. NR 319 TC 1 Z9 1 U1 19 U2 19 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 20 PY 2016 VL 7 AR 2003 DI 10.3389/fmicb.2016.02003 PG 37 WC Microbiology SC Microbiology GA EF2MX UT WOS:000390159900001 PM 28066339 ER PT J AU Paddison, JAM Ong, HS Hamp, JO Mukherjee, P Bai, XJ Tucker, MG Butch, NP Castelnovo, C Mourigal, M Dutton, SE AF Paddison, Joseph A. M. Ong, Harapan S. Hamp, James O. Mukherjee, Paromita Bai, Xiaojian Tucker, Matthew G. Butch, Nicholas P. Castelnovo, Claudio Mourigal, Martin Dutton, S. E. TI Emergent order in the kagome Ising magnet Dy3Mg2Sb3O14 SO NATURE COMMUNICATIONS LA English DT Article ID EARTH TITANATE PYROCHLORES; NEUTRON POWDER DIFFRACTION; DIPOLAR SPIN ICE; MONTE-CARLO; FRUSTRATED MAGNETS; PHASE-TRANSITIONS; CRYSTAL-STRUCTURE; FRAGMENTATION; SIMULATION; SCATTERING AB The Ising model-in which degrees of freedom (spins) are binary valued (up/down)-is a cornerstone of statistical physics that shows rich behaviour when spins occupy a highly frustrated lattice such as kagome. Here we show that the layered Ising magnet Dy3Mg2Sb3O14 hosts an emergent order predicted theoretically for individual kagome layers of in-plane Ising spins. Neutron-scattering and bulk thermomagnetic measurements reveal a phase transition at similar to 0.3 K from a disordered spin-ice-like regime to an emergent charge ordered state, in which emergent magnetic charge degrees of freedom exhibit three-dimensional order while spins remain partially disordered. Monte Carlo simulations show that an interplay of inter-layer interactions, spin canting and chemical disorder stabilizes this state. Our results establish Dy3Mg2Sb3O14 as a tuneable system to study interacting emergent charges arising from kagome Ising frustration. C1 [Paddison, Joseph A. M.; Ong, Harapan S.; Hamp, James O.; Mukherjee, Paromita; Castelnovo, Claudio; Dutton, S. E.] Univ Cambridge, Cavendish Lab, Dept Phys, JJ Thomson Ave, Cambridge CB3 0HE, England. [Paddison, Joseph A. M.; Bai, Xiaojian; Mourigal, Martin] Georgia Inst Technol, Sch Phys, Atlanta, GA 30332 USA. [Tucker, Matthew G.] Rutherford Appleton Lab, ISIS Neutron & Muon Source, Harwell Campus, Didcot OX11 0QX, Oxon, England. [Tucker, Matthew G.] Oak Ridge Natl Lab, Spallat Neutron Source, Oak Ridge, TN 37831 USA. [Butch, Nicholas P.] NIST, Ctr Neutron Res, Gaithersburg, MD 20899 USA. RP Paddison, JAM; Dutton, SE (reprint author), Univ Cambridge, Cavendish Lab, Dept Phys, JJ Thomson Ave, Cambridge CB3 0HE, England.; Paddison, JAM (reprint author), Georgia Inst Technol, Sch Phys, Atlanta, GA 30332 USA. EM paddison@gatech.edu; sed33@cam.ac.uk OI Mourigal, Martin/0000-0003-2772-8440 FU Winton Programme for the Physics of Sustainability; College of Sciences; Ministry of Education, Singapore; Engineering and Physical Sciences Research Council (EPSRC); EPSRC [EP/G049394/1]; EPSRC NetworkPlus on 'Emergence and Physics far from Equilibrium'; Churchill College, Cambridge FX Work at Cambridge was supported through the Winton Programme for the Physics of Sustainability. The work of J.A.M.P., X.B. and M.M. and facilities at Georgia Tech were supported by the College of Sciences through M.M. start-up funds. J.A.M.P. gratefully acknowledges Churchill College, Cambridge for the provision of a Junior Research Fellowship. H.S.O. acknowledges a Teaching Scholarship (Overseas) from the Ministry of Education, Singapore. J.O.H. is grateful to the Engineering and Physical Sciences Research Council (EPSRC) for funding. C.C. was supported by EPSRC Grant No. EP/G049394/1, and the EPSRC NetworkPlus on 'Emergence and Physics far from Equilibrium'. Experiments at the ISIS Pulsed Neutron and Muon Source were supported by a beamtime allocation from the Science and Technology Facilities Council. This work utilized facilities at the NIST Center for Neutron Research. Monte Carlo simulations were performed using the Darwin Supercomputer of the University of Cambridge High Performance Computing Service (http://www.hpc.cam.ac.uk/) and the ARCHER UK National Supercomputing Service (http://www.archer.ac.uk/, for which access was provided by an ARCHER Instant Access scheme). We thank G.-W. Chern, J. Goff, A. L. Goodwin, G. Lonzarich, G. Moller, D. Prabhakaran, J. R. Stewart and A. Zangwill for valuable discussions, and M. Kwasigroch for preliminary theoretical work. NR 60 TC 0 Z9 0 U1 12 U2 12 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 20 PY 2016 VL 7 AR 13842 DI 10.1038/ncomms13842 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE9VF UT WOS:000389973600001 PM 27996012 ER PT J AU Guguchia, Z Khasanov, R Shengelaya, A Pomjakushina, E Billinge, SJL Amato, A Morenzoni, E Keller, H AF Guguchia, Z. Khasanov, R. Shengelaya, A. Pomjakushina, E. Billinge, S. J. L. Amato, A. Morenzoni, E. Keller, H. TI Cooperative coupling of static magnetism and bulk superconductivity in the stripe phase of La2-xBaxCuO4: Pressure-and doping-dependent studies SO PHYSICAL REVIEW B LA English DT Article ID HIGH-TEMPERATURE SUPERCONDUCTORS; CUPRATE SUPERCONDUCTORS; PENETRATION DEPTH; MU-SR; ORDER; SPINS; DENSITY; HOLES; BA; TC AB Static spin-stripe order and superconductivity were systematically studied in La2-xBaxCuO4 (0.11 <= x <= 0.17) at ambient pressure by means of magnetization and mu SR experiments. We find that all the investigated La2-xBaxCuO4 samples exhibit static spin-stripe order and that the quasi-two-dimensional superconducting (SC) transition temperature T-c1 and the static spin-stripe order temperature T-so have very similar values throughout the phase diagram. Moreover, the magnetic and the SC properties of the x = 0.155 (LBCO-0.155) and x = 0.17 (LBCO-0.17) samples were studied under hydrostatic pressure. As a remarkable result, in these bulk cuprate superconductors, the three-dimensional SC transition temperature Tc and Tso nearly coincide [T-c(p) similar or equal to T-so(p)] at all pressure investigated (0 <= p <= 2.3 GPa). We also observed a pressure induced transition from long-range spin stripe order to a disordered magnetic state at p star similar or equal to 1.6 GPa in LBCO-0.155, coexisting with a SC state with substantial superfluid density. In LBCO-0.17, a disordered magnetic state is present at all p. The present results indicate that static magnetic order and SC pairing correlations develop in a cooperative fashion in La2-xBaxCuO4 , and provide a new route of understanding the complex interplay between static magnetism and superconductivity in the stripe phase of cuprates. C1 [Guguchia, Z.; Khasanov, R.; Amato, A.; Morenzoni, E.] Paul Scherrer Inst, Lab Muon Spin Spect, CH-5232 Villigen, Switzerland. [Guguchia, Z.] Columbia Univ, Dept Phys, New York, NY 10027 USA. [Shengelaya, A.] Tbilisi State Univ, Dept Phys, Chavchavadze 3, GE-0128 Tbilisi, Rep of Georgia. [Shengelaya, A.] I Javakhishvili Tbilisi State Univ, Andronikashvili Inst Phys, Tamarashvili Str 6, GE-0177 Tbilisi, Rep of Georgia. [Pomjakushina, E.] Paul Scherrer Inst, Lab Dev & Methods, CH-5232 Villigen, Switzerland. [Billinge, S. J. L.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Keller, H.] Univ Zurich, Phys Inst, Winterthurerstr 190, CH-8057 Zurich, Switzerland. RP Guguchia, Z (reprint author), Paul Scherrer Inst, Lab Muon Spin Spect, CH-5232 Villigen, Switzerland.; Guguchia, Z (reprint author), Columbia Univ, Dept Phys, New York, NY 10027 USA. EM zurab.guguchia@psi.ch RI Amato, Alex/H-7674-2013; OI Amato, Alex/0000-0001-9963-7498; Khasanov, Rustem/0000-0002-4768-5524 FU Swiss National Science Foundation (SNF) [P2ZHP2_161980, 200021_149486]; SCOPES grant [Z74Z0_160484]; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences (DOE-BES) [DE-SC00112704] FX The mu SR experiments were performed at the Swiss Muon Source (S mu S) Paul Scherrer Insitute, Villigen, Switzerland. Z.G. thanks Y.J. Uemura, S.A. Kivelson, and J. Tranquada for helpful discussions. Z.G. thanks P.K. Biswas for his technical support during the experiments on Dolly mu SR Instrument. Z.G. gratefully acknowledges the financial support by the Swiss National Science Foundation (SNFfellowship P2ZHP2_161980 and SNFGrant 200021_149486). A.S. acknowledges support from the SCOPES grant No. Z74Z0_160484. We further thank A. Schilling and F.v. Rohr for supporting the susceptibility measurements of LBCO-0.155 under pressure. Work in the Billinge group was supported by U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences (DOE-BES) under Contract No. DE-SC00112704. NR 45 TC 0 Z9 0 U1 9 U2 9 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 20 PY 2016 VL 94 IS 21 AR 214511 DI 10.1103/PhysRevB.94.214511 PG 15 WC Physics, Condensed Matter SC Physics GA EF3TO UT WOS:000390247500002 ER PT J AU Kim, DY Lin, SZ Weickert, F Kenzelmann, M Bauer, ED Ronning, F Thompson, JD Movshovich, R AF Kim, Duk Y. Lin, Shi-Zeng Weickert, Franziska Kenzelmann, Michel Bauer, Eric D. Ronning, Filip Thompson, J. D. Movshovich, Roman TI Intertwined Orders in Heavy-Fermion Superconductor CeCoIn5 SO PHYSICAL REVIEW X LA English DT Article ID CRITICAL-FIELD; ELECTRON-SPIN; DENSITY-WAVE; TEMPERATURE; CONDUCTIVITY AB The appearance of spin-density-wave (SDW) magnetic order in the low-temperature and high-field corner of the superconducting phase diagram of CeCoIn5 is unique among unconventional superconductors. The nature of this magnetic Q phase is a matter of current debate. Here, we present the thermal conductivity of CeCoIn5 in a rotating magnetic field, which reveals the presence of an additional order inside the Q phase that is intimately intertwined with the superconducting d-wave and SDW orders. A discontinuous change of the thermal conductivity within the Q phase, when the magnetic field is rotated about antinodes of the superconducting d-wave order parameter, demands that the additional order must change abruptly, together with the recently observed switching of the SDW. A combination of interactions, where spin-orbit coupling orients the SDW, which then selects the secondary p-wave pair-density-wave component (with an average amplitude of 20% of the primary d-wave order parameter), accounts for the observed behavior. C1 [Kim, Duk Y.; Lin, Shi-Zeng; Weickert, Franziska; Bauer, Eric D.; Ronning, Filip; Thompson, J. D.; Movshovich, Roman] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Kenzelmann, Michel] Paul Scherrer Inst, Lab Sci Dev & Novel Mat, CH-5232 Villigen, Switzerland. RP Kim, DY (reprint author), Los Alamos Natl Lab, Los Alamos, NM 87545 USA. EM dykim@lanl.gov; roman@lanl.gov RI Kenzelmann, Michel/A-8438-2008; Lin, Shi-Zeng/B-2906-2008 OI Kenzelmann, Michel/0000-0001-7913-4826; Lin, Shi-Zeng/0000-0002-4368-5244 FU U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering; U.S. Department of Energy through the LANL/LDRD Program FX Discussions with James A. Sauls, Anton B. Vorontsov, Ilya Vekhter, Stuart E. Brown, Alexander V. Balatsky, David M. Fobes, and Marc Janoschek are gratefully acknowledged. This work was conducted at the Los Alamos National Laboratory under the auspices of the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering. We gratefully acknowledge the support of the U.S. Department of Energy through the LANL/LDRD Program. NR 46 TC 0 Z9 0 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2160-3308 J9 PHYS REV X JI Phys. Rev. X PD DEC 20 PY 2016 VL 6 IS 4 AR 041059 DI 10.1103/PhysRevX.6.041059 PG 9 WC Physics, Multidisciplinary SC Physics GA EF4IC UT WOS:000390288000001 ER PT J AU Jang, H Lee, WS Nojiri, H Matsuzawa, S Yasumura, H Nie, L Maharaj, AV Gerber, S Liu, YJ Mehta, A Bonn, DA Liang, R Hardy, WN Burns, CA Islam, Z Song, S Hastings, J Devereaux, TP Shen, ZX Kivelson, SA Kao, CC Zhu, D Lee, JS AF Jang, H. Lee, W. -S. Nojiri, H. Matsuzawa, S. Yasumura, H. Nie, L. Maharaj, A. V. Gerber, S. Liu, Y. -J. Mehta, A. Bonn, D. A. Liang, R. Hardy, W. N. Burns, C. A. Islam, Z. Song, S. Hastings, J. Devereaux, T. P. Shen, Z. -X. Kivelson, S. A. Kao, C. -C. Zhu, D. Lee, J. -S. TI Ideal charge-density-wave order in the high-field state of superconducting YBCO SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE high-temperature superconductors; charge-density-wave order; high magnetic field X-ray scattering; vestigial nematic order; competing order ID HIGH-TEMPERATURE SUPERCONDUCTOR; STRIPE ORDER; CUPRATE SUPERCONDUCTORS; ROTATIONAL SYMMETRY; FERMI-SURFACE; YBA2CU3O6.67; PHASE AB The existence of charge-density-wave (CDW) correlations in cuprate superconductors has now been established. However, the nature of the CDW ground state has remained uncertain because disorder and the presence of superconductivity typically limit the CDW correlation lengths to only a dozen unit cells or less. Here we explore the field-induced 3D CDW correlations in extremely pure detwinned crystals of YBa2Cu3Ox (YBCO) ortho-II and ortho-VIII at magnetic fields in excess of the resistive upper critical field (H-c2) where superconductivity is heavily suppressed. We observe that the 3D CDW is unidirectional and possesses a long in-plane correlation length as well as significant correlations between neighboring CuO2 planes. It is significant that we observe only a single sharply defined transition at a critical field proportional to H-c2, given that the field range used in this investigation overlaps with other high-field experiments including quantum oscillation measurements. The correlation volume is at least two to three orders of magnitude larger than that of the zero-field CDW. This is by far the largest CDW correlation volume observed in any cuprate crystal and so is presumably representative of the high-field ground state of an "ideal" disorder-free cuprate. C1 [Jang, H.; Liu, Y. -J.; Mehta, A.; Burns, C. A.; Lee, J. -S.] SLAC Natl Accelerator Lab, Stanford Synchrotron Radiat Lightsource, Menlo Pk, CA 94025 USA. [Lee, W. -S.; Devereaux, T. P.; Shen, Z. -X.] Stanford Inst Mat & Energy Sci, SLAC Natl Accelerator Lab, Menlo Pk, CA 94025 USA. [Lee, W. -S.; Devereaux, T. P.; Shen, Z. -X.] Stanford Univ, Menlo Pk, CA 94025 USA. [Matsuzawa, S.; Yasumura, H.] Tohoku Univ, Inst Mat Res, Katahira 2-1-1, Sendai, Miyagi 9808577, Japan. [Nie, L.; Maharaj, A. V.; Shen, Z. -X.; Kivelson, S. A.] Stanford Univ, Geballe Lab Adv Mat, Dept Phys, Stanford, CA 94305 USA. [Nie, L.; Maharaj, A. V.; Shen, Z. -X.; Kivelson, S. A.] Stanford Univ, Dept Appl Phys, Stanford, CA 94305 USA. [Gerber, S.] Paul Scherrer Inst, SwissFEL, CH-5232 Villigen, Switzerland. [Bonn, D. A.; Liang, R.; Hardy, W. N.] Univ British Columbia, Dept Phys & Astron, Vancouver, BC V6T 1Z1, Canada. [Bonn, D. A.; Liang, R.; Hardy, W. N.] Canadian Inst Adv Res, Toronto, ON M5G 1Z8, Canada. [Burns, C. A.] Western Michigan Univ, Dept Phys, Kalamazoo, MI 49008 USA. [Islam, Z.] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA. [Song, S.; Hastings, J.; Zhu, D.] SLAC Natl Accelerator Lab, Linac Coherent Light Source, Menlo Pk, CA 94025 USA. [Kao, C. -C.] SLAC Natl Accelerator Lab, Menlo Pk, CA 94025 USA. RP Lee, JS (reprint author), SLAC Natl Accelerator Lab, Stanford Synchrotron Radiat Lightsource, Menlo Pk, CA 94025 USA.; Kivelson, SA (reprint author), Stanford Univ, Geballe Lab Adv Mat, Dept Phys, Stanford, CA 94305 USA.; Kivelson, SA (reprint author), Stanford Univ, Dept Appl Phys, Stanford, CA 94305 USA.; Zhu, D (reprint author), SLAC Natl Accelerator Lab, Linac Coherent Light Source, Menlo Pk, CA 94025 USA. EM kivelson@stanford.edu; dlzhu@slac.stanford.edu; jslee@slac.stanford.edu RI Gerber, Simon/A-4566-2012; Nojiri, Hiroyuki/B-3688-2011; OI Gerber, Simon/0000-0002-5717-2626; Liu, Yijin/0000-0002-8417-2488 FU Department of Energy (DOE), Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division [DE-AC02-76SF00515]; KAKENHI [23224009, 15K13510]; ICC-IMR; MD program; US DOE, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering [DE-FG02-99ER45772]; Natural Sciences and Engineering Research Council; Canadian Institute for Advanced Research FX This work was supported by Department of Energy (DOE), Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division Contract DE-AC02-76SF00515. X-ray FEL studies were carried out at the Linac Coherent Light Source, a Directorate of SLAC and an Office of Science User Facility operated for the US DOE, Office of Science by Stanford University. Resonant soft X-ray scattering measurements were carried out at the Stanford Synchrotron Radiation Lightsource (BL13-3), a Directorate of SLAC and an Office of Science User Facility operated for the US DOE, Office of Science by Stanford University. This work was also supported by KAKENHI Grants 23224009, 15K13510, ICC-IMR, and MD program (to H.N.); and US DOE, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering, Award DE-FG02-99ER45772 (to C.A.B.). Materials development was supported by the Natural Sciences and Engineering Research Council and by the Canadian Institute for Advanced Research. NR 33 TC 1 Z9 1 U1 10 U2 10 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 20 PY 2016 VL 113 IS 51 BP 14645 EP 14650 DI 10.1073/pnas.1612849113 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF0VR UT WOS:000390044900047 PM 27930313 ER PT J AU Allorent, G Lefebvre-Legendre, L Chappuis, R Kuntz, M Truong, TB Niyogi, KK Ulm, R Goldschmidt-Clermont, M AF Allorent, Guillaume Lefebvre-Legendre, Linnka Chappuis, Richard Kuntz, Marcel Truong, Thuy B. Niyogi, Krishna K. Ulm, Roman Goldschmidt-Clermont, Michel TI UV-B photoreceptor-mediated protection of the photosynthetic machinery in Chlamydomonas reinhardtii SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE nonphotochemical quenching; UV-B photoreceptor; PSBS; LHCSR1; photoprotection ID HIGH LIGHT; SIGNAL-TRANSDUCTION; ACTION SPECTRUM; ARABIDOPSIS; PROTEIN; PLANTS; STRESS; COP1; ACCLIMATION; PERCEPTION AB Life on earth is dependent on the photosynthetic conversion of light energy into chemical energy. However, absorption of excess sunlight can damage the photosynthetic machinery and limit photosynthetic activity, thereby affecting growth and productivity. Photosynthetic light harvesting can be down-regulated by nonphotochemical quenching (NPQ). A major component of NPQ is qE (energy-dependent nonphotochemical quenching), which allows dissipation of light energy as heat. Photodamage peaks in the UV-B part of the spectrum, but whether and how UV-B induces qE are unknown. Plants are responsive to UV-B via the UVR8 photoreceptor. Here, we report in the green alga Chlamydomonas reinhardtii that UVR8 induces accumulation of specific members of the light-harvesting complex (LHC) superfamily that contribute to qE, in particular LHC Stress-Related 1 (LHCSR1) and Photosystem II Subunit S (PSBS). The capacity for qE is strongly induced by UV-B, although the patterns of qE-related proteins accumulating in response to UV-B or to high light are clearly different. The competence for qE induced by acclimation to UV-B markedly contributes to photoprotection upon subsequent exposure to high light. Our study reveals an anterograde link between photoreceptor-mediated signaling in the nucleocytosolic compartment and the photoprotective regulation of photosynthetic activity in the chloroplast. C1 [Allorent, Guillaume; Lefebvre-Legendre, Linnka; Chappuis, Richard; Ulm, Roman; Goldschmidt-Clermont, Michel] Univ Geneva, Dept Bot & Plant Biol Sci 3, CH-1211 Geneva, Switzerland. [Kuntz, Marcel] Univ Grenoble Alpes, Inst Natl Rech Agron, CNRS,Lab Physiol Cellulaire & Vegetale, Commissariatat Energie Atom & Energies Alternat, F-38054 Grenoble, France. [Truong, Thuy B.; Niyogi, Krishna K.] Univ Calif Berkeley, Howard Hughes Med Inst, Dept Plant & Microbial Biol, Berkeley, CA 94720 USA. [Truong, Thuy B.; Niyogi, Krishna K.] Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Bioimaging Div, Berkeley, CA 94720 USA. [Ulm, Roman; Goldschmidt-Clermont, Michel] Univ Geneva, Inst Genet & Genom Geneva, CH-1211 Geneva, Switzerland. RP Ulm, R; Goldschmidt-Clermont, M (reprint author), Univ Geneva, Dept Bot & Plant Biol Sci 3, CH-1211 Geneva, Switzerland.; Ulm, R; Goldschmidt-Clermont, M (reprint author), Univ Geneva, Inst Genet & Genom Geneva, CH-1211 Geneva, Switzerland. EM roman.ulm@unige.ch; michel.goldschmidt-clermont@unige.ch FU Swiss National Science Foundation [31003A_153475, 31003A_146300]; European Research Council under the European Union's Seventh Framework Programme [310539]; University of Geneva; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division [449B]; Gordon and Betty Moore Foundation [GBMF3070] FX We thank Martin Jonikas and the Chlamydomonas stock center for providing the uvr8 mutant; Michael Hippler and Dimitris Petroutsos for the anti-LHCSR3 antibody; Donald Weeks for the anti-tubulin antibody; Sabeeha Merchant for the anti-CF1 antibody; Sylvain Loubery for help with statistical analyses; and Giovanni Finazzi, Michael Hothorn, Dimitris Petroutsos, and Jean-David Rochaix for helpful comments on the manuscript. This work was supported by Swiss National Science Foundation Grants 31003A_153475 (to R.U.) and 31003A_146300 (to M.G.-C.); the European Research Council under the European Union's Seventh Framework Programme (Grant 310539 to R.U.); and the University of Geneva. Construction of the npq4 lhcsr1 mutant was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division under Field Work Proposal 449B. K.K.N. is an investigator for the Howard Hughes Medical Institute and the Gordon and Betty Moore Foundation (through Grant GBMF3070). NR 50 TC 0 Z9 0 U1 15 U2 15 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 20 PY 2016 VL 113 IS 51 BP 14864 EP 14869 DI 10.1073/pnas.1607695114 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF0VR UT WOS:000390044900084 PM 27930292 ER PT J AU Lee, KT Yao, Y He, JW Fisher, B Sheng, X Lumb, M Xu, L Anderson, MA Scheiman, D Han, SY Kang, YS Gumus, A Bahabry, RR Lee, JW Paik, U Bronstein, ND Alivisatos, AP Meitl, M Burroughs, S Hussain, MM Lee, JC Nuzzo, RG Rogers, JA AF Lee, Kyu-Tae Yao, Yuan He, Junwen Fisher, Brent Sheng, Xing Lumb, Matthew Xu, Lu Anderson, Mikayla A. Scheiman, David Han, Seungyong Kang, Yongseon Gumus, Abdurrahman Bahabry, Rabab R. Lee, Jung Woo Paik, Ungyu Bronstein, Noah D. Alivisatos, A. Paul Meitl, Matthew Burroughs, Scott Hussain, Muhammad Mustafa Lee, Jeong Chul Nuzzo, Ralph G. Rogers, John A. TI Concentrator photovoltaic module architectures with capabilities for capture and conversion of full global solar radiation SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE photovoltaics; multijunction solar cells; concentration optics; diffuse light capture ID LUMINESCENT WAVE-GUIDES; CPV MODULE; CELLS; EFFICIENCY; DESIGN; PROGRESS; DEVICES; SYSTEM; COST AB Emerging classes of concentrator photovoltaic (CPV) modules reach efficiencies that are far greater than those of even the highest performance flat-plate PV technologies, with architectures that have the potential to provide the lowest cost of energy in locations with high direct normal irradiance (DNI). A disadvantage is their inability to effectively use diffuse sunlight, thereby constraining widespread geographic deployment and limiting performance even under the most favorable DNI conditions. This study introduces a module design that integrates capabilities in flat-plate PV directly with the most sophisticated CPV technologies, for capture of both direct and diffuse sunlight, thereby achieving efficiency in PV conversion of the global solar radiation. Specific examples of this scheme exploit commodity silicon (Si) cells integrated with two different CPV module designs, where they capture light that is not efficiently directed by the concentrator optics onto large-scale arrays of miniature multi-junction (MJ) solar cells that use advanced III-V semiconductor technologies. In this CPV+ scheme ("+" denotes the addition of diffuse collector), the Si and MJ cells operate independently on indirect and direct solar radiation, respectively. On-sun experimental studies of CPV+ modules at latitudes of 35.9886 degrees N (Durham, NC), 40.1125 degrees N (Bondville, IL), and 38.9072 degrees N (Washington, DC) show improvements in absolute module efficiencies of between 1.02% and 8.45% over values obtained using otherwise similar CPV modules, depending on weather conditions. These concepts have the potential to expand the geographic reach and improve the cost-effectiveness of the highest efficiency forms of PV power generation. C1 [Lee, Kyu-Tae; Han, Seungyong; Kang, Yongseon; Lee, Jung Woo; Lee, Jeong Chul; Nuzzo, Ralph G.; Rogers, John A.] Univ Illinois, Dept Mat Sci & Engn, Urbana, IL 61801 USA. [Lee, Kyu-Tae; Han, Seungyong; Kang, Yongseon; Lee, Jung Woo; Lee, Jeong Chul; Nuzzo, Ralph G.; Rogers, John A.] Univ Illinois, Frederick Seitz Mat Res Lab, Urbana, IL 61801 USA. [Yao, Yuan; He, Junwen; Xu, Lu; Anderson, Mikayla A.; Nuzzo, Ralph G.; Rogers, John A.] Univ Illinois, Dept Chem, Urbana, IL 61801 USA. [Fisher, Brent; Meitl, Matthew; Burroughs, Scott] Semprius, Durham, NC 27713 USA. [Sheng, Xing] Tsinghua Univ, Dept Elect Engn, Beijing 100084, Peoples R China. [Lumb, Matthew] George Washington Univ, Washington, DC 20037 USA. [Lumb, Matthew; Scheiman, David] US Naval Res Lab, Washington, DC 20375 USA. [Gumus, Abdurrahman; Bahabry, Rabab R.; Hussain, Muhammad Mustafa] King Abdullah Univ Sci & Technol, Elect & Math Sci & Engn Div, Integrated Nanotechnol Lab, Thuwal, Saudi Arabia. [Lee, Jung Woo; Paik, Ungyu] Hanyang Univ, Dept Mat Sci & Engn, Seoul 133791, South Korea. [Lee, Jung Woo; Paik, Ungyu] Hanyang Univ, Dept Energy Engn, Seoul 133791, South Korea. [Bronstein, Noah D.; Alivisatos, A. Paul] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Alivisatos, A. Paul] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Alivisatos, A. Paul] Univ Calif Berkeley, Kavli Energy NanoSci Inst, Berkeley, CA 94720 USA. [Alivisatos, A. Paul] Lawrence Berkeley Natl Lab, Mat Sci Div, Berkeley, CA 94720 USA. RP Lee, JC; Nuzzo, RG; Rogers, JA (reprint author), Univ Illinois, Dept Mat Sci & Engn, Urbana, IL 61801 USA.; Lee, JC; Nuzzo, RG; Rogers, JA (reprint author), Univ Illinois, Frederick Seitz Mat Res Lab, Urbana, IL 61801 USA.; Nuzzo, RG; Rogers, JA (reprint author), Univ Illinois, Dept Chem, Urbana, IL 61801 USA. EM jcleegm@illinois.edu; r-nuzzo@illinois.edu; jrogers@illinois.edu RI Sheng, Xing/B-7661-2011; Alivisatos , Paul /N-8863-2015 OI Sheng, Xing/0000-0002-8744-1700; Alivisatos , Paul /0000-0001-6895-9048 FU US Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-SC0001293]; Advanced Research Projects Agency-Energy, US Department of Energy [DE-AR0000624]; Global Research Laboratory Program through the National Research Foundation of Korea - Ministry of Science [K20704000003TA050000310]; King Abdullah University of Science and Technology Technology Transfer Office [GEN/1/4014-01-01]; National Natural Science Foundation of China [51602172] FX This work is part of the "Light-Material Interactions in Energy Conversion" Energy Frontier Research Center (to K.-T.L., Y.Y., J.H., X.S., L.X., M.A.A., N.D.B., A.P.A., R.G.N., and J.A.R.) funded by the US Department of Energy, Office of Science, Office of Basic Energy Sciences under Award DE-SC0001293. The work presented here was funded in part by the Advanced Research Projects Agency-Energy, US Department of Energy, under Award DE-AR0000624. J.W.L. and U.P. are supported by the Global Research Laboratory Program (K20704000003TA050000310) through the National Research Foundation of Korea funded by the Ministry of Science. A.G., R.R.B., and M.M.H. are supported by the King Abdullah University of Science and Technology Technology Transfer Office under Award GEN/1/4014-01-01. X.S. acknowledges support from National Natural Science Foundation of China (Project 51602172). NR 47 TC 1 Z9 1 U1 13 U2 13 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 20 PY 2016 VL 113 IS 51 BP E8210 EP E8218 DI 10.1073/pnas.1617391113 PG 9 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF0VR UT WOS:000390044900001 PM 27930331 ER PT J AU Zhu, XH Hitchcock, AP Bazylinski, DA Denes, P Joseph, J Lins, U Marchesini, S Shiu, HW Tyliszczak, T Shapiro, DA AF Zhu, Xiaohui Hitchcock, Adam P. Bazylinski, Dennis A. Denes, Peter Joseph, John Lins, Ulysses Marchesini, Stefano Shiu, Hung-Wei Tyliszczak, Tolek Shapiro, David A. TI Measuring spectroscopy and magnetism of extracted and intracellular magnetosomes using soft X-ray ptychography SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE ptychography; magnetotactic bacteria; biomineralization; STXM; XAS-XMCD ID MAGNETOTACTIC BACTERIA; ELECTRON HOLOGRAPHY; FORCE MICROSCOPY; ZONE PLATES; BIOMINERALIZATION; RESOLUTION; FE; MAGNETORECEPTION; MICROSTRUCTURE; TOMOGRAPHY AB Characterizing the chemistry and magnetism of magnetotactic bacteria (MTB) is an important aspect of understanding the biomineralization mechanism and function of the chains of magnetosomes (Fe3O4 nanoparticles) found in such species. Images and X-ray absorption spectra (XAS) of magnetosomes extracted from, and magnetosomes in, whole Magnetovibrio blakemorei strain MV-1 cells have been recorded using soft X-ray ptychography at the Fe 2p edge. A spatial resolution of 7 nm is demonstrated. Precursor-like and immature magnetosome phases in a whole MV-1 cell were visualized, and their Fe 2p spectra were measured. Based on these results, a model for the pathway of magnetosome biomineralization for MV-1 is proposed. Fe 2p X-ray magnetic circular dichroism (XMCD) spectra have been derived from ptychography image sequences recorded using left and right circular polarization. The shape of the XAS and XMCD signals in the ptychographic absorption spectra of both sample types is identical to the shape and signals measured with conventional bright-field scanning transmission X-ray microscope. A weaker and inverted XMCD signal was observed in the ptychographic phase spectra of the extracted magnetosomes. The XMCD ptychographic phase spectrum of the intracellular magnetosomes differed from the ptychographic phase spectrum of the extracted magnetosomes. These results demonstrate that spectro-ptychography offers a superior means of characterizing the chemical and magnetic properties of MTB at the individual magnetosome level. C1 [Zhu, Xiaohui; Hitchcock, Adam P.] McMaster Univ, Dept Chem & Chem Biol, Hamilton, ON L8S 4M1, Canada. [Bazylinski, Dennis A.] Univ Nevada, Sch Life Sci, Las Vegas, NV 89154 USA. [Denes, Peter; Marchesini, Stefano; Shiu, Hung-Wei; Tyliszczak, Tolek; Shapiro, David A.] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Joseph, John] Lawrence Berkeley Natl Lab, Engn Div, Berkeley, CA 94720 USA. [Lins, Ulysses] Univ Fed Rio de Janeiro, Inst Microbiol, BR-2194590 Rio De Janeiro, RJ, Brazil. [Shiu, Hung-Wei] Nat Synchrotron Radiat Res Ctr, Hsinchu 30076, Taiwan. RP Hitchcock, AP (reprint author), McMaster Univ, Dept Chem & Chem Biol, Hamilton, ON L8S 4M1, Canada. EM aph@mcmaster.ca FU Canada Foundation for Innovation; Natural Sciences and Engineering Research Council (NSERC); Canadian Institute for Health Research; National Research Council; University of Saskatchewan; NSERC; Canada Research Chairs; Division of Basic Energy Sciences of the US Department of Energy [DE-AC02-05CH11231]; Center for Applied Mathematics for Energy Research Applications; US National Science Foundation [EAR-1423939] FX We thank Dr. Chunpeng Wang (Shanghai Institute of Applied Physics) for his spatial resolution analysis with the power spectral density method. Some scanning transmission X-ray microscope (STXM) results were measured at the STXM on beamline 10ID1 at the Canadian Light Source, which is supported by the Canada Foundation for Innovation, Natural Sciences and Engineering Research Council (NSERC), the Canadian Institute for Health Research, the National Research Council, and University of Saskatchewan. This research was funded by the NSERC and Canada Research Chairs. Most measurements were made at the 5.3.2.1 and 11.0.2 beamlines at the ALS, which is supported by the Division of Basic Energy Sciences of the US Department of Energy under Contract DE-AC02-05CH11231. This work is also partially supported by the Center for Applied Mathematics for Energy Research Applications, which is a partnership between Basic Energy Sciences and Advanced Scientific Computing Research at the US Department of Energy. D.A.B. is supported by US National Science Foundation Grant EAR-1423939. NR 64 TC 0 Z9 0 U1 18 U2 18 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 20 PY 2016 VL 113 IS 51 BP E8219 EP E8227 DI 10.1073/pnas.1610260114 PG 9 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF0VR UT WOS:000390044900002 PM 27930297 ER PT J AU Demarteau, M Lipton, R Nicholson, H Shipsey, I AF Demarteau, M. Lipton, R. Nicholson, H. Shipsey, I. TI Particle and nuclear physics instrumentation and its broad connections SO REVIEWS OF MODERN PHYSICS LA English DT Article ID TRACKING DETECTORS; NEUTRON-RADIOGRAPHY; SIMULATION TOOLKIT; PIXEL DETECTORS; TIMEPIX; RECONSTRUCTION; RESOLUTION; CHAMBERS; DESIGN; SYSTEM AB Subatomic physics shares with other basic sciences the need to innovate, invent, and develop tools, techniques, and technologies to carry out its mission to explore the nature of matter, energy, space, and time. In some cases, entire detectors or technologies developed specifically for particle physics research have been adopted by other fields of research or in commercial applications. In most cases, however, the development of new devices and technologies by particle physics for its own research has added value to other fields of research or to applications beneficial to society by integrating them in the existing technologies. Thus, detector research and development has not only advanced the current state of technology for particle physics, but has often advanced research in other fields of science and has underpinned progress in numerous applications in medicine and national security. At the same time particle physics has profited immensely from developments in industry and applied them to great benefit for the use of particle physics detectors. This symbiotic relationship has seen strong mutual benefits with sometimes unexpected far reach. C1 [Demarteau, M.] Argonne Natl Lab, Div High Energy Phys, 9700 South Cass Ave, Argonne, IL 60439 USA. [Lipton, R.] Fermilab Natl Accelerator Lab, Batavia, IL 60510 USA. [Nicholson, H.] Mt Holyoke Coll, Dept Phys, S Hadley, MA 01075 USA. [Shipsey, I.] Univ Oxford, Dept Phys, Denys Wilkinson Bldg,Keble Rd, Oxford OX1 3RH, England. RP Demarteau, M (reprint author), Argonne Natl Lab, Div High Energy Phys, 9700 South Cass Ave, Argonne, IL 60439 USA. EM demarteau@anl.gov; lipton@fnal.gov; hnichols@mtholyoke.edu; shipsey@physics.ox.ac.uk FU Argonne National Laboratory; Fermi National Accelerator Laboratory; U.S. Department of Energy Office of Science [DE-4122 AC02-06CH11357, DE-AC02-07CH11359]; University of Oxford; Science and Technology Facilities Council of the United Kingdom FX The authors acknowledge the support and assistance of Paul Grannis. We also acknowledge support from the Argonne National Laboratory, the Fermi National Accelerator Laboratory, operated by the U.S. Department of Energy Office of Science under Contracts No. DE-4122 AC02-06CH11357 and No. DE-AC02-07CH11359, respectively, as well as the support from the University of Oxford, and the Science and Technology Facilities Council of the United Kingdom. NR 142 TC 0 Z9 0 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0034-6861 EI 1539-0756 J9 REV MOD PHYS JI Rev. Mod. Phys. PD DEC 20 PY 2016 VL 88 IS 4 DI 10.1103/RevModPhys.88.045007 PG 40 WC Physics, Multidisciplinary SC Physics GA EF4MJ UT WOS:000390302900001 ER PT J AU Majdak, P Ossyra, JR Ossyra, JM Cobert, AJ Hofmann, GC Tse, S Panozzo, B Grogan, EL Sorokina, A Rhodes, JS AF Majdak, Petra Ossyra, John R. Ossyra, Jessica M. Cobert, Adam J. Hofmann, Gabrielle C. Tse, Stephen Panozzo, Brent Grogan, Elizabeth L. Sorokina, Anastassia Rhodes, Justin S. TI A new mouse model of ADHD for medication development SO SCIENTIFIC REPORTS LA English DT Article ID ATTENTION-DEFICIT/HYPERACTIVITY-DISORDER; DEFICIT HYPERACTIVITY DISORDER; SPONTANEOUS-ALTERNATION BEHAVIOR; D-AMPHETAMINE; SUSTAINED ATTENTION; INBRED STRAINS; FUNCTIONAL MRI; WISTAR-KYOTO; ANIMAL-MODEL; RAT STRAINS AB ADHD is a major societal problem with increasing incidence and a stagnant track record for treatment advances. A lack of appropriate animal models has partly contributed to the incremental advance of this field. Hence, our goal was to generate a novel mouse model that could be useful for ADHD medication development. We reasoned that hyperactivity is a core feature of ADHD that could easily be bred into a population, but to what extent other hallmark features of ADHD would appear as correlated responses was unknown. Hence, starting from a heterogeneous population, we applied within-family selection over 16 generations to produce a High-Active line, while simultaneously maintaining an unselected line to serve as the Control. We discovered that the High-Active line demonstrated motor impulsivity in two different versions of the Go/No-go test, which was ameliorated with a low dose of amphetamine, and further displayed hypoactivation of the prefrontal cortex and dysregulated cerebellar vermal activation as indexed by c-Fos immunohistochemical staining. We conclude that the High-Active line represents a valid model for the Hyperactive-Impulsive subtype of ADHD and therefore may be used in future studies to advance our understanding of the etiology of ADHD and screen novel compounds for its treatment. C1 [Majdak, Petra; Rhodes, Justin S.] Univ Illinois, Neurosci Program, Chicago, IL 60680 USA. [Majdak, Petra; Tse, Stephen; Panozzo, Brent; Grogan, Elizabeth L.; Sorokina, Anastassia; Rhodes, Justin S.] Univ Illinois, Beckman Inst Adv Sci & Technol, Chicago, IL 60680 USA. [Ossyra, John R.] Univ Tennessee, Oak Ridge Natl Lab, Knoxville, TN USA. [Ossyra, Jessica M.] Univ Tennessee, Coll Engn, Knoxville, TN USA. [Cobert, Adam J.] Univ Calif Davis, Dept Food Sci & Technol, Davis, CA 95616 USA. [Hofmann, Gabrielle C.] Univ Illinois, Coll Vet Med, Chicago, IL 60680 USA. [Rhodes, Justin S.] Univ Illinois, Dept Psychol, Chicago, IL 60680 USA. RP Majdak, P (reprint author), Univ Illinois, Neurosci Program, Chicago, IL 60680 USA.; Majdak, P (reprint author), Univ Illinois, Beckman Inst Adv Sci & Technol, Chicago, IL 60680 USA. EM pmajda2@illinois.edu NR 68 TC 0 Z9 0 U1 7 U2 7 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 20 PY 2016 VL 6 AR 39472 DI 10.1038/srep39472 PG 18 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE9XU UT WOS:000389980500001 PM 27996970 ER PT J AU Namhata, A Oladyshkin, S Dilmore, RM Zhang, LW Nakles, DV AF Namhata, Argha Oladyshkin, Sergey Dilmore, Robert M. Zhang, Liwei Nakles, David V. TI Probabilistic Assessment of Above Zone Pressure Predictions at a Geologic Carbon Storage Site SO SCIENTIFIC REPORTS LA English DT Article ID GLOBAL SENSITIVITY-ANALYSIS; POLYNOMIAL CHAOS EXPANSION; DRIVEN UNCERTAINTY QUANTIFICATION; REDUCED-ORDER MODELS; CO2-EOR FIELD; RISK ANALYSIS; SEQUESTRATION; DIOXIDE; IMPACTS; LEAKAGE AB Carbon dioxide (CO2) storage into geological formations is regarded as an important mitigation strategy for anthropogenic CO2 emissions to the atmosphere. This study first simulates the leakage of CO2 and brine from a storage reservoir through the caprock. Then, we estimate the resulting pressure changes at the zone overlying the caprock also known as Above Zone Monitoring Interval (AZMI). A data-driven approach of arbitrary Polynomial Chaos (aPC) Expansion is then used to quantify the uncertainty in the above zone pressure prediction based on the uncertainties in different geologic parameters. Finally, a global sensitivity analysis is performed with Sobol indices based on the aPC technique to determine the relative importance of different parameters on pressure prediction. The results indicate that there can be uncertainty in pressure prediction locally around the leakage zones. The degree of such uncertainty in prediction depends on the quality of site specific information available for analysis. The scientific results from this study provide substantial insight that there is a need for site-specific data for efficient predictions of risks associated with storage activities. The presented approach can provide a basis of optimized pressure based monitoring network design at carbon storage sites. C1 [Namhata, Argha; Nakles, David V.] Carnegie Mellon Univ, Dept Civil & Environm Engn, Pittsburgh, PA 15217 USA. [Namhata, Argha; Dilmore, Robert M.; Zhang, Liwei] US DOE, Natl Energy Technol Lab, 626 Cochrans Mill Rd, Pittsburgh, PA 15236 USA. [Oladyshkin, Sergey] Univ Stuttgart, Dept Stochast Simulat & Safety Res Hydrosyst IWS, Stuttgart, Germany. RP Namhata, A (reprint author), Carnegie Mellon Univ, Dept Civil & Environm Engn, Pittsburgh, PA 15217 USA.; Namhata, A (reprint author), US DOE, Natl Energy Technol Lab, 626 Cochrans Mill Rd, Pittsburgh, PA 15236 USA. EM anamhata@andrew.cmu.edu FU US Department of Energy's (DOE) Office of Fossil Energy's CCS Program; Department of Civil and Environmental Engineering; Oak Ridge Institute for Science & Education (ORISE); Bertucci fellowship program at Carnegie Mellon University; US Department of Energy's (DOE) Office of Fossil Energy's Crosscutting Research Program FX This work was completed as part of the National Risk Assessment Partnership (NRAP) project. Support for this project came from the US Department of Energy's (DOE) Office of Fossil Energy's CCS and Crosscutting Research Programs, by the Department of Civil and Environmental Engineering and the Bertucci fellowship program at Carnegie Mellon University, and by training fellowship through the Oak Ridge Institute for Science & Education (ORISE). The authors would like to thank Grant Bromhal, Traci Rodosta, Robert Romanosky, M. Kylee Rice, and Steven Seachman of NETL and Mark Ackwiecz and Regis Conrad of US DOE, Fossil Energy for their technical direction and Programmatic guidance; Mitchell Small and Athanasios Karamalidis of Carnegie Mellon University; Seth King and Ernest Lindner of AECOM, Inc. at NETL, and Ya-Mei Yang of NETL/ORISE at NETL for their valuable technical comments. The authors would also like to thank Dr. Haruko Wainwright, Dr. Erika Gasperikova and Dr. Tom Daley of the Lawrence Berkeley National Laboratory for providing valuable technical direction. NR 46 TC 0 Z9 0 U1 2 U2 2 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 20 PY 2016 VL 6 AR 39536 DI 10.1038/srep39536 PG 12 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE9YD UT WOS:000389981400001 PM 27996043 ER PT J AU Yuan, TY Vazquez, M Goldner, AN Xu, Y Contrucci, R Firestone, MA Olson, MA Fang, L AF Yuan, Tianyu Vazquez, Mariela Goldner, Amanda N. Xu, Yan Contrucci, Rafael Firestone, Millicent A. Olson, Mark A. Fang, Lei TI Versatile Thermochromic Supramolecular Materials Based on Competing Charge Transfer Interactions SO ADVANCED FUNCTIONAL MATERIALS LA English DT Article ID HOST-GUEST CHEMISTRY; TRANSFER COMPLEXES; SYMMETRY-BREAKING; DONOR-ACCEPTOR; DYNAMIC CHIRALITY; PI INTERACTIONS; 2 HOMOPOLYMERS; AMPHIPHILES; ASSEMBLIES; NANOFIBERS AB Stimuli-responsive supramolecular materials are of paramount importance for a broad range of applications. It is essential to impart versatility, sustainability, and scalability into these materials. Herein the authors report the design and synthesis of a new class of thermochromic supramolecular materials, which can easily be processed from water via a reversible sol-gel transition. The supramolecular materials are composed of a bis-bipyridinium acceptor, a pi-electron-rich naphthalene derivative donor, and halogen counterions. Long helical nanofibers can be assembled in water, gelating at room temperature. Inked designs, thin films, and aerogels are solution-processed to exhibit thermochromic behavior based on competing pi -> pi* and n -> pi* charge transfer interactions. By using different pi-electron rich donors, and counterions, the authors demonstrate that both the color observed at room temperature and at high temperatures can be tailored. The results open up the door to develop novel amphiphile-based thermochromes with water processability and a large tunable color palette. C1 [Yuan, Tianyu; Xu, Yan; Olson, Mark A.] Tianjin Univ, Sch Pharmaceut Sci & Technol, Tianjin 300072, Peoples R China. [Yuan, Tianyu; Vazquez, Mariela; Contrucci, Rafael; Fang, Lei] Texas A&M Univ, Dept Chem, 3255 TAMU, College Stn, TX 77840 USA. [Yuan, Tianyu; Fang, Lei] Texas A&M Univ, Mat Sci & Engn Dept, 3003 TAMU, College Stn, TX 77840 USA. [Goldner, Amanda N.; Olson, Mark A.] Texas A&M Univ Corpus Christi, Dept Phys & Environm Sci, 6300 Ocean Dr, Corpus Christi, TX 78412 USA. [Firestone, Millicent A.] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Mat Phys & Applicat, Los Alamos, NM 87545 USA. RP Olson, MA (reprint author), Tianjin Univ, Sch Pharmaceut Sci & Technol, Tianjin 300072, Peoples R China.; Fang, L (reprint author), Texas A&M Univ, Dept Chem, 3255 TAMU, College Stn, TX 77840 USA.; Fang, L (reprint author), Texas A&M Univ, Mat Sci & Engn Dept, 3003 TAMU, College Stn, TX 77840 USA.; Olson, MA (reprint author), Texas A&M Univ Corpus Christi, Dept Phys & Environm Sci, 6300 Ocean Dr, Corpus Christi, TX 78412 USA. EM molson@tju.edu.cn; fang@chem.tamu.edu RI Olson, Mark/C-1083-2008; Yuan, Tianyu/C-8824-2017 OI Olson, Mark/0000-0003-0398-5063; Yuan, Tianyu/0000-0002-6698-5178 FU National Basic Research Program of China [2015CB856500]; Welch Foundation Departmental Grant [BT-0041]; Texas AM University; DOE Office of Basic Energy Sciences; National Nuclear Security Administration of the U.S. Department of Energy [DE-AC52-06NA25396] FX This research was supported by the National Basic Research Program of China (2015CB856500), a Welch Foundation Departmental Grant (BT-0041) and start-up funds from Texas A&M University. Use of the Texas A&M University Materials Characterization Facility is acknowledged. This work was performed in part at the Center for Integrated Nanotechnologies (CINT) at Los Alamos National Laboratory (LANL) and funded by the DOE Office of Basic Energy Sciences. LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. NR 70 TC 0 Z9 0 U1 42 U2 42 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1616-301X EI 1616-3028 J9 ADV FUNCT MATER JI Adv. Funct. Mater. PD DEC 20 PY 2016 VL 26 IS 47 BP 8604 EP 8612 DI 10.1002/adfm.201603364 PG 9 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EF1XK UT WOS:000390118300004 ER PT J AU Hoffmann, M Pesic, M Chatterjee, K Khan, AI Salahuddin, S Slesazeck, S Schroeder, U Mikolajick, T AF Hoffmann, Michael Pesic, Milan Chatterjee, Korok Khan, Asif I. Salahuddin, Sayeef Slesazeck, Stefan Schroeder, Uwe Mikolajick, Thomas TI Direct Observation of Negative Capacitance in Polycrystalline Ferroelectric HfO2 SO ADVANCED FUNCTIONAL MATERIALS LA English DT Article ID NANOSCALE DEVICES; ROOM-TEMPERATURE; HAFNIUM OXIDE; VOLTAGE; FILMS AB To further reduce the power dissipation in nanoscale transistors, the fundamental limit posed by the Boltzmann distribution of electrons has to be overcome. Stabilization of negative capacitance in a ferroelectric gate insulator can be used to achieve this by boosting the transistor gate voltage. Up to now, negative capacitance is only directly observed in polymer and perovskite ferroelectrics, which are incompatible with semiconductor manufacturing. Recently discovered HfO2-based ferroelectrics, on the other hand, are ideally suited for this application because of their high scalability and semiconductor process compatibility. Here, for the first time, a direct measurement of negative capacitance in polycrystalline HfO2-based thin films is reported. Decreasing voltage with increasing charge transients are observed in 18 and 27 nm thin Gd:HfO2 capacitors in series with an external resistor. Furthermore, a multigrain Landau-Khalatnikov model is developed to successfully simulate this transient behavior in polycrystalline ferroelectrics with nucleation limited switching dynamics. Structural requirements for negative capacitance in such materials are discussed. These results demonstrate that negative capacitance effects are not limited to epitaxial ferroelectrics, thus significantly extending the range of potential applications. C1 [Hoffmann, Michael; Pesic, Milan; Salahuddin, Sayeef; Schroeder, Uwe; Mikolajick, Thomas] NaMLab gGmbH, Noethnitzer Str 64, D-01187 Dresden, Germany. [Hoffmann, Michael; Chatterjee, Korok; Khan, Asif I.; Salahuddin, Sayeef] Univ Calif Berkeley, Dept Elect Engn & Comp Sci, Berkeley, CA 94270 USA. [Salahuddin, Sayeef] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94270 USA. [Mikolajick, Thomas] Tech Univ Dresden, Chair Nanoelect Mat, D-01069 Dresden, Germany. RP Schroeder, U (reprint author), NaMLab gGmbH, Noethnitzer Str 64, D-01187 Dresden, Germany. EM uwe.schroeder@namlab.com OI Hoffmann, Michael/0000-0001-6493-3457 FU European Fund for Regional Development; Free State of Saxony; University of California, Berkeley FX M.H., M.P., U.S., St.Sl., and T.M. gratefully acknowledge the support by the European Fund for Regional Development and the Free State of Saxony. M.H. also acknowledges a visiting scholar fellowship from the University of California, Berkeley. NR 34 TC 2 Z9 2 U1 50 U2 50 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1616-301X EI 1616-3028 J9 ADV FUNCT MATER JI Adv. Funct. Mater. PD DEC 20 PY 2016 VL 26 IS 47 BP 8643 EP 8649 DI 10.1002/adfm.201602869 PG 7 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EF1XK UT WOS:000390118300008 ER PT J AU Gelin, M Tretiak, S Prezhdo, O AF Gelin, Maxim Tretiak, Sergei Prezhdo, Oleg TI Quantum Dynamics and Femtosecond Spectroscopy (in honor of Professor Vladimir Y. Chernyak on the occasion of his 60th birthday) Preface SO CHEMICAL PHYSICS LA English DT Editorial Material C1 [Gelin, Maxim] Tech Univ Munich, Dept Chem, Garching, Germany. [Tretiak, Sergei] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM USA. [Prezhdo, Oleg] Univ Southern Calif, Dept Chem, Los Angeles, CA 90089 USA. RP Gelin, M (reprint author), Tech Univ Munich, Dept Chem, Garching, Germany. RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 NR 0 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 1 EP 2 DI 10.1016/j.chemphys.2016.11.003 PG 2 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700001 ER PT J AU Li, FX Sinitsyn, NA AF Li, Fuxiang Sinitsyn, Nikolai A. TI Dynamic symmetries and quantum nonadiabatic transitions SO CHEMICAL PHYSICS LA English DT Article ID BOW-TIE MODEL; ZENER; INTERFERENCE AB Kramers degeneracy theorem is one of the basic results in quantum mechanics. According to it, the time-reversal symmetry makes each energy level of a half-integer spin system at least doubly degenerate, meaning the absence of transitions or scatterings between degenerate states if the Hamiltonian does not depend on time explicitly. We generalize this result to the case of explicitly time-dependent spin Hamiltonians. We prove that for a spin system with the total spin being a half integer, if its Hamiltonian and the evolution time interval are symmetric under a specifically defined time reversal operation, the scattering amplitude between an arbitrary initial state and its time reversed counterpart is exactly zero. We also discuss applications of this result to the multistate Landau-Zener (LZ) theory. (C) 2016 Elsevier B.V. All rights reserved. C1 [Li, Fuxiang] Los Alamos Natl Lab, Ctr Nonlinear Studies, Los Alamos, NM 87545 USA. [Li, Fuxiang; Sinitsyn, Nikolai A.] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Sinitsyn, NA (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. EM nsinitsyn@lanl.gov FU National Nuclear Security Administration of the U.S. Department of Energy at Los Alamos National Laboratory [DE-AC52-06NA25396]; LDRD program at LANL FX The work was carried out under the auspices of the National Nuclear Security Administration of the U.S. Department of Energy at Los Alamos National Laboratory under Contract No. DE-AC52-06NA25396. Authors also thank the support from the LDRD program at LANL. NR 26 TC 0 Z9 0 U1 5 U2 5 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 28 EP 33 DI 10.1016/j.chemphys.2016.05.029 PG 6 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700005 ER PT J AU Nelson, T Naumov, A Fernandez-Alberti, S Tretiak, S AF Nelson, Tammie Naumov, Artem Fernandez-Alberti, Sebastian Tretiak, Sergei TI Nonadiabatic excited-state molecular dynamics: On-the-fly limiting of essential excited states SO CHEMICAL PHYSICS LA English DT Article DE Fewest switches surface hopping; NA-ESMD; Excited state limiting; Local kinetic energy; Poly-phenylene vinylene; Poly-phenylene ethynylene ID PROTON-TRANSFER; ENERGY-TRANSFER; CONJUGATED MOLECULES; SIMULATIONS; EXCITATIONS; TRANSITIONS; COUPLINGS; COHERENCE; MODEL AB The simulation of nonadiabatic dynamics in extended molecular systems involving hundreds of atoms and large densities of states is particularly challenging. Nonadiabatic coupling terms (NACTs) represent a significant numerical bottleneck in surface hopping approaches. Rather than using unreliable NACT cutting schemes, here we develop "on-the-fly" state limiting methods to eliminate states that are no longer essential for the non-radiative relaxation dynamics as a trajectory proceeds. We propose a state number criteria and an energy-based state limit. The latter is more physically relevant by requiring a user-imposed energy threshold. For this purpose, we introduce a local kinetic energy gauge by summing contributions from atoms within the spatial localization of the electronic wavefunction to define the energy available for upward hops. The proposed state limiting schemes are implemented within the nonadiabatic excited-state molecular dynamics framework to simulate photoinduced relaxation in poly-phenylene vinylene (PPV) and branched poly-phenylene ethynylene (PPE) oligomers for benchmark evaluation. (C) 2016 Published by Elsevier B.V. C1 [Nelson, Tammie; Tretiak, Sergei] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Naumov, Artem] Skolkovo Inst Sci & Technol, Moscow 143026, Russia. [Fernandez-Alberti, Sebastian] Univ Nacl Quilmes, Roque Saenz Pea 352,B1876BXD, Bernal, Argentina. RP Tretiak, S (reprint author), Los Alamos Natl Lab, Los Alamos, NM 87545 USA. EM serg@lanl.gov RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU U.S. Department of Energy through the Los Alamos National Laboratory (LANL) LDRD Program; U.S. Department of Energy [DE-AC52-06NA25396]; Center for Nonlinear Studies (CNLS) at LANL; Center for Integrated Nanotechnology (CINT) at LANL; CONICET; UNQ; ANPCyT [PICT-2010-2375] FX We thank V.Y. Chernyak for many fruitful discussions that helped to develop the NA-ESMD framework. This research used resources provided by the Los Alamos National Laboratory Institutional Computing Program. We acknowledge support of the U.S. Department of Energy through the Los Alamos National Laboratory (LANL) LDRD Program. LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. We also acknowledge support of the Center for Nonlinear Studies (CNLS) and the Center for Integrated Nanotechnology (CINT) at LANL. S.F.A. is supported by CONICET, UNQ, ANPCyT (PICT-2010-2375). NR 39 TC 1 Z9 1 U1 4 U2 4 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 84 EP 90 DI 10.1016/j.chemphys.2016.05.017 PG 7 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700012 ER PT J AU Li, H Wu, C Malinin, SV Tretiak, S Chernyak, VY AF Li, Hao Wu, Chao Malinin, Sergey V. Tretiak, Sergei Chernyak, Vladimir Y. TI Exciton scattering approach for optical spectra calculations in branched conjugated macromolecules SO CHEMICAL PHYSICS LA English DT Article DE Exciton; Scattering; Conjugation; Dendrimers; Electronic excitations; Excited states; Branched structures; ES approach; Scattering phase; Transition dipoles ID ENERGY-LOSS SPECTROSCOPY; ELECTRONIC EXCITATIONS; ORGANIC DENDRIMERS; SOLAR-CELLS; MOLECULES; OLIGOMERS; COHERENCE; POLYMERS; POLARIZABILITIES; DONOR AB The exciton scattering (ES) technique is a multiscale approach based on the concept of a particle in a box and developed for efficient calculations of excited-state electronic structure and optical spectra in low-dimensional conjugated macromolecules. Within the ES method, electronic excitations in molecular structure are attributed to standing waves representing quantum quasi-particles (excitons), which reside on the graph whose edges and nodes stand for the molecular linear segments and vertices, respectively. Exciton propagation on the linear segments is characterized by the exciton dispersion, whereas exciton scattering at the branching centers is determined by the energy-dependent scattering matrices. Using these ES energetic parameters, the excitation energies are then found by solving a set of generalized "particle in a box" problems on the graph that represents the molecule. Similarly, unique energy-dependent ES dipolar parameters permit calculations of the corresponding oscillator strengths, thus, completing optical spectra modeling. Both the energetic and dipolar parameters can be extracted from quantum-chemical computations in small molecular fragments and tabulated in the ES library for further applications. Subsequently, spectroscopic modeling for any macrostructure within a considered molecular family could be performed with negligible numerical effort. We demonstrate the ES method application to molecular families of branched conjugated phenylacetylenes and ladder poly-para-phenylenes, as well as structures with electron donor and acceptor chemical substituents. Time-dependent density functional theory (TD-DFT) is used as a reference model for electronic structure. The ES calculations accurately reproduce the optical spectra compared to the reference quantum chemistry results, and make possible to predict spectra of complex macromolecules, where conventional electronic structure calculations are unfeasible. (C) 2016 Elsevier B.V. All rights reserved. C1 [Li, Hao] Univ Houston, Dept Chem, Houston, TX 77204 USA. [Wu, Chao] Xi An Jiao Tong Univ, Frontier Inst Sci & Technol, Elect Struct Lab, Ctr Microscop Theory & Simulat, Xian 710054, Peoples R China. [Malinin, Sergey V.; Chernyak, Vladimir Y.] Wayne State Univ, Dept Chem, 5101 Cass Ave, Detroit, MI 48202 USA. [Tretiak, Sergei] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. [Tretiak, Sergei] Los Alamos Natl Lab, Ctr Nonlinear Studies, Los Alamos, NM 87545 USA. [Tretiak, Sergei] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. RP Tretiak, S (reprint author), Wayne State Univ, Dept Chem, 5101 Cass Ave, Detroit, MI 48202 USA. EM serg@lanl.gov; chernyak@chem.wayne.edu RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU National Science Foundation [CHE-1111350]; Directed Research and Development Funds at Los Alamos National Laboratory (LANL); Center for Integrated Nanotechnology at Los Alamos National Laboratory (LANL); Center for Nonlinear Studies at Los Alamos National Laboratory (LANL); U.S. Department of Energy [DE-AC52-06NA25396] FX This material is based upon work supported by the National Science Foundation under Grant No. CHE-1111350. We acknowledge support of Directed Research and Development Funds, Center for Integrated Nanotechnology and Center for Nonlinear Studies at Los Alamos National Laboratory (LANL). LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. NR 50 TC 0 Z9 0 U1 4 U2 4 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 124 EP 132 DI 10.1016/j.chemphys.2016.08.033 PG 9 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700017 ER PT J AU Zhugayevych, A Postupna, O Wang, HL Tretiak, S AF Zhugayevych, Andriy Postupna, Olena Wang, Hsing-Lin Tretiak, Sergei TI Modification of optoelectronic properties of conjugated oligomers due to donor/acceptor functionalization: DFT study SO CHEMICAL PHYSICS LA English DT Article DE Functionalized p-phenylene vinylene; Distyrylbenzene; Molecular descriptor; Push-pull functionalization; Structure-property relationship ID POLARIZABLE CONTINUUM MODEL; 2-PHOTON ABSORPTION; ELECTRONIC-PROPERTIES; EXCITED-STATES; BASIS-SETS; SOLVATION MODELS; CHARGE-TRANSFER; LARGE MOLECULES; DENSITY; CHROMOPHORES AB A comprehensive DFT study of a set of oligo(p-phenylene vinylene) molecules is performed to understand the structural and electronic changes upon functionalization. These changes are rationalized within a model considering frontier molecular orbitals of the p-conjugated system and sigma-bonding orbital by which the functional group is attached to the host molecule. Two simple scalar quantum chemical descriptors are shown to correlate with optoelectronic properties of the functionalized molecule: the electronegativity and the relative electric dipole moment of the smallest pi-closed shell subsystem containing the functional group and the terminal segment of the host molecule (phenyl). Both descriptors correlate linearly with the empirical Hammett sigma(p) constant for a set of 24 functional groups. Comparison with available experimental data on UV-vis absorption and cyclic voltammetry is made. Observed structural changes reflect changes in the electronic density. (C) 2016 Elsevier B.V. All rights reserved. C1 [Zhugayevych, Andriy; Tretiak, Sergei] Skolkovo Inst Sci & Technol, Moscow 143026, Russia. [Postupna, Olena; Wang, Hsing-Lin; Tretiak, Sergei] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Zhugayevych, A (reprint author), Skolkovo Inst Sci & Technol, Moscow 143026, Russia. EM a.zhugayevych@skoltech.ru RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU Directed Research and Development Fund at Los Alamos National Laboratory (LANL) - United States; Center for Integrated Nanotechnology (CINT) at Los Alamos National Laboratory (LANL) - United States; Center for Nonlinear Studies (CNLS) at Los Alamos National Laboratory (LANL) - United States; U.S. Department of Energy [DE-AC52-06NA25396] FX We acknowledge support of Directed Research and Development Fund, Center for Integrated Nanotechnology (CINT) and Center for Nonlinear Studies (CNLS) at Los Alamos National Laboratory (LANL) - United States. LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. NR 74 TC 0 Z9 0 U1 4 U2 4 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 133 EP 143 DI 10.1016/j.chemphys.2016.09.009 PG 11 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700018 ER PT J AU Dandu, N Tretiak, S Kilina, S Kilin, D AF Dandu, Naveen Tretiak, Sergei Kilina, Svetlana Kilin, Dmitri TI Through space and through bridge channels of charge transfer at p-n nano-junctions: A DFT study SO CHEMICAL PHYSICS LA English DT Article DE Arrays of quantum dots; p-n junction; Depletion layer; Drift current; Photovoltaic effect; Co-doping; Intrinsic silicon; Optical properties; Photodiode; Transition density; Charge transfer exciton; Shallow impurity; TDDFT; Exciton formation energy; Bound exciton; 3D solids ID SILICON QUANTUM DOTS; MULTIPLE EXCITON GENERATION; DENSITY-FUNCTIONAL THEORY; OPTICAL-PROPERTIES; AB-INITIO; PHOTOVOLTAIC APPLICATIONS; SURFACE PHOTOVOLTAGE; ELECTRONIC-STRUCTURE; CARBON NANOTUBES; SIZE DEPENDENCE AB Details of charge density distribution at p-n nano interface are analyzed with density functional theory techniques using model system of dimers of doped silicon quantum dots interacting through bond and through space. Spatial distributions of transition densities between the ground and excited states suggest the character of essential electronic excitations, which have a Forster, bound, unbound, or charge transfer character. A redistribution of electronic density from n-impurities to p-impurities results in a ground state polarization and creates an offset of energies of the bands localized on p-doped quantum dot and the bands localized on n-doped quantum dot. Although impurities contribute very few orbitals to the total density, a ground state charge redistribution and polarization are both responsible for the presence of a large number of charge transfer excitations involving solely silicon orbitals. (C) 2016 Elsevier B.V. All rights reserved. C1 [Tretiak, Sergei] Los Alamos Natl Lab, Ctr Nonlinear Studies CNLS, Div Theoret, Los Alamos, NM 57069 USA. [Tretiak, Sergei] Los Alamos Natl Lab, Ctr Integrated Nanotechnol CINT, Los Alamos, NM 57069 USA. [Dandu, Naveen; Kilina, Svetlana; Kilin, Dmitri] NDSU, Dept Chem & Biochem, Fargo, ND 58108 USA. RP Kilin, D (reprint author), NDSU, Dept Chem & Biochem, Fargo, ND 58108 USA. EM Dmitri.Kilin@ndsu.edu RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU NSF [CHE-1413614]; Center for Integrated Nanotechnology (CINT) at Los Alamos National Laboratory (LANL); Center for Nonlinear Studies (CNLS) at Los Alamos National Laboratory (LANL); U.S. Department of Energy [DE-AC52-06NA25396]; U.S. Department of Energy (DOE) [DE-SC008446]; Alfred P. Sloan Research [BR2014-073] FX This research used resources provided by the LANL Institutional Computing Program. D.K. together with S.K. thank NSF grant CHE-1413614 for financial support of methods development. We acknowledge support of Center for Integrated Nanotechnology (CINT) and Center for Nonlinear Studies (CNLS) at Los Alamos National Laboratory (LANL). LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under contract DE-AC52-06NA25396. S.K. acknowledges financial support of the U.S. Department of Energy (DOE) Early Career Research grant DE-SC008446 for the work on nanostructures and the Alfred P. Sloan Research Award BR2014-073 for the work on method justification. D.S.K. thanks Mariah Hoffman for discussions and editorial suggestions. NR 83 TC 0 Z9 0 U1 8 U2 8 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 144 EP 156 DI 10.1016/j.chemphys.2016.09.003 PG 13 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700019 ER PT J AU Velizhanin, KA AF Velizhanin, Kirill A. TI Renormalization of optical transition strengths in semiconductor nanoparticles due to band mixing SO CHEMICAL PHYSICS LA English DT Article DE Narrow-gap semiconductors; Quantum dots; Optical transitions; Envelope function formalism; Gauge invariance ID QUANTUM DOTS; NANOCRYSTALS; PBSE AB Unique optical properties of semiconductor nanoparticles (SN) make them very promising in the multitude of applications including lasing, light emission and photovoltaics. In many of these applications it is imperative to understand the physics of interaction of electrons in a SN with external electromagnetic fields on the quantitative level. In particular, the strength of electron-photon coupling determines such important SN parameters as the radiative lifetime and absorption cross section. This strength is often assumed to be fully encoded by the so called Kane momentum matrix element. This parameter, however, pertains to a bulk semiconductor material and, as such, is not sensitive to the quantum confinement effects in SNs. In this work we demonstrate that the quantum confinement, via the so called band mixing, can result in a significant suppression of the strength of electron interaction with electromagnetic field. Within the envelope function formalism we show how this suppression can be described by introducing an effective energy-dependent Kane momentum. Then, the effect of band mixing on the efficiencies of various photoinduced processes can be fully captured by the conventional formulae (e.g., spontaneous emission rate), once the conventional Kane momentum is substituted with the renormalized energy-dependent Kane momentum introduced in here. As an example, we evaluate the energy-dependent Kane momentum for spherical PbSe and PbS SNs (i.e., quantum dots) and show that neglecting band mixing in these systems can result in the overestimation of absorption cross sections and emission rates by a factor of similar to 2. (C) 2016 Elsevier B.V. All rights reserved. C1 [Velizhanin, Kirill A.] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Velizhanin, KA (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. EM kirill@lanl.gov RI Velizhanin, Kirill/C-4835-2008 FU Center for Advanced Solar Photophysics (CASP), an Energy Frontier Research Center - Office of Basic Energy Sciences, Office of Science, US Department of Energy (DOE) FX We are grateful to Nikolay Makarov and Oleksandr Isaienko for useful discussion. K.A.V. was supported by the Center for Advanced Solar Photophysics (CASP), an Energy Frontier Research Center funded by the Office of Basic Energy Sciences, Office of Science, US Department of Energy (DOE). NR 40 TC 0 Z9 0 U1 4 U2 4 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 165 EP 176 DI 10.1016/j.chemphys.2016.05.019 PG 12 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700021 ER PT J AU Roslyak, O Piryatinski, A AF Roslyak, Oleksiy Piryatinski, Andrei TI Effect of periodic potential on exciton states in semiconductor carbon nanotubes SO CHEMICAL PHYSICS LA English DT Article DE Semiconductor single-walled carbon; nanotubes; Surface acoustic waves; Optical properties of excitons; Light absorption; Sonoluminescence ID SURFACE ACOUSTIC-WAVES; QUANTUM DOTS; MODULATION; TRANSPORT AB We develop a theoretical background to treat exciton states in semiconductor single-walled carbon nanotubes (SWCNTs) in the presence of a periodic potential induced by a surface acoustic wave (SAW) propagating along SWCNT. The formalism accounts for the electronic band splitting into the Floquet subbands induced by the Bragg scattering on the SAW potential. Optical transitions between the Floquet states and correlated electron-hole pairs (excitons) are numerically examined. Formation of new van Hove singularities within the edges of Floquet sub-bands and associated transfer of the exciton oscillator strengths resulting in the photoluminescence quenching are predicted. The simulations demonstrate the exciton energy red Stark shift and reduction in the exciton binding energy. Comparison of our results with reported theoretical and experimental studies is provided. (C) 2016 Elsevier B.V. All rights reserved. C1 [Roslyak, Oleksiy] Fordham Univ, Dept Phys & Engn Phys, Bronx, NY 10458 USA. [Piryatinski, Andrei] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Roslyak, O (reprint author), Fordham Univ, Dept Phys & Engn Phys, Bronx, NY 10458 USA.; Piryatinski, A (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. EM oroslyak@fordham.edu; apiryat@lanl.gov RI Piryatinski, Andrei/B-5543-2009 FU Fordham University; Los Alamos National Laboratory Directed Research and Development (LDRD) Funds FX O.R. acknowledges the support provided by the Fordham University startup funds. AP acknowledges the support provided by Los Alamos National Laboratory Directed Research and Development (LDRD) Funds. NR 30 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 177 EP 183 DI 10.1016/j.chemphys.2016.05.025 PG 7 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700022 ER PT J AU Huang, SP Balasanthiran, C Tretiak, S Hoefelmeyer, JD Kilina, SV Kilin, DS AF Huang, Shuping Balasanthiran, Choumini Tretiak, Sergei Hoefelmeyer, James D. Kilina, Svetlana V. Kilin, Dmitri S. TI Dynamics of charge at water-to-semiconductor interface: Case study of wet [001] anatase TiO2 nanowire SO CHEMICAL PHYSICS LA English DT Article DE TiO2 nanowire; Water splitting; Absorption spectrum; Photoluminescence; Nonadiabatic excited state dynamics; Multilevel Redfield theory; Energy-gap law ID NONADIABATIC MOLECULAR-DYNAMICS; ULTRAFAST ELECTRON INJECTION; MULTILEVEL REDFIELD THEORY; INITIO TIME-DOMAIN; PBSE QUANTUM-DOT; CARRIER DYNAMICS; LIGHT-ABSORPTION; BUILDING-BLOCKS; SENSITIZED TIO2; SOLAR-CELLS AB The behavior of water molecules on the surfaces of the TiO2 nanowire grown in [001] direction has been investigated by combining theoretical calculations and experiments. Calculated UV-visible absorption spectra reproduce the main features of the experimental spectra. Computations predict that a photoexcitation followed by a sequence of relaxation events results in photoluminescence across the gap. TiO2 nanowires in vacuum and aqueous environment exhibit different dynamics of photo-excited charge carriers. In water, computed relaxation of electrons (holes) is approximately 2 (4) times faster compared with vacuum environment. Faster relaxation of holes vs. electrons and specific spatial localization of holes result to formation of long lived charge transfer excitation with positive charge at the surface of the nanowire. Comparison of relaxation process in TiO2/water interfaces focusing on different surfaces and nanostructures has potential in identifying structural characteristics of TiO2 materials important for efficient photo-electrochemical water splitting. (C) 2016 Elsevier B.V. All rights reserved. C1 [Huang, Shuping; Balasanthiran, Choumini; Hoefelmeyer, James D.; Kilin, Dmitri S.] Univ South Dakota, Dept Chem, Vermillion, SD USA. [Tretiak, Sergei] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. [Kilina, Svetlana V.; Kilin, Dmitri S.] NDSU, Dept Chem & Biochem, Fargo, ND 58108 USA. [Huang, Shuping] Fuzhou Univ, Coll Chem, Fuzhou 350116, Peoples R China. [Huang, Shuping] Univ Minnesota, Dept Chem, Minneapolis, MN 55455 USA. RP Kilin, DS (reprint author), North Dakota State Univ, Dept Chem & Biochem, Fargo, ND 58105 USA. EM Dmitri.Kilin@usd.edu RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU National Science Foundation of the United States [CHE-1413614, ACI-1440681, CHE-0840507, CHE-0722632, EPS-0903804, EPS-0554609]; United States Department of Energy (DOE) BES - Chemical Sciences [DE-FG02-08ER64624, DE-EE0000270]; NERSC [DE-AC02-05CH11231, 86898, 89959]; Center for Integrated Nanotechnology (CINT) at Los Alamos National Laboratory (LANL); Center for Nonlinear Studies (CNLS) at Los Alamos National Laboratory (LANL); National Nuclear Security Administration of the US Department of Energy [DE-AC52-06NA25396]; U.S. Department of Energy (DOE) Early Career Research grant [DE-SC008446] FX This research was supported by National Science Foundation of the United States (CHE-1413614, ACI-1440681, CHE-0840507, CHE-0722632, EPS-0903804, EPS-0554609), and United States Department of Energy (DOE) (DE-FG02-08ER64624 and DE-EE0000270) BES - Chemical Sciences, NERSC Contract No. DE-AC02-05CH11231, allocation Awards 86898, and 89959 "Computational Modeling of Photo-catalysis and Photoinduced Charge Transfer Dynamics on Surfaces", and computational resources of USD High Performance Computing facilities operated by Douglas Jennewein. SPH and DSK thank Peter Deak for discussions on problematic of TiO2 NWs. DK thanks Talgat Inerbaev, Oleg Prezhdo, David Micha, for inspiring discussions on nonadiabatic dynamics. We also acknowledge support of Center for Integrated Nanotechnology (CINT) and Center for Nonlinear Studies (CNLS) at Los Alamos National Laboratory (LANL). LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the US Department of Energy under contract DE-AC52-06NA25396. S.K. acknowledges financial support of the U.S. Department of Energy (DOE) Early Career Research grant DE-SC008446. NR 87 TC 1 Z9 1 U1 19 U2 19 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 184 EP 190 DI 10.1016/j.chemphys.2016.08.002 PG 7 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700023 ER PT J AU Kuo, CY Liu, YH Yarotski, D Li, H Xu, P Yen, HJ Tretiak, S Wang, HL AF Kuo, Cheng-Yu Liu, Yinghao Yarotski, Dmitry Li, Hao Xu, Ping Yen, Hung-Ju Tretiak, Sergei Wang, Hsing-Lin TI Synthesis, electrochemistry, STM investigation of oligothiophene self-assemblies with superior structural order and electronic properties SO CHEMICAL PHYSICS LA English DT Article DE Oligothiophene; Self-assembly; Spectroscopy; Structural order; TDDFT ID SINGLE-MOLECULE SPECTROSCOPY; THIN-FILM TRANSISTORS; POLARIZATION PROPAGATOR; OPTICAL-PROPERTIES; ORGANIC OLIGOMERS; MATERIALS DESIGN; ENERGY-TRANSFER; POLYTHIOPHENES; DEPENDENCE; TRANSPORT AB Three oligothiophene (terthiophene, tetrathiophene and pentathiophene) derivatives are synthesized and their monolayer self-assemblies on gold (Au) are prepared via Au-S covalent bond. Our UV-Vis experimental characterization of solution reveals the dependence of the optical properties on the conjugation length of the oligothiophenes, which compares well with Time-Dependent Density Functional Theory (TDDFT) simulations of spectra of individual chromophores. Photoluminescent spectra of thin films show pronounced red shifts compared to that of solutions, suggesting strong inter-oligomer interactions. The comparative studies of cyclic voltammograms of tetrathiophene from solution, cast film and self-assembled monolayer (SAM) indicate presence of one, two, and three oxidized species in these samples, respectively, suggesting a very strong electronic coupling between tetrathiophene molecules in the SAM. Scanning tunneling microscopy (STM) imaging of SAMs of the tetrathiophene on an atomically flat Au surface exhibits formation of monolayer assemblies with molecular order, and the molecular packing appears to show an overlay of oligothiophene molecules on top of another one. In contrast, the trimer and pentamer images show only aggregated species lacking long-range order on the molecular level. Such trends in going from disordered-ordered-disordered monolayer assemblies are mainly due to a delicate balance between inter-chromophore p-p couplings, hydrophobic interaction and the propensity to form Au-S covalent bond. Such hypothesis has been validated by our computational results suggesting different interaction patterns of oligothiophenes with odd numbered and even numbered thiophene repeat units placed in a dimer configuration. Observed correlations between oligomer geometry and structural order of monolayer assembly elucidate important structure-property relationships and have implications for these molecular structures in organic optoelectronic devices and energy devices. (C) 2016 Published by Elsevier B.V. C1 [Kuo, Cheng-Yu; Xu, Ping; Yen, Hung-Ju; Wang, Hsing-Lin] Los Alamos Natl Lab, Div Chem, C PCS, Los Alamos, NM 87545 USA. [Liu, Yinghao; Yarotski, Dmitry] Los Alamos Natl Lab, Mat Phys & Applicat Div, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. [Li, Hao; Tretiak, Sergei] Los Alamos Natl Lab, Div Theory, Los Alamos, NM 87545 USA. RP Wang, HL (reprint author), Los Alamos Natl Lab, Div Chem, C PCS, Los Alamos, NM 87545 USA.; Tretiak, S (reprint author), Los Alamos Natl Lab, Div Theory, Los Alamos, NM 87545 USA. EM serg@lanl.gov; hwang@lanl.gov RI Tretiak, Sergei/B-5556-2009 OI Tretiak, Sergei/0000-0001-5547-3647 FU Los Alamos National Laboratory (LANL) Directed Research and Development program; National Nuclear Security Administration of the U.S. DOE [DE-AC52-06NA25396] FX This work was performed in part at the Center for Integrated Nanotechnologies, a U.S. Department of Energy, Office of Basic Energy Sciences (DOE BES) user facility, and funded by the Los Alamos National Laboratory (LANL) Directed Research and Development program. The authors also acknowledge the LANL Institutional Computing (IC) Program for providing computational resources. LANL is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. DOE under contract DE-AC52-06NA25396. NR 56 TC 0 Z9 0 U1 14 U2 14 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0301-0104 EI 1873-4421 J9 CHEM PHYS JI Chem. Phys. PD DEC 20 PY 2016 VL 481 BP 191 EP 197 DI 10.1016/j.chemphys.2016.05.015 PG 7 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE4QM UT WOS:000389589700024 ER PT J AU Rameau, JD Freutel, S Kemper, AF Sentef, MA Freericks, JK Avigo, I Ligges, M Rettig, L Yoshida, Y Eisaki, H Schneeloch, J Zhong, RD Xu, ZJ Gu, GD Johnson, PD Bovensiepen, U AF Rameau, J. D. Freutel, S. Kemper, A. F. Sentef, M. A. Freericks, J. K. Avigo, I. Ligges, M. Rettig, L. Yoshida, Y. Eisaki, H. Schneeloch, J. Zhong, R. D. Xu, Z. J. Gu, G. D. Johnson, P. D. Bovensiepen, U. TI Energy dissipation from a correlated system driven out of equilibrium SO NATURE COMMUNICATIONS LA English DT Article ID ANGLE-RESOLVED PHOTOEMISSION; ELECTRONS; DYNAMICS; METALS; SUPERCONDUCTORS; SPECTROSCOPY; RELAXATION; SURFACES AB In complex materials various interactions have important roles in determining electronic properties. Angle-resolved photoelectron spectroscopy (ARPES) is used to study these processes by resolving the complex single-particle self-energy and quantifying how quantum interactions modify bare electronic states. However, ambiguities in the measurement of the real part of the self-energy and an intrinsic inability to disentangle various contributions to the imaginary part of the self-energy can leave the implications of such measurements open to debate. Here we employ a combined theoretical and experimental treatment of femtosecond time-resolved ARPES (tr-ARPES) show how population dynamics measured using tr-ARPES can be used to separate electron-boson interactions from electron-electron interactions. We demonstrate a quantitative analysis of a well-defined electron-boson interaction in the unoccupied spectrum of the cuprate Bi2Sr2CaCu2O8+x characterized by an excited population decay time that maps directly to a discrete component of the equilibrium self-energy not readily isolated by static ARPES experiments. C1 [Rameau, J. D.; Schneeloch, J.; Zhong, R. D.; Xu, Z. J.; Gu, G. D.; Johnson, P. D.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, 734 Brookhaven Ave, Upton, NY 11973 USA. [Freutel, S.; Avigo, I.; Ligges, M.; Rettig, L.; Bovensiepen, U.] Univ Duisburg Essen, Fac Phys, Lotharstr 1, D-47057 Duisburg, Germany. [Freutel, S.; Avigo, I.; Ligges, M.; Rettig, L.; Bovensiepen, U.] Univ Duisburg Essen, Ctr Nanointegrat Duisburg Essen Cenide, Lotharstr 1, D-47057 Duisburg, Germany. [Kemper, A. F.] North Carolina State Univ, Dept Phys, Raleigh, NC 27695 USA. [Kemper, A. F.] Lawrence Berkeley Natl Lab, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Sentef, M. A.] Univ Bonn, HISKP, D-53115 Bonn, Germany. [Sentef, M. A.] Max Planck Inst Struct & Dynam Matter, Ctr Free Electron Laser Sci, D-22761 Hamburg, Germany. [Freericks, J. K.] Georgetown Univ, Dept Phys, Washington, DC 20057 USA. [Yoshida, Y.; Eisaki, H.] Natl Inst Adv Ind Sci & Technol, Tsukuba, Ibaraki 3058568, Japan. [Rettig, L.] Max Planck Gesell, Fritz Haber Inst, Faradayweg 4-6, D-14195 Berlin, Germany. RP Rameau, JD (reprint author), Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, 734 Brookhaven Ave, Upton, NY 11973 USA.; Kemper, AF (reprint author), North Carolina State Univ, Dept Phys, Raleigh, NC 27695 USA.; Kemper, AF (reprint author), Lawrence Berkeley Natl Lab, 1 Cyclotron Rd, Berkeley, CA 94720 USA. EM jrameau@bnl.gov; akemper@ncsu.edu RI Zhong, Ruidan/D-5296-2013; Bovensiepen, Uwe/E-7435-2017; xu, zhijun/A-3264-2013 OI Zhong, Ruidan/0000-0003-1652-9454; Bovensiepen, Uwe/0000-0002-1506-4491; xu, zhijun/0000-0001-7486-2015 FU Center for Emergent Superconductivity; Energy Frontier Research Center; US Department of Energy [DE-2009-BNL-PM015]; National Science Foundation [PHYS-1066293]; Laboratory Directed Research and Development Program of Lawrence Berkeley National Laboratory under US Department of Energy [DE-AC02-05CH11231]; Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering (DMSE) [DE-FG02-08ER46542]; McDevitt bequest at Georgetown; Deutsche Forschungsgemeinschaft (DFG) through the Emmy Noether program; Department of Energy, Office of Science [DE-AC02-05CH11231]; Deutsche Forschungsgemeinschaft [SFB 616, SPP 1458]; Mercator Research Center Ruhr [PR-2011-0003]; European Union [280555] FX Work at Brookhaven National Laboratory was supported by the Center for Emergent Superconductivity, an Energy Frontier Research Center, headquartered at Brookhaven National Laboratory and funded by the US Department of Energy, under Contract No. DE-2009-BNL-PM015. This work was supported, in part by National Science Foundation Grant No. PHYS-1066293 and the hospitality of the Aspen Center for Physics. A.F.K. was supported by the Laboratory Directed Research and Development Program of Lawrence Berkeley National Laboratory under US Department of Energy Contract No. DE-AC02-05CH11231. J.K.F. was supported by the Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering (DMSE) under Contract No. DE-FG02-08ER46542, and by the McDevitt bequest at Georgetown. M.A.S. received further support from the Deutsche Forschungsgemeinschaft (DFG) through the Emmy Noether program. Computational resources were provided by the National Energy Research Scientific Computing Center supported by the Department of Energy, Office of Science, under Contract No. DE-AC02-05CH11231. We acknowledge further funding from the Deutsche Forschungsgemeinschaft through SFB 616 and SPP 1458, from the Mercator Research Center Ruhr through Grant No. PR-2011-0003 and from the European Union within the seventh Framework Program under Grant No. 280555 (GO FAST). NR 41 TC 0 Z9 0 U1 28 U2 28 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 20 PY 2016 VL 7 AR 13761 DI 10.1038/ncomms13761 PG 9 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF0YQ UT WOS:000390052600001 PM 27996009 ER PT J AU Loftis, JD Abdel-Fattah, TM AF Loftis, Jon Derek Abdel-Fattah, Tarek M. TI Nanoscale electropolishing of high-purity silver with a deep eutectic solvent SO COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS LA English DT Article DE Electrochemical polishing; Ionic liquid; Ag AB Samples of high-purity (>99.9% composition) silver metal were used in electropolishing treatments with an acid-free ionic liquid deep eutectic solvent prepared from quaternary ammonium salts as an eco-friendly electrochemical polishing solution. Linear sweep voltammetry tests were utilized to determine the optimum conditions for electrochemical polishing, which exposed that relatively stable electropolishing for pure silver metals can achieved at 3.75 V with a current density of 0.064 A/cm(2). Atomic force microscopy was used for surface morphology comparisons while summarizing electrochemical polishing efficiency by providing root mean square roughness averages before and after electrochemical polishing to reveal an average decrease of 150.433 nm in RMS surface roughness, resulting in a surface eight times smoother than the original unpolished silver specimens. Digital microscopy provided an overall observation of the material interface between the treated and unpolished regions, and indicated that the high and electrical conductivity in silver specimens at conditions above steady state current densities could result in vigorous pitting on the silver anode surface, and result in a less smooth surface. (C) 2016 Elsevier B.V. All rights reserved. C1 [Abdel-Fattah, Tarek M.] Christopher Newport Univ, Appl Res Ctr, Thomas Jefferson Natl Accelerator Facil, Newport News, VA 23606 USA. Christopher Newport Univ, Dept Mol Biol & Chem, Newport News, VA 23606 USA. RP Abdel-Fattah, TM (reprint author), Christopher Newport Univ, Appl Res Ctr, Thomas Jefferson Natl Accelerator Facil, Newport News, VA 23606 USA. EM fattah@cnu.edu NR 25 TC 0 Z9 0 U1 10 U2 10 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0927-7757 EI 1873-4359 J9 COLLOID SURFACE A JI Colloid Surf. A-Physicochem. Eng. Asp. PD DEC 20 PY 2016 VL 511 BP 113 EP 119 DI 10.1016/j.colsurfa.2016.09.013 PG 7 WC Chemistry, Physical SC Chemistry GA ED0QM UT WOS:000388547000013 ER PT J AU Khachatryan, V Sirunyan, AM Tumasyan, A Adam, W Asilar, E Bergauer, T Brandstetter, J Brondolin, E Dragicevic, M Ero, J Flechl, M Friedl, M Fruhwirth, R Ghete, VM Hartl, C Hormann, N Hrubec, J Jeitler, M Konig, A Krammer, M Kratschmer, I Liko, D Matsushita, T Mikulec, I Rabady, D Rad, N Rahbaran, B Rohringer, H Schieck, J Schofbeck, R Strauss, J Treberer-Treberspurg, W Waltenberger, W Wulz, CE Mossolov, V Shumeiko, N Gonzalez, JS Alderweireldt, S Cornelis, T De Wolf, EA Janssen, X Knutsson, A Lauwers, J Luyckx, S De Klundert, MV Van Haevermaet, H Van Mechelen, P Van Remortel, N Van Spilbeeck, A Abu Zeid, S Blekman, F D'Hondt, J Daci, N De Bruyn, I Deroover, K Heracleous, N Keaveney, J Lowette, S Moortgat, S Moreels, L Olbrechts, A Python, Q Strom, D Tavernier, S Van Doninck, W Van Mulders, P Van Onsem, GP Van Parijs, I Barria, P Brun, H Caillol, C Clerbaux, B De Lentdecker, G Fasanella, G Favart, L Goldouzian, R Grebenyuk, A Karapostoli, G Lenzi, T Leonard, A Maerschalk, T Marinov, A Pernie, L Randle-Conde, A Seva, T Vander Velde, C Vanlaer, P Yonamine, R Zenoni, F Zhang, F Beernaert, K Benucci, L Cimmino, A Crucy, S Dobur, D Fagot, A Garcia, G Gul, M Mccartin, J Rios, AAO Poyraz, D Ryckbosch, D Salva, S Sigamani, M Tytgat, M Van Driessche, W Yazgan, E Zaganidis, N Basegmez, S Beluffi, C Bondu, O Brochet, S Bruno, G Caudron, A Ceard, L De Visscher, S Delaere, C Delcourt, M Favart, D Forthomme, L Giammanco, A Jafari, A Jez, P Komm, M Lemaitre, V Mertens, A Musich, M Nuttens, C Perrini, L Piotrzkowski, K Popov, A Quertenmont, L Selvaggi, M Marono, MV Beliy, N Hammad, GH Alda, WL Alves, FL Alves, GA Brito, L Martins, MC Hamer, M Hensel, C Moraes, A Pol, ME Teles, PR Das Chagas, EBB Carvalho, W Chinellato, J Custodio, A Da Costa, EM Damiao, DD Martins, CD De Souza, SF Guativa, LMH Malbouisson, H Figueiredo, DM Herrera, CM Mundim, L Nogima, H Da Silva, WLP Santoro, A Sznajder, A Manganote, EJT Pereira, AV Ahuja, S Bernardes, CA Santos, AD Dogra, S Tomei, TRFP Gregores, EM Mercadante, PG Moon, CS Novaes, SF Padula, SS Abad, DR Vargas, JCR Aleksandrov, A Hadjiiska, R Iaydjiev, P Rodozov, M Stoykova, S Sultanov, G Vutova, M Dimitrov, A Glushkov, I Litov, L Pavlov, B Petkov, P Fang, W Ahmad, M Bian, JG Chen, GM Chen, HS Chen, M Cheng, T Du, R Jiang, CH Leggat, D Plestina, R Romeo, F Shaheen, SM Spiezia, A Tao, J Wang, C Wang, Z Zhang, H Asawatangtrakuldee, C Ban, Y Li, Q Liu, S Mao, Y Qian, SJ Wang, D Xu, Z Avila, C Cabrera, A Sierra, LFC Florez, C Gomez, JP Moreno, BG Sanabria, JC Godinovic, N Lelas, D Puljak, I Cipriano, PMR Antunovic, Z Kovac, M Brigljevic, V Kadija, K Luetic, J Micanovic, S Sudic, L Attikis, A Mavromanolakis, G Mousa, J Nicolaou, C Ptochos, F Razis, PA Rykaczewski, H Finger, M Finger, M Awad, A El-Khateeb, E Elgammal, S Mohamed, A Calpas, B Kadastik, M Murumaa, M Raidal, M 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CA CMS Collaboration TI Search for dark matter particles in proton-proton collisions at root 8 = TeV using the razor variables SO JOURNAL OF HIGH ENERGY PHYSICS LA English DT Article DE Hadron-Hadron scattering (experiments); Supersymmetry ID CRESST-II DETECTOR; MODEL; EXTENSION; NEUTRINO; GALAXIES; CLUSTERS; LHC AB A search for dark matter particles directly produced in proton-proton collisions recorded by the CMS experiment at the LHC is presented. The data correspond to an integrated luminosity of 18.8 fb(-1), at a center-of-mass energy of 8 TeV. The event selection requires at least two jets and no isolated leptons. The razor variables are used to quantify the transverse momentum balance in the jet momenta. The study is performed separately for events with and without jets originating from b quarks. The observed yields are consistent with the expected backgrounds and, depending on the nature of the production mechanism, dark matter production at the LHC is excluded at 90% confidence level for a mediator mass scale I > below 1 TeV. The use of razor variables yields results that complement those previously published. C1 [Khachatryan, V.; Sirunyan, A. M.; Tumasyan, A.] Yerevan Phys Inst, Yerevan, Armenia. [Adam, W.; Asilar, E.; Bergauer, T.; Brandstetter, J.; Brondolin, E.; Dragicevic, M.; Eroe, J.; Flechl, M.; Friedl, M.; Fruehwirth, R.; Ghete, V. M.; Hartl, C.; Hoermann, N.; Hrubec, J.; Jeitler, M.; Koenig, A.; Krammer, M.; Kraetschmer, I.; Liko, D.; Matsushita, T.; Mikulec, I.; Rabady, D.; Rad, N.; Rahbaran, B.; Rohringer, H.; Schieck, J.; Schoefbeck, R.; Strauss, J.; Treberer-Treberspurg, W.; Waltenberger, W.; Wulz, C. -E.; Blobel, V.; Bhatnagar, V.] OeAW, Inst Hochenergiephys, Vienna, Austria. [Mossolov, V.; Shumeiko, N.; Gonzalez, J. 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[Aziz, T.; Banerjee, S.; Bhowmik, S.; Chatterjee, R. M.; Dewanjee, R. K.; Dugad, S.; Ganguly, S.; Ghosh, S.; Guchait, M.; Gurtu, A.; Jain, Sa; Kole, G.; Kumar, S.; Mahakud, B.; Maity, M.; Majumder, G.; Mazumdar, K.; Mitra, S.; Mohanty, G. B.; Parida, B.; Sarkar, T.; Sur, N.; Sutar, B.; Wickramage, N.] Tata Inst Fundamental Res, Bombay, Maharashtra, India. [Chauhan, S.; Dube, S.; Kapoor, A.; Kothekar, K.; Rane, A.; Sharma, S.] Indian Inst Sci Educ & Res, Pune, Maharashtra, India. [Bakhshiansohi, H.; Behnamian, H.; Etesami, S. M.; Fahim, A.; Khakzad, M.; Najafabadi, M. Mohammadi; Naseri, M.; Mehdiabadi, S. Paktinat; Hosseinabadi, F. Rezaei; Safarzadeh, B.; Zeinali, M.] Inst Res Fundamental Sci IPM, Tehran, Iran. [Felcini, M.; Grunewald, M.] Univ Coll Dublin, Dublin, Ireland. [Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iaselli, G.; Maggi, G.; Maggi, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Silvestris, L.; Venditti, R.] Ist Nazl Fis Nucl, Sez Bari, Bari, Italy. [Abbrescia, M.; Calabria, C.; Caputo, C.; Cristella, L.; De Palma, M.; Miniello, G.; Nuzzo, S.; Pompili, A.; Radogna, R.; Selvaggi, G.; Venditti, R.] Univ Bari, Bari, Italy. [Creanza, D.; De Filippis, N.; Iaselli, G.; Maggi, G.; My, S.; Pugliese, G.] Politecn Bari, Bari, Italy. [Abbiendi, G.; Battilana, C.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Ist Nazl Fis Nucl, Sez Bologna, Bologna, Italy. [Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Fanfani, A.; Fasanella, D.; Guiducci, L.; Navarria, F. L.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Univ Bologna, Bologna, Italy. [Chiorboli, M.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Ist Nazl Fis Nucl, Sez Catania, Catania, Italy. [Cappello, G.; Chiorboli, M.; Costa, S.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Univ Catania, Catania, Italy. [Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Meschini, M.; Paoletti, S.; Sguazzoni, G.; Viliani, L.] Ist Nazl Fis Nucl, Sez Firenze, Florence, Italy. [Ciulli, V.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Viliani, L.] Univ Florence, Florence, Italy. [Fabbri, F.; Benussi, L.; Bianco, S.; Piccolo, D.; Primavera, F.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Calvelli, V.; Ferro, F.; Lo Vetere, M.; Monge, M. R.; Robutti, E.; Tosi, S.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Calvelli, V.; Lo Vetere, M.; Monge, M. R.; Tosi, S.] Univ Genoa, Genoa, Italy. [Brianza, L.; Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Gerosa, R.; Ghezzi, A.; Govoni, P.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Ragazzi, S.; Redaelli, N.; de Fatis, T. Tabarelli] Ist Nazl Fis Nucl, Sez Milano Bicocca, Milan, Italy. [Dinardo, M. E.; Fiorendi, S.; Gerosa, R.; Ghezzi, A.; Govoni, P.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Paganoni, M.; Ragazzi, S.; de Fatis, T. Tabarelli] Univ Milano Bicocca, Milan, Italy. [Buontempo, S.; Cavallo, N.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Merola, M.; Paolucci, P.; Sciacca, C.; Thyssen, F.] Ist Nazl Fis Nucl, Sez Napoli, Naples, Italy. [Esposito, M.; Iorio, A. O. M.; Sciacca, C.] Univ Naples Federico II, Naples, Italy. [Cavallo, N.; Fabozzi, F.] Univ Basilicata, Potenza, Italy. [Di Guida, S.; Meola, S.] Univ G Marconi, Rome, Italy. [Azzi, P.; Bacchetta, N.; Benato, L.; Bisello, D.; Boletti, A.; Checchia, P.; Dall'Osso, M.; Gasparini, F.; Gozzelino, A.; Margoni, M.; Meneguzzo, A. T.; Montecassiano, F.; Passaseo, M.; Pazzini, J.; Pegoraro, M.; Pozzobon, N.; Simonetto, F.; Torassa, E.; Tosi, M.; Zanetti, M.; Zucchetta, A.; Zumerle, G.] Ist Nazl Fis Nucl, Sez Padova, Padua, Italy. [Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; Dall'Osso, M.; Gasparini, F.; Gasparini, U.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Tosi, M.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Univ Padua, Padua, Italy. Univ Trento, Trento, Italy. [Braghieri, A.; Magnani, A.; Montagna, P.; Ratti, S. P.; Re, V.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Univ Pavia, Pavia, Italy. [Solestizi, L. Alunni; Bilei, G. M.; Ciangottini, D.; Fano, L.; Lariccia, P.; Mantovani, G.; Menichelli, M.; Saha, A.; Santocchia, A.] Ist Nazl Fis Nucl, Sez Perugia, Perugia, Italy. [Solestizi, L. Alunni; Ciangottini, D.; Fano, L.; Lariccia, P.; Mantovani, G.; Santocchia, A.] Univ Perugia, Perugia, Italy. [Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Donato, S.; Fedi, G.; Foa, L.; Giassi, A.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Tonelli, G.] Univ Pisa, Pisa, Italy. [Donato, S.; Foa, L.; Ligabue, F.] Scuola Normale Super Pisa, Pisa, Italy. [Barone, L.; Cavallari, F.; D'imperio, G.; Del Re, D.; Diemoz, M.; Gelli, S.; Jorda, C.; Longo, E.; Margaroli, F.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Tonelli, G.] Univ Roma, Rome, Italy. [Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bellan, R.; Biino, C.; Cartiglia, N.; Costa, M.; Covarelli, R.; Degano, A.; Demaria, N.; Finco, L.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Solano, A.; Staiano, A.] Ist Nazl Fis Nucl, Sez Torino, Turin, Italy. [Amapane, N.; Argiro, S.; Bellan, R.; Costa, M.; Covarelli, R.; Degano, A.; Finco, L.; Kiani, B.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Solano, A.; Staiano, A.] Univ Turin, Turin, Italy. [Arcidiacono, R.; Arneodo, M.; Sacchi, R.] Univ Piemonte Orientale, Novara, Italy. [Belforte, S.; Candelise, V.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; Gobbo, B.; La Licata, C.; Schizzi, A.; Zanetti, A.] Ist Nazl Fis Nucl, Sez Trieste, Trieste, Italy. [Riccardi, C.; Candelise, V.; La Licata, C.; Schizzi, A.] Univ Trieste, Trieste, Italy. [Kropivnitskaya, A.; Nam, S. K.] Kangwon Natl Univ, Chunchon, South Korea. [Kim, D. H.; Kim, G. N.; Kim, M. S.; Kong, D. J.; Lee, S.; Lee, S. W.; Oh, Y. D.; Sakharov, A.; Son, D. C.; Kamon, T.] Kyungpook Natl Univ, Daegu, South Korea. [Cifuentes, J. A. Brochero; Kim, H.; Kim, T. J.] Chonbuk Natl Univ, Jeonju, South Korea. [Song, S.] Chonnam Natl Univ, Inst Universe & Elementary Particles, Kwangju, South Korea. [Cho, S.; Choi, S.; Go, Y.; Gyun, D.; Hong, B.; Kim, H.; Kim, Y.; Lee, B.; Lee, K.; Lee, K. S.; Lee, S.; Lim, J.; Park, S. K.; Roh, Y.] Korea Univ, Seoul, South Korea. [Yoo, H. D.] Seoul Natl Univ, Seoul, South Korea. [Choi, M.; Kim, H.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.] Univ Seoul, Seoul, South Korea. [Choi, Y.; Goh, J.; Kim, D.; Kwon, E.; Lee, J.; Yu, I.] Sungkyunkwan Univ, Suwon, South Korea. [Dudenas, V.; Juodagalvis, A.; Vaitkus, J.] Vilnius Univ, Vilnius, Lithuania. [Ahmed, I.; Ibrahim, Z. A.; Komaragiri, J. R.; Ali, M. A. B. Md; Idris, F. Mohamad; Abdullah, W. A. T. Wan; Yusli, M. N.; Zolkapli, Z.] Univ Malaya, Natl Ctr Particle Phys, Kuala Lumpur, Malaysia. [Casimiro Linares, E.; Castilla-Valdez, H.; De La Cruz-Burelo, E.; Heredia-De La Cruz, I.; Hernandez-Almada, A.; Lopez-Fernandez, R.; Mejia Guisao, J.; Sanchez-Hernandez, A.] IPN, Ctr Invest Estudios & Avanzados, Mexico City, DF, Mexico. [Carrillo Moreno, S.; Vazquez Valencia, F.] Univ Iberoamer, Mexico City, DF, Mexico. [Pedraza, I.; Ibarguen, H. A. Salazar] Benemerita Univ Autonoma Puebla, Puebla, Mexico. [Pineda, A. Morelos] Univ Autonoma San Luis Potosi, San Luis Potosi, Mexico. [Krofcheck, D.] Univ Auckland, Auckland, New Zealand. [Butler, P. H.] Univ Canterbury, Christchurch, New Zealand. [Ahmad, A.; Ahmad, M.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Khurshid, T.; Shoaib, M.; Waqas, M.] Quaid I Azam Univ, Natl Ctr Phys, Islamabad, Pakistan. [Bialkowska, H.; Bluj, M.; Boimska, B.; Frueboes, T.; Gorski, M.; Kazana, M.; Nawrocki, K.; Romanowska-Rybinska, K.; Szleper, M.; Traczyk, P.; Zalewski, P.] Natl Ctr Nucl Res, Otwock, Poland. [Brona, G.; Bunkowski, K.; Byszuk, A.; Doroba, K.; Kalinowski, A.; Konecki, M.; Krolikowski, J.; Misiura, M.; Olszewski, M.; Walczak, M.] Univ Warsaw, Inst Expt Phys, Fac Phys, Warsaw, Poland. [Bargassa, P.; Da Cruz E Silva, C. Beirao; Di Francesco, A.; Faccioli, P.; Ferreira Parracho, P. G.; Gallinaro, M.; Hollar, J.; Leonardo, N.; Lloret Iglesias, L.; Nemallapudi, M. V.; Nguyen, F.; Rodrigues Antunes, J.; Seixas, J.; Toldaiev, O.; Vadruccio, D.; Varela, J.; Vischia, P.] Lab Instrumentacao Fis & Expt Particulas, Lisbon, Portugal. [Finger, M.; Finger, M., Jr.; Tsamalaidze, Z.; Golutvin, I.; Gorbounov, N.; Gorbunov, I.; Karjavin, V.; Kozlov, G.; Lanev, A.; Malakhov, A.; Matveev, V.; Moisenz, P.; Savina, M.; Shmatov, S.; Shulha, S.; Skatchkov, N.; Tikhonenko, E.; Zarubin, A.] Joint Inst Nucl Res, Dubna, Russia. [Golovtsov, V.; Ivanov, Y.; Kim, V.; Kuznetsova, E.; Levchenko, P.; Murzin, V.; Oreshkin, V.; Smirnov, I.; Sulimov, V.; Uvarov, L.; Vavilov, S.; Vorobyev, A.] Petersburg Nucl Phys Inst, St Petersburg, Russia. [Matveev, V.; Andreev, Yu.; Dermenev, A.; Gninenko, S.; Golubev, N.; Karneyeu, A.; Kirsanov, M.; Krasnikov, N.; Pashenkov, A.; Tlisov, D.; Toropin, A.; Musienko, Y.] Inst Nucl Res, Moscow, Russia. [Epshteyn, V.; Gavrilov, V.; Lychkovskaya, N.; Popov, V.; Pozdnyakov, I.; Safronov, G.; Spiridonov, A.; Vlasov, E.; Zhokin, A.; Starodumov, A.; Nikitenko, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Matveev, V.; Chistov, R.; Danilov, M.; Markin, O.; Rusinov, V.; Tarkovskii, E.; Azarkin, M.; Dremin, I.; Leonidov, A.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Andreev, V.; Azarkin, M.; Dremin, I.; Kirakosyan, M.; Leonidov, A.; Mesyats, G.; Rusakov, S. V.] PN Lebedev Phys Inst, Moscow, Russia. [Popov, A.; Zhukov, V.; Katkov, I.; Baskakov, A.; Belyaev, A.; Boos, E.; Dubinin, M.; Dudko, L.; Ershov, A.; Gribushin, A.; Klyukhin, V.; Kodolova, O.; Lokhtin, I.; Miagkov, I.; Obraztsov, S.; Petrushanko, S.; Savrin, V.; Snigirev, A.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Azhgirey, I.; Bayshev, I.; Bitioukov, S.; Kachanov, V.; Kalinin, A.; Konstantinov, D.; Krychkine, V.; Petrov, V.; Ryutin, R.; Sobol, A.; Tourtchanovitch, L.; Troshin, S.; Tyurin, N.; Uzunian, A.; Volkov, A.] State Res Ctr Russian Federat, Inst High Energy Phys, Protvino, Russia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Milosevic, J.; Rekovic, V.; Milenovic, P.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Milosevic, J.; Rekovic, V.; Milenovic, P.] Vinca Inst Nucl Sci, Belgrade, Serbia. [Alcaraz Maestre, J.; Del Valle, A. Escalante; Fernandez Bedoya, C.; Fernandez Ramos, J. P.; Flix, J.; Fouz, M. C.; Garcia-Abia, P.; Gonzalez Lopez, O.; Goy Lopez, S.; Hernandez, J. M.; Josa, M. I.; Navarro De Martino, E.; Perez-Calero Yzquierdo, A.; Puerta Pelayo, J.; Quintario Olmeda, A.; Redondo, I.; Romero, L.; Soares, M. S.] CIEMAT, Madrid, Spain. [de Troconiz, J. F.; Missiroli, M.; Moran, D.] Univ Autonoma Madrid, Madrid, Spain. [Cuevas, J.; Fernandez Menendez, J.; Folgueras, S.; Gonzalez Caballero, I.; Palencia Cortezon, E.; Vizan Garcia, J. M.] Univ Oviedo, Oviedo, Spain. [Cabrillo, I. J.; Calderon, A.; de Saa, J. R. Castineiras; Curras, E.; De Castro Manzano, P.; Fernandez, M.; Garcia-Ferrero, J.; Gomez, G.; Lopez Virto, A.; Marco, J.; Marco, R.; Martinez Rivero, C.; Matorras, F.; Piedra Gomez, J.; Rodrigo, T.; Rodriguez-Marrero, A. Y.; Ruiz-Jimeno, A.; Scodellaro, L.; Trevisani, N.; Vila, I.; Vilar Cortabitarte, R.] Univ Cantabria, CSIC, Inst Fis Cantabria IFCA, Santander, Spain. [Merlin, J. A.; Pantaleo, F.; Hartmann, F.; Kornmayer, A.; Szillasi, Z.; Mohanty, A. K.; Silvestris, L.; Battilana, C.; Tosi, N.; Viliani, L.; Primavera, F.; Manzoni, R. A.; Azzi, P.; Dall'Osso, M.; Pazzini, J.; Zucchetta, A.; Azzurri, P.; D'imperio, G.; Del Re, D.; Arcidiacono, R.; Palencia Cortezon, E.; Abbaneo, D.; Auffray, E.; Auzinger, G.; Bachtis, M.; Baillon, P.; Ball, A. H.; Barney, D.; Benaglia, A.; Benhabib, L.; Berruti, G. M.; Bloch, P.; Bocci, A.; Bonato, A.; Botta, C.; Breuker, H.; Camporesi, T.; Castello, R.; Cepeda, M.; Cerminara, G.; D'Alfonso, M.; d'Enterria, D.; Dabrowski, A.; Daponte, V.; David, A.; De Gruttola, M.; De Guio, F.; De Roeck, A.; Di Marco, E.; Dobson, M.; Dordevic, M.; Dorney, B.; du Pree, T.; Duggan, D.; Duenser, M.; Dupont, N.; Elliott-Peisert, A.; Franzoni, G.; Fulcher, J.; Funk, W.; Gigi, D.; Gill, K.; Giordano, D.; Girone, M.; Glege, F.; Guida, R.; Gundacker, S.; Guthoff, M.; Hammer, J.; Harris, P.; Hegeman, J.; Innocente, V.; Janot, P.; Kirschenmann, H.; Knuenz, V.; Kortelainen, M. J.; Kousouris, K.; Lecoq, P.; Lourenco, C.; Lucchini, M. T.; Magini, N.; Malgeri, L.; Mannelli, M.; Martelli, A.; Masetti, L.; Meijers, F.; Mersi, S.; Meschi, E.; Moortgat, F.; Morovic, S.; Mulders, M.; Neugebauer, H.; Orfanelli, S.; Orsini, L.; Pape, L.; Perez, E.; Peruzzi, M.; Petrilli, A.; Petrucciani, G.; Pfeiffer, A.; Pierini, M.; Piparo, D.; Racz, A.; Reis, T.; Rolandi, G.; Rovere, M.; Ruan, M.; Sakulin, H.; Schaefer, C.; Schwick, C.; Seidel, M.; Sharma, A.; Silva, P.; Simon, M.; Sphicas, P.; Steggemann, J.; Stoye, M.; Takahashi, Y.; Treille, D.; Triossi, A.; Tsirou, A.; Veres, G. I.; Wardle, N.; Woehri, H. K.; Zagozdzinska, A.; Zeuner, W. D.] CERN, European Org Nucl Res, Geneva, Switzerland. [Bertl, W.; Deiters, K.; Erdmann, W.; Horisberger, R.; Ingram, Q.; Kaestli, H. C.; Kotlinski, D.; Langenegger, U.; Rohe, T.] Paul Scherrer Inst, Villigen, Switzerland. [Bachmair, F.; Bani, L.; Bianchini, L.; Casal, B.; Dissertori, G.; Dittmar, M.; Donega, M.; Eller, P.; Grab, C.; Heidegger, C.; Hits, D.; Hoss, J.; Kasieczka, G.; Lecomte, P.; Lustermann, W.; Mangano, B.; Marionneau, M.; del Arbol, P. Martinez Ruiz; Masciovecchio, M.; Meinhard, M. T.; Meister, D.; Micheli, F.; Musella, P.; Nessi-Tedaldi, F.; Pandolfi, F.; Pata, J.; Pauss, F.; Perrin, G.; Perrozzi, L.; Quittnat, M.; Rossini, M.; Schonenberger, M.; Starodumov, A.; Takahashi, M.; Tavolaro, V. R.; Theofilatos, K.; Wallny, R.] Swiss Fed Inst Technol, Inst Particle Phys, Zurich, Switzerland. [Aarrestad, T. K.; Amsler, C.; Caminada, L.; Canelli, M. F.; Chiochia, V.; De Cosa, A.; Galloni, C.; Hinzmann, A.; Hreus, T.; Kilminster, B.; Lange, C.; Ngadiuba, J.; Pinna, D.; Rauco, G.; Robmann, P.; Salerno, D.; Yang, Y.] Univ Zurich, Zurich, Switzerland. [Chen, K. H.; Doan, T. H.; Jain, Sh.; Khurana, R.; Konyushikhin, M.; Kuo, C. M.; Lin, W.; Lu, Y. J.; Pozdnyakov, A.; Yu, S. S.] Natl Cent Univ, Chungli, Taiwan. [Kumar, Arun; Chang, P.; Chang, Y. H.; Chang, Y. W.; Chao, Y.; Chen, K. F.; Chen, P. H.; Dietz, C.; Fiori, F.; Grundler, U.; Hou, W. -S.; Hsiung, Y.; Liu, Y. F.; Lu, R. -S.; Moya, M. Minano; Petrakou, E.; Tsai, J. F.; Tzeng, Y. M.] Natl Taiwan Univ, Taipei, Taiwan. [Asavapibhop, B.; Kovitanggoon, K.; Singh, G.; Srimanobhas, N.; Suwonjandee, N.] Chulalongkorn Univ, Dept Phys, Fac Sci, Bangkok, Thailand. [Adiguzel, A.; Bakirci, M. N.; Cerci, S.; Damarseckin, S.; Demiroglu, Z. S.; Dozen, C.; Dumanoglu, I.; Eskut, E.; Girgis, S.; Gokbulut, G.; Guler, Y.; Gurpinar, E.; Hos, I.; Kangal, E. E.; Onengut, G.; Ozdemir, K.; Polatoz, A.; Cerci, D. Sunar; Zorbilmez, C.] Cukurova Univ, Adana, Turkey. [Bilin, B.; Bilmis, S.; Isildak, B.; Karapinar, G.; Yalvac, M.; Zeyrek, M.] Middle East Tech Univ, Dept Phys, Ankara, Turkey. [Gulmez, E.; Kaya, M.; Kaya, O.; Yetkin, E. A.; Yetkin, T.] Bogazici Univ, Istanbul, Turkey. [Cakir, A.; Cankocak, K.; Sen, S.; Vardarli, F. I.] Istanbul Tech Univ, Istanbul, Turkey. [Grynyov, B.] Natl Acad Sci Ukraine, Inst Scintillat Mat, Kharkov, Ukraine. [Levchuk, L.; Sorokin, P.] Kharkov Inst Phys & Technol, Natl Sci Ctr, Kharkov, Ukraine. [Aggleton, R.; Ball, F.; Beck, L.; Brooke, J. J.; Burns, D.; Clement, E.; Cussans, D.; Flacher, H.; Goldstein, J.; Grimes, M.; Heath, G. P.; Heath, H. F.; Jacob, J.; Kreczko, L.; Lucas, C.; Meng, Z.; Newbold, D. M.; Paramesvaran, S.; Poll, A.; Sakuma, T.; El Nasr-Storey, S. Seif; Senkin, S.; Smith, D.; Smith, V. J.] Univ Bristol, Bristol, Avon, England. [Newbold, D. M.; Bell, K. W.; Belyaev, A.; Brew, C.; Brown, R. M.; Calligaris, L.; Cieri, D.; Cockerill, D. J. A.; Coughlan, J. A.; Harder, K.; Harper, S.; Olaiya, E.; Petyt, D.; Shepherd-Themistocleous, C. H.; Thea, A.; Tomalin, I. R.; Williams, T.; Worm, S. D.; Lucas, R.] Rutherford Appleton Lab, Didcot, Oxon, England. [Baber, M.; Bainbridge, R.; Buchmuller, O.; Bundock, A.; Burton, D.; Casasso, S.; Citron, M.; Colling, D.; Corpe, L.; Dauncey, P.; Davies, G.; De Wit, A.; Della Negra, M.; Elwood, A.; Futyan, D.; Hall, G.; Iles, G.; Lane, R.; Lucas, R.; Lyons, L.; Magnan, A. -M.; Malik, S.; Nash, J.; Nikitenko, A.; Pela, J.; Penning, B.; Pesaresi, M.; Raymond, D. M.; Richards, A.; Rose, A.; Seez, C.; Tapper, A.; Uchida, K.; Acosta, M. Vazquez; Virdee, T.; Zenz, S. C.] Imperial Coll, London, England. [Cole, J. E.; Hobson, P. R.; Khan, A.; Kyberd, P.; Leslie, D.; Reid, I. D.; Symonds, P.; Teodorescu, L.; Turner, M.] Brunel Univ, Uxbridge, Middx, England. [Borzou, A.; Call, K.; Dittmann, J.; Hatakeyama, K.; Liu, H.; Pastika, N.] Baylor Univ, Waco, TX 76798 USA. [Charaf, O.; Cooper, S. I.; Henderson, C.; Rumerio, P.] Univ Alabama, Tuscaloosa, AL USA. [Arcaro, D.; Avetisyan, A.; Bose, T.; Gastler, D.; Rankin, D.; Richardson, C.; Rohlf, J.; Sulak, L.; Zou, D.] Boston Univ, Boston, MA 02215 USA. [Alimena, J.; Benelli, G.; Berry, E.; Cutts, D.; Ferapontov, A.; Garabedian, A.; Hakala, J.; Heintz, U.; Jesus, O.; Laird, E.; Landsberg, G.; Mao, Z.; Narain, M.; Piperov, S.; Sagir, S.; Syarif, R.] Brown Univ, Providence, RI 02912 USA. [Breedon, R.; Breto, G.; Sanchez, M. Calderon De La Barca; Chauhan, S.; Chertok, M.; Conway, J.; Conway, R.; Cox, P. T.; Erbacher, R.; Funk, G.; Gardner, M.; Ko, W.; Lander, R.; Mclean, C.; Mulhearn, M.; Pellett, D.; Pilot, J.; Ricci-Tam, F.; Shalhout, S.; Smith, J.; Squires, M.; Stolp, D.; Tripathi, M.; Wilbur, S.; Yohay, R.] Univ Calif Davis, Davis, CA 95616 USA. [Cousins, R.; Everaerts, P.; Florent, A.; Hauser, J.; Ignatenko, M.; Saltzberg, D.; Takasugi, E.; Valuev, V.; Weber, M.] Univ Calif Los Angeles, Los Angeles, CA USA. [Burt, K.; Clare, R.; Ellison, J.; Gary, J. W.; Hanson, G.; Heilman, J.; Paneva, M. Ivova; Jandir, P.; Kennedy, E.; Lacroix, F.; Long, O. R.; Malberti, M.; Negrete, M. Olmedo; Shrinivas, A.; Wei, H.; Wimpenny, S.; Yates, B. R.] Univ Calif Riverside, Riverside, CA 92521 USA. [Branson, J. G.; Cerati, G. B.; Cittolin, S.; D'Agnolo, R. T.; Derdzinski, M.; Holzner, A.; Kelley, R.; Klein, D.; Letts, J.; Macneill, I.; Olivito, D.; Padhi, S.; Pieri, M.; Sani, M.; Sharma, V.; Simon, S.; Tadel, M.; Vartak, A.; Wasserbaech, S.; Welke, C.; Wuethwein, F.; Yagil, A.; Della Porta, G. Zevi] Univ Calif San Diego, La Jolla, CA 92093 USA. [Bradmiller-Feld, J.; Campagnari, C.; Dishaw, A.; Dutta, V.; Flowers, K.; Sevilla, M. Franco; Geffert, P.; George, C.; Golf, F.; Gouskos, L.; Gran, J.; Incandela, J.; Mccoll, N.; Mullin, S. D.; Richman, J.; Stuart, D.; Suarez, I.; West, C.; Yoo, J.] Univ Calif Santa Barbara, Santa Barbara, CA 93106 USA. [Dubinin, M.; Anderson, D.; Apresyan, A.; Bendavid, J.; Bornheim, A.; Bunn, J.; Chen, Y.; Duarte, J.; Mott, A.; Newman, H. B.; Pena, C.; Spiropulu, M.; Vlimant, J. R.; Xie, S.; Zhu, R. Y.] CALTECH, Pasadena, CA 91125 USA. [Andrews, M. B.; Azzolini, V.; Calamba, A.; Carlson, B.; Ferguson, T.; Paulini, M.; Russ, J.; Sun, M.; Vogel, H.; Vorobiev, I.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Cumalat, J. P.; Ford, W. T.; Gaz, A.; Jensen, F.; Johnson, A.; Krohn, M.; Mulholland, T.; Nauenberg, U.; Stenson, K.; Wagner, S. R.] Univ Colorado, Boulder, CO 80309 USA. [Alexander, J.; Chatterjee, A.; Chaves, J.; Chu, J.; Dittmer, S.; Eggert, N.; Mirman, N.; Kaufman, G. Nicolas; Patterson, J. R.; Rinkevicius, A.; Ryd, A.; Skinnari, L.; Soffi, L.; Sun, W.; Tan, S. M.; Teo, W. D.; Thom, J.; Thompson, J.; Tucker, J.; Weng, Y.; Wittich, P.] Cornell Univ, Ithaca, NY USA. [Abdullin, S.; Albrow, M.; Apollinari, G.; Banerjee, S.; Bauerdick, L. A. T.; Beretvas, A.; Berryhill, J.; Bhat, P. C.; Bolla, G.; Burkett, K.; Butler, J. N.; Cheung, H. W. K.; Chlebana, F.; Cihangir, S.; Elvira, V. D.; Fisk, I.; Freeman, J.; Gottschalk, E.; Gray, L.; Green, D.; Grunendahl, S.; Gutsche, O.; Hanlon, J.; Hare, D.; Harris, R. M.; Hasegawa, S.; Hu, Z.; Jayatilaka, B.; Jindariani, S.; Johnson, M.; Joshi, U.; Klima, B.; Kreis, B.; Lammel, S.; Lewis, J.; Linacre, J.; Lincoln, D.; Lipton, R.; Liu, T.; De Sa, R. Lopes; Lykken, J.; Maeshima, K.; Marraffino, J. M.; Maruyama, S.; Mason, D.; McBride, P.; Merkel, P.; Mrenna, S.; Nahn, S.; Newman-Holmes, C.; O'Dell, V.; Pedro, K.; Prokofyev, O.; Rakness, G.; Sexton-Kennedy, E.; Soha, A.; Spalding, W. J.; Spiegel, L.; Stoynev, S.; Strobbe, N.; Taylor, L.; Tkaczyk, S.; Tran, N. V.; Uplegger, L.; Vaandering, E. W.; Vernieri, C.; Verzocchi, M.; Vidal, R.; Wang, M.; Weber, H. A.; Whitbeck, A.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Acosta, D.; Avery, P.; Bortignon, P.; Bourilkov, D.; Brinkerhoff, A.; Carnes, A.; Carver, M.; Curry, D.; Das, S.; Field, R. D.; Furic, I. K.; Konigsberg, J.; Korytov, A.; Kotov, K.; Ma, P.; Matchev, K.; Mei, H.; Milenovic, P.; Mitselmakher, G.; Rank, D.; Rossin, R.; Shchutska, L.; Snowball, M.; Sperka, D.; Terentyev, N.; Thomas, L.; Wang, J.; Wang, S.; Yelton, J.] Univ Florida, Gainesville, FL USA. [Linn, S.; Markowitz, P.; Martinez, G.; Rodriguez, J. L.] Florida Int Univ, Miami, FL 33199 USA. [Ackert, A.; Adams, J. R.; Adams, T.; Askew, A.; Bein, S.; Bochenek, J.; Diamond, B.; Haas, J.; Hagopian, S.; Hagopian, V.; Johnson, K. F.; Khatiwada, A.; Prosper, H.; Weinberg, M.] Florida State Univ, Tallahassee, FL 32306 USA. [Baarmand, M. M.; Bhopatkar, V.; Colafranceschi, S.; Hohlmann, M.; Kalakhety, H.; Noonan, D.; Roy, T.; Yumiceva, F.] Florida Inst Technol, Melbourne, FL 32901 USA. [Adams, M. R.; Apanasevich, L.; Berry, D.; Betts, R. R.; Bucinskaite, I.; Cavanaugh, R.; Evdokimov, O.; Gauthier, L.; Gerber, C. E.; Hofman, D. J.; Kurt, P.; O'Brien, C.; Gonzalez, I. D. Sandoval; Turner, P.; Varelas, N.; Wu, Z.; Zakaria, M.; Zhang, J.] Univ Illinois, Chicago, IL USA. [Bilki, B.; Clarida, W.; Dilsiz, K.; Durgut, S.; Gandrajula, R. P.; Haytmyradov, M.; Khristenko, V.; Merlo, J. -P.; Mermerkaya, H.; Mestvirishvili, A.; Moeller, A.; Nachtman, J.; Ogul, H.; Onel, Y.; Ozok, F.; Penzo, A.; Snyder, C.; Tiras, E.; Wetzel, J.; Yi, K.] Univ Iowa, Iowa City, IA USA. [Anderson, I.; Barnett, B. A.; Blumenfeld, B.; Cocoros, A.; Eminizer, N.; Fehling, D.; Feng, L.; Gritsan, A. V.; Maksimovic, P.; Osherson, M.; Roskes, J.; Sarica, U.; Swartz, M.; Xiao, M.; Xin, Y.; You, C.] Johns Hopkins Univ, Baltimore, MD USA. [Baringer, P.; Bean, A.; Bruner, C.; Kenny, R. P., III; Majumder, D.; Malek, M.; Mcbrayer, W.; Murray, M.; Sanders, S.; Stringer, R.; Wang, Q.] Univ Kansas, Lawrence, KS 66045 USA. [Ivanov, A.; Kaadze, K.; Khalil, S.; Makouski, M.; Maravin, Y.; Mohammadi, A.; Saini, L. K.; Skhirtladze, N.; Toda, S.] Kansas State Univ, Manhattan, KS 66506 USA. [Lange, D.; Rebassoo, F.; Wright, D.] Lawrence Livermore Natl Lab, Livermore, CA USA. [Anelli, C.; Baden, A.; Baron, O.; Belloni, A.; Calvert, B.; Eno, C.; Ferraioli, C.; Gomez, J. A.; Hadley, N. J.; Jabeen, S.; Kellogg, R. G.; Kolberg, T.; Kunkle, J.; Lu, Y.; Mignerey, A. C.; Shin, Y. H.; Skuja, A.; Tonjes, M. B.; Tonwar, S. C.] Univ Maryland, College Pk, MD 20742 USA. [Apyan, A.; Barbieri, R.; Baty, A.; Bi, R.; Bierwagen, K.; Brandt, S.; Busza, W.; Cali, I. A.; Demiragli, Z.; Di Matteo, L.; Ceballos, G. Gomez; Goncharov, M.; Gulhan, D.; Iiyama, Y.; Innocenti, G. M.; Klute, M.; Kovalskyi, D.; Krajczar, K.; Lai, Y. S.; Lee, Y. -J.; Levin, A.; Luckey, P. D.; Marini, A. C.; Mcginn, C.; Mironov, C.; Narayanan, S.; Niu, X.; Paus, C.; Roland, C.; Roland, G.; Salfeld-Nebgen, J.; Stephans, G. S. F.; Sumorok, K.; Tatar, K.; Varma, M.; Velicanu, D.; Veverka, J.; Wang, J.; Wang, T. W.; Wyslouch, B.; Yang, M.; Zhukova, V.] MIT, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Benvenuti, A. C.; Dahmes, B.; Evans, A.; Finkel, A.; Gude, A.; Hansen, P.; Kalafut, S.; Kao, S. C.; Klapoetke, K.; Kubota, Y.; Lesko, Z.; Mans, J.; Nourbakhsh, S.; Ruckstuhl, N.; Rusack, R.; Tambe, N.; Turkewitz, J.] Univ Minnesota, Minneapolis, MN USA. [Acosta, J. G.; Oliveros, S.] Univ Mississippi, Oxford, MS USA. [Avdeeva, E.; Bartek, R.; Bloom, K.; Bose, S.; Claes, D. R.; Dominguez, A.; Fangmeier, C.; Suarez, R. Gonzalez; Kamalieddin, R.; Knowlton, D.; Kravchenko, I.; Meier, F.; Monroy, J.; Ratnikov, F.; Siado, J. E.; Snow, G. R.; Stieger, B.; Alyari, M.; Dolen, J.; George, J.; Godshalk, A.; Harrington, C.; Iashvili, I.; Kaisen, J.; Kharchilava, A.; Kumar, A.; Rappoccio, S.; Roozbahani, B.] Univ Nebraska, Lincoln, NE USA. [Alyari, M.; Dolen, J.; George, J.; Godshalk, A.; Harrington, C.; Iashvili, I.; Kaisen, J.; Kharchilava, A.; Kumar, A.; Rappoccio, S.; Roozbahani, B.] SUNY Buffalo, Buffalo, NY USA. [Alverson, G.; Barberis, E.; Baumgartel, D.; Chasco, M.; Hortiangtham, A.; Massironi, A.; Morse, D. M.; Nash, D.; Orimoto, T.; De Lima, R. Teixeira; Trocino, D.; Wang, R. -J.; Wood, D.; Zhang, J.] Northeastern Univ, Boston, MA 02115 USA. [Bhattacharya, S.; Hahn, K. A.; Kubik, A.; Low, J. F.; Mucia, N.; Odell, N.; Pollack, B.; Schmitt, M.; Sung, K.; Trovato, M.; Velasco, M.] Northwestern Univ, Evanston, IL USA. [Dev, N.; Hildreth, M.; Jessop, C.; Karmgard, D. J.; Kellams, N.; Lannon, K.; Marinelli, N.; Meng, F.; Mueller, C.; Musienko, Y.; Planer, M.; Reinsvold, A.; Ruchti, R.; Rupprecht, N.; Smith, G.; Taroni, S.; Valls, N.; Wayne, M.; Wolf, M.; Woodard, A.] Univ Notre Dame, Notre Dame, IN 46556 USA. [Antonelli, L.; Brinson, J.; Bylsma, B.; Durkin, L. S.; Flowers, S.; Hart, A.; Hill, C.; Hughes, R.; Ji, W.; Ling, T. Y.; Liu, B.; Luo, W.; Puigh, D.; Rodenburg, M.; Winer, B. L.; Wulsin, H. W.] Ohio State Univ, Columbus, OH 43210 USA. [Driga, O.; Elmer, P.; Hardenbrook, J.; Hebda, P.; Koay, S. A.; Lujan, P.; Marlow, D.; Medvedeva, T.; Mooney, M.; Olsen, J.; Palmer, C.; Piroue, P.; Stickland, D.; Tully, C.; Zuranski, A.] Princeton Univ, Princeton, NJ 08544 USA. [Malik, S.] Univ Puerto Rico, Mayaguez, PR USA. [Barker, A.; Barnes, V. E.; Benedetti, D.; Bortoletto, D.; Gutay, L.; Jha, M. K.; Jones, M.; Jung, A. W.; Jung, K.; Kumar, A.; Miller, D. H.; Neumeister, N.; Radburn-Smith, B. C.; Shi, X.; Shipsey, I.; Silvers, D.; Sun, J.; Svyatkovskiy, A.; Wang, F.; Xie, W.; Xu, L.] Purdue Univ, W Lafayette, IN 47907 USA. [Parashar, N.; Stupak, J.] Purdue Univ Calumet, Hammond, LA USA. [Adair, A.; Akgun, B.; Chen, Z.; Ecklund, K. M.; Geurts, F. J. M.; Guilbaud, M.; Li, W.; Michlin, B.; Northup, M.; Padley, B. P.; Redjimi, R.; Roberts, J.; Rorie, J.; Tu, Z.; Zabel, J.] Rice Univ, Houston, TX USA. [Betchart, B.; Bodek, A.; de Barbaro, P.; Demina, R.; Eshaq, Y.; Ferbel, T.; Galanti, M.; Garcia-Bellido, A.; Han, J.; Hindrichs, O.; Khukhunaishvili, A.; Lo, K. H.; Tan, P.; Verzetti, M.] Univ Rochester, Rochester, NY USA. [Chou, J. P.; Contreras-Campana, E.; Ferencek, D.; Gershtein, Y.; Halkiadakis, E.; Heindl, M.; Hidas, D.; Hughes, E.; Kaplan, S.; Elayavalli, R. Kunnawalkam; Lath, A.; Nash, K.; Saka, H.; Salur, S.; Schnetzer, S.; Sheffield, D.; Somalwar, S.; Stone, R.; Thomas, S.; Thomassen, P.; Walker, M.] Rutgers State Univ, Piscataway, NJ USA. [Foerster, M.; Riley, G.; Rose, K.; Spanier, S.; Thapa, K.] Univ Tennessee, Knoxville, TN USA. [Bouhali, O.; Hernandez, A. Castaneda; Celik, A.; Dalchenko, M.; De Mattia, M.; Delgado, A.; Dildick, S.; Eusebi, R.; Gilmore, J.; Huang, T.; Kamon, T.; Krutelyov, V.; Mueller, R.; Osipenkov, I.; Pakhotin, Y.; Patel, R.; Perloff, A.; Rathjens, D.; Rose, A.; Safonov, A.; Tatarinov, A.; Ulmer, K. A.] Texas A&M Univ, College Stn, TX USA. [Akchurin, N.; Cowden, C.; Damgov, J.; Dragoiu, C.; Dudero, P. R.; Faulkner, J.; Kunori, S.; Lamichhane, K.; Lee, S. W.; Libeiro, T.; Undleeb, S.; Volobouev, I.] Texas Tech Univ, Lubbock, TX 79409 USA. [Appelt, E.; Delannoy, A. G.; Greene, S.; Gurrola, A.; Janjam, R.; Johns, W.; Maguire, C.; Mao, Y.; Melo, A.; Ni, H.; Sheldon, P.; Tuo, S.; Velkovska, J.; Xu, Q.] Vanderbilt Univ, 221 Kirkland Hall, Nashville, TN 37235 USA. [Arenton, M. W.; Cox, B.; Francis, B.; Goodell, J.; Hirosky, R.; Ledovskoy, A.; Li, H.; Neu, C.; Sinthuprasith, T.; Sun, X.; Wang, Y.; Wolfe, E.; Wood, J.; Xia, F.] Univ Virginia, Charlottesville, VA USA. [Clarke, C.; Harr, R.; Karchin, P. E.; Don, C. Kottachchi Kankanamge; Lamichhane, P.; Sturdy, J.] Wayne State Univ, Detroit, MI USA. [Belknap, D. A.; Carlsmith, D.; Dasu, S.; Dodd, L.; Duric, S.; Gomber, B.; Grothe, M.; Herndon, M.; Herve, A.; Klabbers, P.; Lanaro, A.; Levine, A.; Long, K.; Loveless, R.; Mohapatra, A.; Ojalvo, I.; Perry, T.; Pierro, G. A.; Polese, G.; Ruggles, T.; Sarangi, T.; Savin, A.; Sharma, A.; Smith, N.; Smith, W. H.; Taylor, D.; Verwilligen, P.; Woods, N.] Univ Wisconsin, Madison, WI USA. [Fruehwirth, R.; Jeitler, M.; Krammer, M.; Wulz, C. -E.] Vienna Univ Technol, Vienna, Austria. [Chinellato, J.; Tonelli Manganote, E. J.] Univ Estadual Campinas, Campinas, SP, Brazil. [Moon, C. S.] CNRS, IN2P3, Paris, France. [El-Khateeb, E.] Ain Shams Univ, Cairo, Egypt. [Elgammal, S.] British Univ Egypt, Cairo, Egypt. [Mohamed, A.] Zewail City Sci & Technol, Zewail, Egypt. [Agram, J. -L.; Conte, E.; Fontaine, J. -C.] Univ Haute Alsace, Mulhouse, France. [Toriashvili, T.] Tbilisi State Univ, Tbilisi, Rep of Georgia. [Hempel, M.; Karacheban, O.; Lohmann, W.] Brandenburg Tech Univ Cottbus, Cottbus, Germany. [Vesztergombi, G.; Bartok, M.; Veres, G. I.] Eotvos Lorand Univ, MTA ELTE Lendulet CMS Particle & Nucl Phys Grp, Budapest, Hungary. [Choudhury, S.] Indian Inst Sci Educ & Res, Bhopal, India. [Bhowmik, S.; Maity, M.; Sarkar, T.] Visva Bharati Univ, Santini Ketan, W Bengal, India. [Gurtu, A.] King Abdulaziz Univ, Jeddah, Saudi Arabia. [Wickramage, N.] Univ Ruhuna, Matara, Sri Lanka. [Etesami, S. M.] Isfahan Univ Technol, Esfahan, Iran. [Fahim, A.] Univ Tehran, Dept Engn Sci, Tehran, Iran. [Safarzadeh, B.] Islamic Azad Univ, Sci & Res Branch, Plasma Phys Res Ctr, Tehran, Iran. [Androsov, K.; Ciocci, M. A.; Grippo, M. T.] Univ Siena, Siena, Italy. [Kim, T. J.] Hanyang Univ, Seoul, South Korea. [Ali, M. A. B. Md] Int Islamic Univ Malaysia, Kuala Lumpur, Malaysia. [Idris, F. Mohamad] MOSTI, Malaysian Nucl Agcy, Kajang, Malaysia. [Heredia-De La Cruz, I.] Consejo Nacl Ciencia & Technol, Mexico City, DF, Mexico. [Byszuk, A.; Zagozdzinska, A.] Warsaw Univ Technol, Inst Elect Syst, Warsaw, Poland. [Kim, V.] St Petersburg State Polytech Univ, St Petersburg, Russia. [Orfanelli, S.] Natl Tech Univ Athens, Athens, Greece. [Rolandi, G.] Ist Nazl Fis Nucl, Scuola Normale & Sez, Pisa, Italy. [Amsler, C.] Albert Einstein Ctr Fundamental Phys, Bern, Switzerland. [Adiguzel, A.] Gaziosmanpasa Univ, Tokat, Turkey. [Bakirci, M. N.; Cerci, D. Sunar] Adiyaman Univ, Adiyaman, Turkey. [Kangal, E. E.] Mersin Univ, Mersin, Turkey. [Onengut, G.] Cag Univ, Mersin, Turkey. [Ozdemir, K.] Piri Reis Univ, Istanbul, Turkey. [Isildak, B.] Ozyegin Univ, Istanbul, Turkey. [Kaya, M.; Kaya, O.] Izmir Inst Technol, Izmir, Turkey. [Kaya, M.; Kaya, O.] Marmara Univ, Istanbul, Turkey. [Yetkin, E. A.] Istanbul Bilgi Univ, Istanbul, Turkey. [Yetkin, T.] Yildiz Tech Univ, Istanbul, Turkey. [Sen, S.] Hacettepe Univ, Ankara, Turkey. [Belyaev, A.] Univ Southampton, Sch Phys & Astron, Southampton, Hants, England. [Acosta, M. Vazquez] Inst Astrofis Canarias, San Cristobal la Laguna, Spain. [Wasserbaech, S.] Utah Valley Univ, Orem, UT USA. [Colafranceschi, S.] Univ Roma, Fac Ingn, Rome, Italy. [Bilki, B.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Mermerkaya, H.] Erzincan Univ, Erzincan, Turkey. [Ozok, F.] Mimar Sinan Univ, Istanbul, Turkey. [Bouhali, O.; Hernandez, A. Castaneda] Texas A&M Univ Qatar, Doha, Qatar. RP Khachatryan, V (reprint author), Yerevan Phys Inst, Yerevan, Armenia. RI Puljak, Ivica/D-8917-2017; Della Ricca, Giuseppe/B-6826-2013; Fernandez Menendez, Javier/B-6550-2014; Manganote, Edmilson/K-8251-2013; Lokhtin, Igor/D-7004-2012; TUVE', Cristina/P-3933-2015; Goh, Junghwan/Q-3720-2016; Konecki, Marcin/G-4164-2015 OI Della Ricca, Giuseppe/0000-0003-2831-6982; Fernandez Menendez, Javier/0000-0002-5213-3708; TUVE', Cristina/0000-0003-0739-3153; Goh, Junghwan/0000-0002-1129-2083; Konecki, Marcin/0000-0001-9482-4841 FU Austrian Federal Ministry of Science, Research and Economy; Austrian Science Fund; Belgian Fonds de la Recherche Scientifique; Fonds voor Wetenschappelijk Onderzoek; CNPq; CAPES; FAPERJ; FAPESP; Bulgarian Ministry of Education and Science; CERN; Chinese Academy of Sciences; Ministry of Science and Technology; National Natural Science Foundation of China; Colombian Funding Agency (COLCIENCIAS); Croatian Ministry of Science, Education and Sport; Croatian Science Foundation; Research Promotion Foundation, Cyprus; Ministry of Education and Research; Estonian Research Council [IUT23-4, IUT23-6]; European Regional Development Fund, Estonia; Academy of Finland; Finnish Ministry of Education and Culture; Helsinki Institute of Physics; Institut National de Physique Nucleaire et de Physique des Particules / CNRS; Commissariat a l'Energie Atomique et aux Energies Alternatives / CEA, France; Bundesministerium fur Bildung und Forschung, Germany; Deutsche Forschungsgemeinschaft, Germany; Helmholtz-Gemeinschaft Deutscher Forschungszentren, Germany; General Secretariat for Research and Technology, Greece; National Scientific Research Foundation, Hungary; National Innovation Office, Hungary; Department of Atomic Energy, India; Department of Science and Technology, India; Institute for Studies in Theoretical Physics and Mathematics, Iran; Science Foundation, Ireland; Istituto Nazionale di Fisica Nucleare, Italy; Ministry of Science, ICT and Future Planning, Republic of Korea; National Research Foundation (NRF), Republic of Korea; Lithuanian Academy of Sciences; Ministry of Education (Malaysia); University of Malaya (Malaysia); CINVESTAV; CONACYT; SEP; UASLP-FAI; Ministry of Business, Innovation and Employment, New Zealand; Pakistan Atomic Energy Commission; Ministry of Science and Higher Education, Poland; National Science Center, Poland; Fundacao para a Ciencia e a Tecnologia, Portugal; JINR, Dubna; Ministry of Education and Science of the Russian Federation; Federal Agency of Atomic Energy of the Russian Federation; Russian Academy of Sciences; Russian Foundation for Basic Research; Ministry of Education, Science and Technological Development of Serbia; Secretaria de Estado de Investigacion, Desarrollo e Innovacion; Programa Consolider-Ingenio, Spain; ETH Board; ETH Zurich; PSI; SNF; UniZH; Canton Zurich; SER; Ministry of Science and Technology, Taipei; Thailand Center of Excellence in Physics; Institute for the Promotion of Teaching Science and Technology of Thailand; Special Task Force for Activating Research; National Science and Technology Development Agency of Thailand; Scientific and Technical Research Council of Turkey; Turkish Atomic Energy Authority; National Academy of Sciences of Ukraine; State Fund for Fundamental Researches, Ukraine; Science and Technology Facilities Council, U.K; US Department of Energy; US National Science Foundation FX We congratulate our colleagues in the CERN accelerator departments for the excellent performance of the LHC and thank the technical and administrative staffs at CERN and at other CMS institutes for their contributions to the success of the CMS effort. In addition, we gratefully acknowledge the computing centers and personnel of the Worldwide LHC Computing Grid for delivering so effectively the computing infrastructure essential to our analyses.; Finally, we acknowledge the enduring support for the construction and operation of the LHC and the CMS detector provided by the following funding agencies: the Austrian Federal Ministry of Science, Research and Economy and the Austrian Science Fund; the Belgian Fonds de la Recherche Scientifique, and Fonds voor Wetenschappelijk Onderzoek; the Brazilian Funding Agencies (CNPq, CAPES, FAPERJ, and FAPESP); the Bulgarian Ministry of Education and Science; CERN; the Chinese Academy of Sciences, Ministry of Science and Technology, and National Natural Science Foundation of China; the Colombian Funding Agency (COLCIENCIAS); the Croatian Ministry of Science, Education and Sport, and the Croatian Science Foundation; the Research Promotion Foundation, Cyprus; the Ministry of Education and Research, Estonian Research Council via IUT23-4 and IUT23-6 and European Regional Development Fund, Estonia; the Academy of Finland, Finnish Ministry of Education and Culture, and Helsinki Institute of Physics; the Institut National de Physique Nucleaire et de Physique des Particules / CNRS, and Commissariat a l'Energie Atomique et aux Energies Alternatives / CEA, France; the Bundesministerium fur Bildung und Forschung, Deutsche Forschungsgemeinschaft, and Helmholtz-Gemeinschaft Deutscher Forschungszentren, Germany; the General Secretariat for Research and Technology, Greece; the National Scientific Research Foundation, and National Innovation Office, Hungary; the Department of Atomic Energy and the Department of Science and Technology, India; the Institute for Studies in Theoretical Physics and Mathematics, Iran; the Science Foundation, Ireland; the Istituto Nazionale di Fisica Nucleare, Italy; the Ministry of Science, ICT and Future Planning, and National Research Foundation (NRF), Republic of Korea; the Lithuanian Academy of Sciences; the Ministry of Education, and University of Malaya (Malaysia); the Mexican Funding Agencies (CINVESTAV, CONACYT, SEP, and UASLP-FAI); the Ministry of Business, Innovation and Employment, New Zealand; the Pakistan Atomic Energy Commission; the Ministry of Science and Higher Education and the National Science Center, Poland; the Fundacao para a Ciencia e a Tecnologia, Portugal; JINR, Dubna; the Ministry of Education and Science of the Russian Federation, the Federal Agency of Atomic Energy of the Russian Federation, Russian Academy of Sciences, and the Russian Foundation for Basic Research; the Ministry of Education, Science and Technological Development of Serbia; the Secretaria de Estado de Investigacion, Desarrollo e Innovacion and Programa Consolider-Ingenio 2010, Spain; the Swiss Funding Agencies (ETH Board, ETH Zurich, PSI, SNF, UniZH, Canton Zurich, and SER); the Ministry of Science and Technology, Taipei; the Thailand Center of Excellence in Physics, the Institute for the Promotion of Teaching Science and Technology of Thailand, Special Task Force for Activating Research and the National Science and Technology Development Agency of Thailand; the Scientific and Technical Research Council of Turkey, and Turkish Atomic Energy Authority; the National Academy of Sciences of Ukraine, and State Fund for Fundamental Researches, Ukraine; the Science and Technology Facilities Council, U.K.; the US Department of Energy, and the US National Science Foundation.; Individuals have received support from the Marie-Curie programme and the European Research Council and EPLANET (European Union); the Leventis Foundation; the A. P. Sloan Foundation; the Alexander von Humboldt Foundation; the Belgian Federal Science Policy Office; the Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); the Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); the Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; the Council of Science and Industrial Research, India; the HOMING PLUS programme of the Foundation for Polish Science, cofinanced from European Union, Regional Development Fund; the OPUS programme of the National Science Center (Poland); the Compagnia di San Paolo (Torino); MIUR project 20108T4XTM (Italy); the Thalis and Aristeia programmes cofinanced by EU-ESF and the Greek NSRF; the National Priorities Research Program by Qatar National Research Fund; the Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University (Thailand); the Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); and the Welch Foundation, contract C-1845; and the Weston Havens Foundation (U.S.A.). NR 92 TC 0 Z9 0 U1 20 U2 20 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1029-8479 J9 J HIGH ENERGY PHYS JI J. High Energy Phys. PD DEC 19 PY 2016 IS 12 AR 088 DI 10.1007/JHEP12(2016)088 PG 48 WC Physics, Particles & Fields SC Physics GA EH5OW UT WOS:000391823600001 ER PT J AU Cortijo, A Kharzeev, D Landsteiner, K Vozmediano, MAH AF Cortijo, Alberto Kharzeev, Dmitri Landsteiner, Karl Vozmediano, Maria A. H. TI Strain-induced chiral magnetic effect in Weyl semimetals SO PHYSICAL REVIEW B LA English DT Article ID NEGATIVE MAGNETORESISTANCE; CD3AS2 AB We argue that strain applied to a time-reversal and inversion breaking Weyl semimetal in a magnetic field can induce an electric current via the chiral magnetic effect. A tight-binding model is used to show that strain generically changes the locations in the Brillouin zone but also the energies of the band touching points (tips of the Weyl cones). Since axial charge in a Weyl semimetal can relax via intervalley scattering processes, the induced current will decay with a time scale given by the lifetime of a chiral quasiparticle. We estimate the strength and lifetime of the current for typical material parameters and find that it should be experimentally observable. C1 [Cortijo, Alberto; Vozmediano, Maria A. H.] Inst Ciencia Mat Madrid, C Sor Juana Ines de la Cruz 3, Madrid 28049, Spain. [Kharzeev, Dmitri] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Kharzeev, Dmitri] Brookhaven Natl Lab, Dept Phys, Upton, NY 11973 USA. [Kharzeev, Dmitri] Brookhaven Natl Lab, RIKEN BNL Res Ctr, Upton, NY 11973 USA. [Landsteiner, Karl] UAM CSIC, Inst Fis Teor, C Nicolas Cabrera 13-15, Madrid 28049, Spain. RP Cortijo, A (reprint author), Inst Ciencia Mat Madrid, C Sor Juana Ines de la Cruz 3, Madrid 28049, Spain. OI Landsteiner, Karl/0000-0003-4583-4511 FU Spanish MECD [FIS2014-57432-P]; European Union; Comunidad de Madrid MAD2D-CM Program [S2013/MIT-3007]; MINECO (Spain) [FIS2015-73454-JIN]; European Union [604391]; U.S. Department of Energy [DE-FG-88ER40388, DE-AC02-98CH10886]; Severo Ochoa Programme [SEV-2012-0249, FPA2015-65480-P]; Simons Center for Geometry and Physics, Stony Brook University FX M.A.H.V. thanks F. de Juan and A. Grushin for useful conversations. The work of A.C. and M.A.H.V. has been supported by Spanish MECD Grant No. FIS2014-57432-P, the European Union structural funds and the Comunidad de Madrid MAD2D-CM Program (S2013/MIT-3007), the MINECO (Spain) Grant No. FIS2015-73454-JIN, and by the European Union Seventh Framework Programme under Grant Agreement No. 604391 Graphene Flagship. The work of D.K. has been supported in part by the U.S. Department of Energy under Contracts No. DE-FG-88ER40388 and No. DE-AC02-98CH10886. The work of K.L. has been supported by Severo Ochoa Programme Grant No. SEV-2012-0249 and by FPA2015-65480-P (MINECO). K.L. and M.A.H.V. gratefully acknowledge support from the Simons Center for Geometry and Physics, Stony Brook University, where some of the research for this paper was performed. NR 37 TC 3 Z9 3 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 19 PY 2016 VL 94 IS 24 AR 241405 DI 10.1103/PhysRevB.94.241405 PG 5 WC Physics, Condensed Matter SC Physics GA EI9EH UT WOS:000392809800003 ER PT J AU Gamble, JK Harvey-Collard, P Jacobson, NT Baczewski, AD Nielsen, E Maurer, L Montano, I Rudolph, M Carroll, MS Yang, CH Rossi, A Dzurak, AS Muller, RP AF Gamble, John King Harvey-Collard, Patrick Jacobson, N. Tobias Baczewski, Andrew D. Nielsen, Erik Maurer, Leon Montano, Ines Rudolph, Martin Carroll, M. S. Yang, C. H. Rossi, A. Dzurak, A. S. Muller, Richard P. TI Valley splitting of single-electron Si MOS quantum dots SO APPLIED PHYSICS LETTERS LA English DT Article ID SPIN QUBIT; SILICON; COMPUTATION AB Silicon-based metal-oxide-semiconductor quantum dots are prominent candidates for high-fidelity, manufacturable qubits. Due to silicon's band structure, additional low-energy states persist in these devices, presenting both challenges and opportunities. Although the physics governing these valley states has been the subject of intense study, quantitative agreement between experiment and theory remains elusive. Here, we present data from an experiment probing the valley states of quantum dot devices and develop a theory that is in quantitative agreement with both this and a recently reported experiment. Through sampling millions of realistic cases of interface roughness, our method provides evidence that the valley physics between the two samples is essentially the same. Published by AIP Publishing. C1 [Gamble, John King; Jacobson, N. Tobias; Baczewski, Andrew D.; Maurer, Leon; Muller, Richard P.] Sandia Natl Labs, Ctr Res Comp, Albuquerque, NM 87185 USA. [Harvey-Collard, Patrick] Univ Sherbrooke, Dept Phys, Sherbrooke, PQ J1K 2R1, Canada. [Harvey-Collard, Patrick] Univ Sherbrooke, Inst Quant, Sherbrooke, PQ J1K 2R1, Canada. [Harvey-Collard, Patrick; Nielsen, Erik; Montano, Ines; Rudolph, Martin; Carroll, M. S.] Sandia Natl Labs, Albuquerque, NM 87185 USA. [Yang, C. H.; Dzurak, A. S.] Univ New South Wales, Sch Elect Engn & Telecommun, Australian Res Council Ctr Excellence Quantum Com, Sydney, NSW 2052, Australia. [Rossi, A.] Univ Cambridge, Cavendish Lab, Cambridge CB3 0HE, England. RP Gamble, JK (reprint author), Sandia Natl Labs, Ctr Res Comp, Albuquerque, NM 87185 USA. EM jkgambl@sandia.gov OI Maurer, Leon/0000-0001-5015-5594 FU U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000]; Sandia National Laboratories Truman Fellowship Program; Laboratory Directed Research and Development (LDRD) program; Australian Research Council [CE11E0001017]; U.S. Army Research Office [W911NF-13-1-0024]; NSW Node of the Australian National Fabrication Facility; European Union's Horizon 2020 research and innovation programme under the Marie Sklodowska-Curie Grant [654712] FX The authors acknowledge useful discussions with F. Mohiyaddin and M. Usman. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract No. DE-AC04-94AL85000. J.K.G. gratefully acknowledges support from the Sandia National Laboratories Truman Fellowship Program, which is funded by the Laboratory Directed Research and Development (LDRD) program. This work was performed, in part, at the Center for Integrated Nanotechnologies, an Office of Science User Facility operated for the U.S. Department of Energy (DOE) Office of Science. C.H.Y. and A.S.D. acknowledge support from the Australian Research Council (CE11E0001017), the U.S. Army Research Office (W911NF-13-1-0024) and the NSW Node of the Australian National Fabrication Facility. A.R. acknowledges support from the European Union's Horizon 2020 research and innovation programme under the Marie Sklodowska-Curie Grant Agreement No. 654712 (SINHOPSI). NR 29 TC 0 Z9 0 U1 8 U2 8 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 19 PY 2016 VL 109 IS 25 AR 253101 DI 10.1063/1.4972514 PG 4 WC Physics, Applied SC Physics GA EH6BK UT WOS:000391857200025 ER PT J AU Goldflam, MD Kadlec, EA Olson, BV Klem, JF Hawkins, SD Parameswaran, S Coon, WT Keeler, GA Fortune, TR Tauke-Pedretti, A Wendt, JR Shaner, EA Davids, PS Kim, JK Peters, DW AF Goldflam, M. D. Kadlec, E. A. Olson, B. V. Klem, J. F. Hawkins, S. D. Parameswaran, S. Coon, W. T. Keeler, G. A. Fortune, T. R. Tauke-Pedretti, A. Wendt, J. R. Shaner, E. A. Davids, P. S. Kim, J. K. Peters, D. W. TI Enhanced infrared detectors using resonant structures combined with thin type-II superlattice absorbers SO APPLIED PHYSICS LETTERS LA English DT Article ID LAYER SUPERLATTICES; CARRIER LIFETIMES; DEVICES; HGCDTE AB We examined the spectral responsivity of a 1.77 mu m thick type-II superlattice based long-wave infrared detector in combination with metallic nanoantennas. Coupling between the Fabry-Perot cavity formed by the semiconductor layer and the resonant nanoantennas on its surface enables spectral selectivity, while also increasing peak quantum efficiency to over 50%. Electromagnetic simulations reveal that this high responsivity is a direct result of field-enhancement in the absorber layer, enabling significant absorption in spite of the absorber's subwavelength thickness. Notably, thinning of the absorbing material could ultimately yield lower photodetector noise through a reduction in dark current while improving photocarrier collection efficiency. The temperature-and incident-angle-independent spectral response observed in these devices allows for operation over a wide range of temperatures and optical systems. This detector paradigm demonstrates potential benefits to device performance with applications throughout the infrared. Published by AIP Publishing. C1 [Goldflam, M. D.; Kadlec, E. A.; Olson, B. V.; Klem, J. F.; Hawkins, S. D.; Parameswaran, S.; Coon, W. T.; Keeler, G. A.; Fortune, T. R.; Tauke-Pedretti, A.; Wendt, J. R.; Shaner, E. A.; Davids, P. S.; Kim, J. K.; Peters, D. W.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. RP Goldflam, MD (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. EM mgoldfl@sandia.gov FU U.S. Department of Energy [DE-AC04-94AL85000, 2011-XXXXP]; Department of Energy's Office of Basic Energy Science FX Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. SAND No. 2011-XXXXP. This work was supported in part by the Department of Energy's Office of Basic Energy Science. NR 35 TC 0 Z9 0 U1 7 U2 7 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 19 PY 2016 VL 109 IS 25 AR 251103 DI 10.1063/1.4972844 PG 5 WC Physics, Applied SC Physics GA EH6BK UT WOS:000391857200003 ER PT J AU Liu, W Chen, YQ Lu, WT Moy, A Poelker, M Stutzman, M Zhang, SK AF Liu, Wei Chen, Yiqiao Lu, Wentao Moy, Aaron Poelker, Matthew Stutzman, Marcy Zhang, Shukui TI Record-level quantum efficiency from a high polarization strained GaAs/GaAsP superlattice photocathode with distributed Bragg reflector SO APPLIED PHYSICS LETTERS LA English DT Article ID ELECTRON-SPIN POLARIZATION; GAAS; PHOTOEMISSION; PHOTOELECTRONS; INGAAS; LAYER AB Photocathodes that provide high electron-spin polarization (ESP) and high quantum efficiency (QE) can significantly enhance the physics capabilities of electron accelerators. We report record-level QE from a high-polarization strained GaAs/GaAsP superlattice photocathode fabricated with a Distributed Bragg Reflector (DBR). The DBR photocathode technique enhances the absorption of incident laser light thereby enhancing QE, but as literature suggests, it is very challenging to optimize all of the parameters associated with the fabrication of complicated photocathode structures composed of many distinct layers. Past reports of DBR photocathodes describe high polarization but typically QE of only similar to 1%, which is comparable to QE of high polarization photocathodes grown without a DBR structure. This work describes a strained GaAs/GaAsP superlattice DBR photocathode exhibiting a high polarization of 84% and significantly enhanced QE of 6.4%. Published by AIP Publishing. C1 [Liu, Wei] Chinese Acad Sci, Inst Modern Phys, 509 Nanchang Rd, Lanzhou 730000, Peoples R China. [Liu, Wei] Univ Chinese Acad Sci, 19 A Yuquan Rd, Beijing 100049, Peoples R China. [Liu, Wei; Poelker, Matthew; Stutzman, Marcy; Zhang, Shukui] Thomas Jefferson Natl Accelerator Facil, 12000 Jefferson Ave, Newport News, VA 23606 USA. [Chen, Yiqiao; Lu, Wentao; Moy, Aaron] SVT Associates Inc, 7620 Executive Dr, Eden Prairie, MN 55344 USA. RP Liu, W (reprint author), Chinese Acad Sci, Inst Modern Phys, 509 Nanchang Rd, Lanzhou 730000, Peoples R China.; Liu, W (reprint author), Univ Chinese Acad Sci, 19 A Yuquan Rd, Beijing 100049, Peoples R China.; Liu, W (reprint author), Thomas Jefferson Natl Accelerator Facil, 12000 Jefferson Ave, Newport News, VA 23606 USA. EM weiliu1006@yahoo.com FU U.S. DOE [DE-AC05-06OR23177]; U.S. DOEs Office of Nuclear Physics SBIR program [DE-SC0009516] FX Authored by Jefferson Science Associates, LLC under U.S. DOE Contract No. DE-AC05-06OR23177. The U.S. Government retains a non-exclusive, paid-up, irrevocable, world-wide license to publish or reproduce this manuscript for U.S. Government purposes. SVT Associates was funded by the U.S. DOEs Office of Nuclear Physics SBIR program DE-SC0009516. W. Liu is currently conducting research at Jefferson Lab toward a Ph.D. degree. NR 36 TC 1 Z9 1 U1 4 U2 4 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 19 PY 2016 VL 109 IS 25 AR 252104 DI 10.1063/1.4972180 PG 5 WC Physics, Applied SC Physics GA EH6BK UT WOS:000391857200010 ER PT J AU Ovodenko, A Agustsson, R Babzien, M Campese, T Fedurin, M Murokh, A Pogorelsky, I Polyanskiy, M Rosenzweig, J Sakai, Y Shaftan, T Swinson, C AF Ovodenko, A. Agustsson, R. Babzien, M. Campese, T. Fedurin, M. Murokh, A. Pogorelsky, I. Polyanskiy, M. Rosenzweig, J. Sakai, Y. Shaftan, T. Swinson, C. TI High duty cycle inverse Compton scattering X-ray source SO APPLIED PHYSICS LETTERS LA English DT Article ID NUCLEAR-RESONANCE FLUORESCENCE; THOMSON SCATTERING; CAVITY; BEAMS AB Inverse Compton Scattering (ICS) is an emerging compact X-ray source technology, where the small source size and high spectral brightness are of interest for multitude of applications. However, to satisfy the practical flux requirements, a high-repetition-rate ICS system needs to be developed. To this end, this paper reports the experimental demonstration of a high peak brightness ICS source operating in a burst mode at 40 MHz. A pulse train interaction has been achieved by recirculating a picosecond CO2 laser pulse inside an active optical cavity synchronized to the electron beam. The pulse train ICS performance has been characterized at 5- and 15-pulses per train and compared to a single pulse operation under the same operating conditions. With the observed near-linear X-ray photon yield gain due to recirculation, as well as noticeably higher operational reliability, the burst-mode ICS offers a great potential for practical scalability towards high duty cycles. Published by AIP Publishing. C1 [Ovodenko, A.; Agustsson, R.; Campese, T.; Murokh, A.] RadiaBeam Technol LLC, 1717 Stewart St, Santa Monica, CA 90404 USA. [Babzien, M.; Fedurin, M.; Pogorelsky, I.; Polyanskiy, M.; Swinson, C.] Brookhaven Natl Lab, Accelerator Test Facil, Upton, NY 11973 USA. [Rosenzweig, J.; Sakai, Y.] Univ Calif Los Angeles, Los Angeles, CA 90095 USA. [Shaftan, T.] Brookhaven Natl Lab, NSLS 2, Upton, NY 11973 USA. RP Murokh, A (reprint author), RadiaBeam Technol LLC, 1717 Stewart St, Santa Monica, CA 90404 USA. EM murokh@radiabeam.com FU DOE SBIR [DE-SC0007703]; U.S. DOE [DE-AC02-98CH10886]; U.S. Department of Homeland Security [2014-DN-077-ARI084-01] FX This work is supported by the DOE SBIR Grant No. DE-SC0007703, the U.S. DOE Contract No. DE-AC02-98CH10886, and U.S. Department of Homeland Security Grant No. 2014-DN-077-ARI084-01. NR 42 TC 0 Z9 0 U1 3 U2 3 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 19 PY 2016 VL 109 IS 25 AR 253504 DI 10.1063/1.4972344 PG 4 WC Physics, Applied SC Physics GA EH6BK UT WOS:000391857200043 ER PT J AU Segercrantz, N Baumgartner, Y Ting, M Yu, KM Mao, SS Sarney, WL Svensson, SP Walukiewicz, W AF Segercrantz, N. Baumgartner, Y. Ting, M. Yu, K. M. Mao, S. S. Sarney, W. L. Svensson, S. P. Walukiewicz, W. TI Undoped p-type GaN1-xSbx alloys: Effects of annealing SO APPLIED PHYSICS LETTERS LA English DT Article ID MG-DOPED GAN; AMPHOTERIC NATIVE DEFECTS; POLYCRYSTALLINE GAN; PHOTOLUMINESCENCE BANDS; BEAM; SEMICONDUCTORS; DEPOSITION; MECHANISM; FILMS AB We report p-type behavior for undoped GaN1-xSbx alloys with x >= 0.06 grown by molecular beam epitaxy at low temperatures (<= 400 degrees C). Rapid thermal annealing of the GaN1-xSbx films at temperatures >400 degrees C is shown to generate hole concentrations greater than 10(19) cm(-3), an order of magnitude higher than typical p-type GaN achieved by Mg doping. The p-type conductivity is attributed to a large upward shift of the valence band edge resulting from the band anticrossing interaction between localized Sb levels and extended states of the host matrix. Published by AIP Publishing. C1 [Segercrantz, N.] Aalto Univ, Sch Sci, Dept Appl Phys, POB 15100, FIN-00076 Espoo, Finland. [Segercrantz, N.; Baumgartner, Y.; Ting, M.; Walukiewicz, W.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Baumgartner, Y.] Ecole Polytech Fed Lausanne, Inst Mat, CH-1015 Lausanne, Switzerland. [Ting, M.; Mao, S. S.] Univ Calif Berkeley, Dept Mech Engn, Berkeley, CA 94720 USA. [Yu, K. M.] City Univ Hong Kong, Dept Phys & Mat Sci, Kowloon, Hong Kong, Peoples R China. [Sarney, W. L.; Svensson, S. P.] US Army Res Lab, 2800 Powder Mill Rd, Adelphi, MD 20783 USA. RP Segercrantz, N (reprint author), Aalto Univ, Sch Sci, Dept Appl Phys, POB 15100, FIN-00076 Espoo, Finland.; Segercrantz, N (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. OI Yu, Kin Man/0000-0003-1350-9642 FU U.S. Department of Energy [DE-AC02-05CH11231]; General Research Fund of the Research Grants Council of Hong Kong SAR, China [CityU 11303715] FX Materials processing, electrical and structural measurements, and interpretation of the data were carried out at LBNL and were supported by the Director, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. The sample growth and the TEM measurements were performed at the U.S. Army Research Laboratory. K. M. Yu acknowledges the support of the General Research Fund of the Research Grants Council of Hong Kong SAR, China, under Project No. CityU 11303715. NR 23 TC 0 Z9 0 U1 5 U2 5 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 19 PY 2016 VL 109 IS 25 AR 252102 DI 10.1063/1.4972559 PG 5 WC Physics, Applied SC Physics GA EH6BK UT WOS:000391857200008 ER PT J AU Shivaram, N Champenois, EG Cryan, JP Wright, T Wingard, T Belkacem, A AF Shivaram, Niranjan Champenois, Elio G. Cryan, James P. Wright, Travis Wingard, Taylor Belkacem, Ali TI Focal overlap gating in velocity map imaging to achieve high signal-to-noise ratio in photo-ion pump-probe experiments SO APPLIED PHYSICS LETTERS LA English DT Article ID ORDER HARMONIC-GENERATION; MOLECULAR-OXYGEN; PHOTOELECTRON; EXPANSION AB We demonstrate a technique in velocity map imaging (VMI) that allows spatial gating of the laser focal overlap region in time resolved pump-probe experiments. This significantly enhances signal-to-noise ratio by eliminating background signal arising outside the region of spatial overlap of pump and probe beams. This enhancement is achieved by tilting the laser beams with respect to the surface of the VMI electrodes which creates a gradient in flight time for particles born at different points along the beam. By suitably pulsing our microchannel plate detector, we can select particles born only where the laser beams overlap. This spatial gating in velocity map imaging can benefit nearly all photo-ion pump-probe VMI experiments especially when extreme-ultraviolet light or Xrays are involved which produce large background signals on their own. Published by AIP Publishing. C1 [Shivaram, Niranjan; Champenois, Elio G.; Wright, Travis; Wingard, Taylor; Belkacem, Ali] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Champenois, Elio G.] Univ Calif Berkeley, Grad Grp Appl Sci & Technol, Berkeley, CA 94720 USA. [Cryan, James P.] SLAC Natl Accelerator Lab, Stanford PULSE Inst, Menlo Pk, CA 94025 USA. [Wright, Travis] Univ Calif Davis, Dept Chem, Davis, CA 95616 USA. [Wingard, Taylor] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. RP Shivaram, N (reprint author), Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. EM nhshivaram@lbl.gov OI Shivaram, Niranjan/0000-0002-9550-3588 FU U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division [DE-AC02-05CH11231] FX We thank Dr. Daniel Slaughter for helpful comments and suggestions. This work was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division under Contract No. DE-AC02-05CH11231. NR 24 TC 1 Z9 1 U1 4 U2 4 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 19 PY 2016 VL 109 IS 25 AR 254101 DI 10.1063/1.4972343 PG 4 WC Physics, Applied SC Physics GA EH6BK UT WOS:000391857200048 ER PT J AU Sanjeewa, LD McMillen, CD McGuire, MA Kolis, JW AF Sanjeewa, Liurukara D. McMillen, Colin D. McGuire, Michael A. Kolis, Joseph W. TI Manganese Vanadate Chemistry in Hydrothermal BaF2 Brines: Ba3Mn2(V2O7)(2)F-2 and Ba7Mn8O2(VO4)(2)F-23 SO INORGANIC CHEMISTRY LA English DT Article ID TRIGONAL-PRISMATIC COORDINATION; MAGNETIC-PROPERTIES; VANADIUM-OXIDES; COMPLEXES; SPIN; NICKEL(II); LATTICES; LIGAND AB Manganese vanadate fluorides were synthesized using high-temperature hydrothermal techniques with BaF2 as a mineralizer. Ba3Mn2(V2O7)(2)F-2 crystallizes in space group C2/c and consists of dimers built from edge-sharing MnO4F2 trigonal prisms with linking V2O7 groups. Ba7Mn8O2(VO4)(2)F-23 crystallizes in space group Cmmm, with a manganese oxyfluoride network built from edge- and corner-sharing Mn2+/3+(O,F)(6) octahedra. These octahedra form alternating Mn2+ and Mn2/3+ layers separated by VO4 tetrahedra. This latter compound exhibits a canted antiferromagnetic order below T-N = 25 K. C1 [Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W.] Clemson Univ, Dept Chem, Clemson, SC 29634 USA. [Sanjeewa, Liurukara D.; McMillen, Colin D.; Kolis, Joseph W.] Clemson Univ, Ctr Opt Mat Sci & Engn Technol, Clemson, SC 29634 USA. [McGuire, Michael A.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. RP Kolis, JW (reprint author), Clemson Univ, Dept Chem, Clemson, SC 29634 USA.; Kolis, JW (reprint author), Clemson Univ, Ctr Opt Mat Sci & Engn Technol, Clemson, SC 29634 USA. EM kjoseph@clemson.edu RI McGuire, Michael/B-5453-2009 OI McGuire, Michael/0000-0003-1762-9406 FU National Science Foundation [DMR-1410727]; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division FX The authors thank the National Science Foundation (Grant DMR-1410727) for financial support. Magnetic studies (M.A.M.) were supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. NR 32 TC 0 Z9 0 U1 5 U2 5 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 19 PY 2016 VL 55 IS 24 BP 12512 EP 12515 DI 10.1021/acs.inorgchem.6b02355 PG 4 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EF4KQ UT WOS:000390294600008 PM 27989183 ER PT J AU Chen, L Cui, HH Stavretis, SE Hunter, SC Zhang, YQ Chen, XT Sun, YC Wang, ZX Song, Y Podlesnyak, AA Ouyang, ZW Xue, ZL AF Chen, Lei Cui, Hui-Hui Stavretis, Shelby E. Hunter, Seth C. Zhang, Yi-Quan Chen, Xue-Tai Sun, Yi-Chen Wang, Zhenxing Song, You Podlesnyak, Andrey A. Ouyang, Zhong-Wen Xue, Zi-Ling TI Slow Magnetic Relaxations in Cobalt(II) Tetranitrate Complexes. Studies of Magnetic. Anisotropy by Inelastic Neutron Scattering and High-Frequency and High-Field EPR Spectroscopy SO INORGANIC CHEMISTRY LA English DT Article ID SINGLE-MOLECULE MAGNETS; TRANSITION-METAL-COMPLEXES; EASY-PLANE ANISOTROPY; ZERO-FIELD; ION-MAGNET; CO(II) COMPLEXES; ELECTRONIC-STRUCTURE; ENERGY BARRIER; PHOTOCHROMIC BEHAVIOR; MONONUCLEAR FE(III) AB Three mononuclear cobalt(II) tetranitrate complexes (A)2[Co(NO3)(4)] with different countercations, Ph4P+ (1), MePh3P+ (2), and Ph4As+ (3), have been synthesized and studied by X-ray single-crystal diffraction, magnetic measurements, inelastic neutron scattering (INS), high-frequency and high-field EPR (HF-EPR) spectroscopy, and theoretical calculations. The X-ray diffraction studies reveal that the structure of the tetranitrate cobalt anion varies with the countercation. 1 and 2 exhibit highly irregular seven coordinate geometries, while the central Co(II) ion of 3 is in a distorted-dodecahedral configuration. The sole magnetic transition observed in the INS spectroscopy of 1-3 corresponds to the zero-field splitting (2(D-2 + 3E(2))(1/2)) from 22.5(2) cm(-1) in 1 to 26.6(3) cm(-1) in 2 and 11.1(5) cm(-1) in 3. The positive sign of the D value, and hence the easy-plane magnetic anisotropy, was demonstrated for 1 by INS studies under magnetic fields and HF-EPR spectroscopy. The combined analyses of INS and HF-EPR data yield the D values as +10.90(3), +12.74(3), and +4.50(3) cm(-1) for 1-3, respectively. Frequency- and temperature-dependent alternating-current magnetic susceptibility measurements reveal the slow magnetization relaxation in 1 and 2 at an applied dc field of 600 Oe, which is a characteristic of field-induced single-molecule magnets (SMMs). The electronic structures and the origin of magnetic anisotropy of 1-3 were revealed by calculations at the CASPT2/NEVPT2 level. C1 [Chen, Lei; Cui, Hui-Hui; Chen, Xue-Tai; Song, You] Nanjing Univ, State Key Lab Coordinat Chem, Sch Chem & Chem Engn, Collaborat Innovat Ctr Adv Microstruct, Nanjing 210023, Jiangsu, Peoples R China. [Stavretis, Shelby E.; Hunter, Seth C.; Xue, Zi-Ling] Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. [Zhang, Yi-Quan] Nanjing Normal Univ, Sch Phys Sci & Technol, Jiangsu Key Lab NSLSCS, Nanjing 210023, Jiangsu, Peoples R China. [Sun, Yi-Chen; Wang, Zhenxing; Ouyang, Zhong-Wen] Huazhong Univ Sci & Technol, Wuhan Natl High Magnet Field Ctr, Wuhan 430074, Peoples R China. [Podlesnyak, Andrey A.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. RP Chen, XT (reprint author), Nanjing Univ, State Key Lab Coordinat Chem, Sch Chem & Chem Engn, Collaborat Innovat Ctr Adv Microstruct, Nanjing 210023, Jiangsu, Peoples R China.; Xue, ZL (reprint author), Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA.; Zhang, YQ (reprint author), Nanjing Normal Univ, Sch Phys Sci & Technol, Jiangsu Key Lab NSLSCS, Nanjing 210023, Jiangsu, Peoples R China.; Wang, ZX (reprint author), Huazhong Univ Sci & Technol, Wuhan Natl High Magnet Field Ctr, Wuhan 430074, Peoples R China.; Podlesnyak, AA (reprint author), Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. EM zhangyiquan@njnu.edu.cn; xtchen@netra.nju.edu.cn; zxwang@hust.edu.cn; podlesnyakaa@ornl.gov; xue@utk.edu FU National Basic Research Program of China [2013CB922102]; Natural Science Grant of China [21471078]; Natural Science Foundation of Jiangsu Province of China [BK20151542]; U.S. National Science Foundation [CHE-1362548, CHE-1633870]; Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy FX We are grateful for financial support from the National Basic Research Program of China (No. 2013CB922102 to X.-T.C. and Y.S.), the Natural Science Grant of China (No. 21471078 to X.-T.C.), the Natural Science Foundation of Jiangsu Province of China (BK20151542), and the U.S. National Science Foundation (CHE-1362548 and CHE-1633870 to Z.L.X.). Acknowledgment is also made to the donors of the American Chemical Society Petroleum Research Fund for partial support of this research. The research at ORNL's Spallation Neutron Source was sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy. NR 155 TC 0 Z9 0 U1 24 U2 24 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 19 PY 2016 VL 55 IS 24 BP 12603 EP 12617 DI 10.1021/acs.inorgchem.6b01544 PG 15 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EF4KQ UT WOS:000390294600019 PM 27989182 ER PT J AU Gullekson, BJ Breshears, AT Brown, MA Essner, JB Baker, GA Walensky, JR Paulenova, A Gelis, AV AF Gullekson, Brian J. Breshears, Andrew T. Brown, M. Alex Essner, Jeremy B. Baker, Gary A. Walensky, Justin R. Paulenova, Alena Gelis, Artem V. TI Extraction of Water and Speciation of Trivalent Lanthanides and Americium in Organophosphorus Extractants SO INORGANIC CHEMISTRY LA English DT Article ID RAY-ABSORPTION SPECTROSCOPY; LUMINESCENCE SPECTROSCOPY; COORDINATION CHEMISTRY; TALSPEAK SEPARATIONS; ACTINIDE COMPLEXES; ELEMENTS; NEODYMIUM(III); TRANSITIONS; LIQUID; HDEHP AB Complexes of the trivalent lanthanides and Am with di-2-ethylhexylphosphoric acid (HDEHP) dissolved in an aliphatic diluent were probed with UVvis, X-ray absorption fine structure, and time-resolved fluorescence spectroscopy while the water concentration was determined by Karl Fischer titrations. In particular, our work focuses on the Nd-hypersensitive UVvis absorbance region to identify the cause of changing absorbance values at 570 and 583 nm in relation to the pseudooctahedral Nd environment when coordinated with three HDEHP dimers. In contrast to recently reported interpretations, we establish that while impurities have an effect on this electronic transition band, a high water content can cause distortion of the pseudooctahedral symmetry of the six-coordinate Nd, resembling the reported spectra of the seven-coordinate Nd compounds. Extended X-ray absorption fine structure analysis of the Nd in high-concentration HDEHP solutions also points to an increase in the coordination number from 6 to 7. The spectral behavior of other lanthanides (Pr, Ho, Sm, and Er) and Am-III as a function of the HDEHP concentration suggests that water coordination with the metal likely depends on the metals effective charge. Fluorescence data using lifetime studies and excitation and emission spectra support the inclusion of water in the Eu coordination sphere. Further, the role of the effective charge was confirmed by a comparison of the Gibbs free energies of six- and seven-coordinate La-HDEHPH2O and Lu-HDEHPH2O complexes using density functional theory. In contrast, HEH[EHP], the phosphonic acid analogue of HDEHP, exhibits a smaller capacity for water, and the electronic absorption spectra of Nd or Am appear to be unchanged, although the Pr spectra show a noticeable change in intensity as a function of the water content. Electronic absorption extinction coefficients of Am-III, Nd-III, Pr-III, Sm-III, Er-III, and Ho-III as a function of the HDEHP concentration are reported for the first time. C1 [Gullekson, Brian J.; Paulenova, Alena] Oregon State Univ, Sch Nucl Sci & Engn, Corvallis, OR 97331 USA. [Breshears, Andrew T.; Essner, Jeremy B.; Baker, Gary A.; Walensky, Justin R.] Univ Missouri, Dept Chem, Columbia, MO 65211 USA. [Breshears, Andrew T.; Brown, M. Alex; Gelis, Artem V.] Argonne Natl Lab, Nucl Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Gelis, AV (reprint author), Argonne Natl Lab, Nucl Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. EM gelis@anl.gov RI Baker, Gary/H-9444-2016; OI Baker, Gary/0000-0002-3052-7730; Essner, Jeremy/0000-0002-2500-7968 FU U.S. Department of Energy Office of Science laboratory [DE-AC02-06CH11357]; Department of Energy, Office of Nuclear Energy, Sigma Team for Advanced Actinide Recover, and Nuclear Energy University Program [DE-NE0000720]; Office of the Chief Human Capital Officer of the Nuclear Regulatory Commission [NRC-HQ-15-G-0036] FX The submitted manuscript has been created by University of Chicago Argonne, LLC, Operator of Argonne National Laboratory ("Argonne"). Argonne National Laboratory, a U.S. Department of Energy Office of Science laboratory, is operated under Contract DE-AC02-06CH11357. This work was funded by the Department of Energy, Office of Nuclear Energy, Sigma Team for Advanced Actinide Recover, and Nuclear Energy University Program (Award DE-NE0000720). The computation for this work was performed on the high-performance computing infrastructure provided by Research Computing Support Services at the University of Missouri, Columbia, MO. This work was prepared by The Curators of the University of Missouri under Award NRC-HQ-15-G-0036, from the Office of the Chief Human Capital Officer of the Nuclear Regulatory Commission. The authors thank R. J. Kropf (Argonne) for fruitful XAFS discussions. NR 50 TC 0 Z9 0 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 19 PY 2016 VL 55 IS 24 BP 12675 EP 12685 DI 10.1021/acs.inorgchem.6b01756 PG 11 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EF4KQ UT WOS:000390294600027 PM 27989209 ER PT J AU Avila, ML Rehm, KE Almaraz-Calderon, S Ayangeakaa, AD Dickerson, C Hoffman, CR Jiang, CL Kay, BP Lai, J Nusair, O Pardo, RC Santiago-Gonzalez, D Talwar, R Ugalde, C AF Avila, M. L. Rehm, K. E. Almaraz-Calderon, S. Ayangeakaa, A. D. Dickerson, C. Hoffman, C. R. Jiang, C. L. Kay, B. P. Lai, J. Nusair, O. Pardo, R. C. Santiago-Gonzalez, D. Talwar, R. Ugalde, C. TI Experimental study of the astrophysically important Na-23(alpha, p)Mg-26 and Na-23(alpha,n)Al-26 reactions SO PHYSICAL REVIEW C LA English DT Article ID THERMONUCLEAR REACTION-RATES; MASSIVE STARS; AL-26; MG-26(P,N)AL-26; ALPHA AB The Na-23(alpha,p)Mg-26 and Na-23(alpha,n)Al-26 reactions are important for our understanding of the Al-26 abundance in massive stars. The aim of this work is to report on a direct and simultaneous measurement of these astrophysically important reactions using an active target system. The reactions were investigated in inverse kinematics using He-4 as the active target gas in the detector. We measured the excitation functions in the energy range of about 2 to 6 MeV in the center of mass. We have found that the cross sections of the Na-23(alpha,p)Mg-26 and the Na-23(alpha,n)Al-26 reactions are in good agreement with previous experiments and with statistical-model calculations. The astrophysical reaction rate of the Na-23(alpha,n)Al-26 reaction has been reevaluated and it was found to be larger than the recommended rate. C1 [Avila, M. L.; Rehm, K. E.; Ayangeakaa, A. D.; Dickerson, C.; Hoffman, C. R.; Jiang, C. L.; Kay, B. P.; Nusair, O.; Pardo, R. C.; Santiago-Gonzalez, D.; Talwar, R.; Ugalde, C.] Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. [Almaraz-Calderon, S.] Florida State Univ, Dept Phys, Tallahassee, FL 32306 USA. [Lai, J.; Santiago-Gonzalez, D.] Louisiana State Univ, Dept Phys & Astron, Baton Rouge, LA 70803 USA. RP Avila, ML (reprint author), Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. EM mavila@anl.gov FU U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC02-06CH11357]; U.S. Department of Energy, Office of Science, Office of Nuclear Science [DE-FG02-96ER40978] FX The authors are grateful to Dr. P. Mohr for helpful discussions. This material is based upon work supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under Contract No. DE-AC02-06CH11357. The authors J.L. and D.S.G. acknowledge the support by the U.S. Department of Energy, Office of Science, Office of Nuclear Science, under Grant No. DE-FG02-96ER40978. This research used resources of ANL's ATLAS facility, which is DOE Office of Science User Facility. NR 26 TC 0 Z9 0 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 19 PY 2016 VL 94 IS 6 AR 065804 DI 10.1103/PhysRevC.94.065804 PG 5 WC Physics, Nuclear SC Physics GA EF3XM UT WOS:000390258400008 ER PT J AU Bzdak, A Holzmann, R Koch, V AF Bzdak, Adam Holzmann, Romain Koch, Volker TI Multiplicity-dependent and nonbinomial efficiency corrections for particle number cumulants SO PHYSICAL REVIEW C LA English DT Article AB In this article we extend previous work on efficiency corrections for cumulant measurements [Bzdak and Koch, Phys. Rev. C 86, 044904 (2012); 91, 027901 (2015)]. We will discuss the limitations of the methods presented in these papers. Specifically we will consider multiplicity dependent efficiencies as well as nonbinomial efficiency distributions. We will discuss the most simple and straightforward methods to implement those corrections. C1 [Bzdak, Adam] AGH Univ Sci & Technol, Fac Phys & Appl Comp Sci, PL-30059 Krakow, Poland. [Holzmann, Romain] GSI Helmholtzzentrum Schwerionenforsch GmbH, D-64291 Darmstadt, Germany. [Koch, Volker] Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA 94720 USA. RP Bzdak, A (reprint author), AGH Univ Sci & Technol, Fac Phys & Appl Comp Sci, PL-30059 Krakow, Poland. EM bzdak@fis.agh.edu.pl; r.holzmann@gsi.de; vkoch@lbl.gov FU Ministry of Science and Higher Education (MNiSW); Foundation for Polish Science; National Science Centre (Narodowe Centrum Nauki) [DEC-2014/15/B/ST2/00175, DEC-2013/09/B/ST2/00497]; Office of Nuclear Physics in the US Department of Energy's Office of Science [DE-AC02-05CH11231] FX We thank A. Kalweit and J. Thaeder for useful discussions. We also thank the HIC for FAIR and ExtreMe Matter Institute (EMMI) for support to attend two workshops where this work was initiated. A.B. was supported by the Ministry of Science and Higher Education (MNiSW), by funding from the Foundation for Polish Science, and by the National Science Centre (Narodowe Centrum Nauki), Grant No. DEC-2014/15/B/ST2/00175, and in part by DEC-2013/09/B/ST2/00497. V.K. was supported by the Office of Nuclear Physics in the US Department of Energy's Office of Science under Contract No. DE-AC02-05CH11231. NR 17 TC 0 Z9 0 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 19 PY 2016 VL 94 IS 6 AR 064907 DI 10.1103/PhysRevC.94.064907 PG 8 WC Physics, Nuclear SC Physics GA EF3XM UT WOS:000390258400006 ER PT J AU Mumpower, MR Kawano, T Moller, P AF Mumpower, M. R. Kawano, T. Moller, P. TI Neutron-gamma competition for beta-delayed neutron emission SO PHYSICAL REVIEW C LA English DT Article ID DECAY HALF-LIVES; STRENGTH FUNCTIONS; NUCLEAR PROPERTIES; MODEL; FORMULA; REGION; TALYS AB We present a coupled quasiparticle random phase approximation and Hauser-Feshbach (QRPA+HF) model for calculating delayed particle emission. This approach uses microscopic nuclear structure information, which starts with Gamow-Teller strength distributions in the daughter nucleus and then follows the statistical decay until the initial available excitation energy is exhausted. Explicitly included at each particle emission stage is gamma-ray competition. We explore this model in the context of neutron emission of neutron-rich nuclei and find that neutron gamma competition can lead to both increases and decreases in neutron emission probabilities, depending on the system considered. A second consequence of this formalism is a prediction of more neutrons on average being emitted after beta decay for nuclei near the neutron drip line compared to models that do not consider the statistical decay. C1 [Mumpower, M. R.; Kawano, T.; Moller, P.] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Mumpower, MR (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. EM mumpower@lanl.gov FU National Nuclear Security Administration of the US Department of Energy at Los Alamos National Laboratory [DE-AC52-06NA25396] FX We thank Iris Dillmann for helpful discussions and her student, Stephine Ciccone, for providing a database of recent Pjn measurements. We thank Scott Marley for helpful discussions regarding current experimental techniques. This work was carried out under the auspices of the National Nuclear Security Administration of the US Department of Energy at Los Alamos National Laboratory under Contract No. DE-AC52-06NA25396. This manuscript is available through the Los Alamos Unclassified Reports system via LA-UR-16-25845. NR 35 TC 1 Z9 1 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 19 PY 2016 VL 94 IS 6 AR 064317 DI 10.1103/PhysRevC.94.064317 PG 8 WC Physics, Nuclear SC Physics GA EF3XM UT WOS:000390258400001 ER PT J AU Li, C Li, T Cai, XX Sun, XS AF Li, Cong Li, Tao Cai, Xiaoxia Sun, Xiuzhi Susan TI Substantially reinforcing plant oil-based materials via cycloaliphatic epoxy with double bond-bridged structure SO POLYMER LA English DT Article DE Plant oil; Reinforcement; Double bond ID PHOTOINITIATED CATIONIC-POLYMERIZATION; RING-CLOSING METATHESIS; OLEFIN METATHESIS; ADMET POLYMERIZATION; CROSS-METATHESIS; COVALENT RADII; POLYURETHANE; EPOXIDES; CATALYST; LIGANDS AB A diepoxide ((E)-1,2-di(7- oxabicyclo [ 4.1.0]heptan-3-yl)ethane, named DCE), possessing two cyclohexane rings bridged by a double bond was obtained via self-metathesis approach. This unique epoxy structure shows great potential in substantially overcoming the poor performances of plant oil materials in thermal and mechanical aspects. The molecular structure of DCE is more compact and regular than the commercial 3,4-epoxycyclohexylmethyl-3,4-epoxycyclohexanecarboxylate (ECHM) and was evidenced by the small-/wide-angle X-ray scattering. After conetwork was built between epoxidized soybean oil (ESO) and DCE, stiff crosslinks were created through the double bonds of DCE, which restricts the backbone rotation of ESO (P-ESO) networks. DCE-rich domains with dimensions ranging from 0.5 to 2 mu m were observed with the increase of DCE, revealed by atomic force microscopy (AFM) phase image and voltage-distance curve. These DCE-rich domains act as micro-scale reinforcements homogenously dispersed in the ESO matrix, effectively sustaining the applied stress and preventing the chain break from high force loading. Compared to P-ESO, the co-polymerized ESO-DCE at 30 wt % DCE loading showed tensile strength of 62 MPa and glass transition temperature of 163 degrees C that are much higher than 4 MPa and 10 degrees C for P-ESO, respectively. ECHM also showed significant reinforcement effects on the thermal and mechanical properties of ESO, but DCE's reinforcement effects is doubled compared to ECHM. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Li, Cong; Cai, Xiaoxia; Sun, Xiuzhi Susan] Kansas State Univ, Dept Grain Sci & Ind, Biomat & Technol Lab, BIVAP Innovat Ctr, 1980 Kimball Ave, Manhattan, KS 66506 USA. [Sun, Xiuzhi Susan] Kansas State Univ, Dept Biol & Agr Engn, Manhattan, KS 66506 USA. [Li, Tao] Argonne Natl Lab, Adv Photon Source, Xray Sci Div, 9700 South Cass Ave, Argonne, IL 60439 USA. RP Sun, XS (reprint author), Kansas State Univ, Dept Grain Sci & Ind, Biomat & Technol Lab, BIVAP Innovat Ctr, 1980 Kimball Ave, Manhattan, KS 66506 USA. EM xss@ksu.edu FU USDA-NIFA Biomass Research and Development Initiative program [2012-10006-20230]; DOE Office of Science by Argonne National Laboratory [2012-10006-20230, DE-AC02-06CH11357] FX This is the contribution No. 16-290-J from the Kansas Agricultural Experimental Station. Financial support was provided by the USDA-NIFA Biomass Research and Development Initiative program (Grant No. 2012-10006-20230). The SAXS/WAXS experiments used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357 (Grant No. 2012-10006-20230). NR 34 TC 0 Z9 0 U1 11 U2 11 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0032-3861 EI 1873-2291 J9 POLYMER JI Polymer PD DEC 19 PY 2016 VL 107 BP 19 EP 28 DI 10.1016/j.polymer.2016.10.014 PG 10 WC Polymer Science SC Polymer Science GA EE7AF UT WOS:000389765500003 ER PT J AU Bobbitt, JM Mendivelso-Perez, D Smith, EA AF Bobbitt, Jonathan M. Mendivelso-Perez, Deyny Smith, Emily A. TI Scanning angle Raman spectroscopy: A nondestructive method for simultaneously determining mixed polymer fractional composition and film thickness SO POLYMER LA English DT Article DE Vibrational spectroscopy; Thin polymer films; Mixed polymer fractional composition ID BIOMEDICAL APPLICATIONS; BLEND; CRYSTALLIZATION; PHOTOVOLTAICS; FABRICATION; RESOLUTION AB A scanning angle (SA) Raman spectroscopy method was developed to simultaneously measure the chemical composition and thickness of waveguide mixed polymer films with varying fractional compositions. In order to test the method, six films of polystyrene-block-poly(methyl methacrylate), some mixed with poly(methyl methacrylate) homopolymer (PS-b-PMMA: PMMA), and two films of poly(2-vinylnapthalene)-block-poly(methyl methacrylate) (P2VN-b-PMMA) were prepared. The film thickness ranged from 495 to 971 nm. The chemical composition and thickness of PS-b-PMMA: PMMA films was varied by the addition of the PMMA homopolymer and annealing the films in acetone. SA Raman peak amplitude ratios (1001 cm(-1) for PS, 812 cm(-1) for PMMA, and 1388 cm(-1) for P2VN) were used to calculate the refractive index of the polymer film, an input parameter in calculations of the sum square electric field (SSEF). The film thickness was determined by SSEF models of the experimental Raman amplitudes versus the incident angle of light. The average film thickness determined by the developed SA Raman spectroscopy method was within 5% of the value determined by optical profilometry. SA Raman spectroscopy will be useful for in situ label-free analyses of mixed polymer waveguide films. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Smith, Emily A.] US DOE, Ames Lab, Ames, IA 50011 USA. Iowa State Univ, Dept Chem, Ames, IA 50011 USA. RP Smith, EA (reprint author), US DOE, Ames Lab, Ames, IA 50011 USA. EM esmith1@iastale.edu FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division; U.S. DOE by Iowa State University [DE-AC02-07CH11358] FX This research was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division. The research was performed at the Ames Laboratory, which is operated for the U.S. DOE by Iowa State University under contract # DE-AC02-07CH11358. NR 36 TC 0 Z9 0 U1 4 U2 4 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0032-3861 EI 1873-2291 J9 POLYMER JI Polymer PD DEC 19 PY 2016 VL 107 BP 82 EP 88 DI 10.1016/j.polymer.2016.10.063 PG 7 WC Polymer Science SC Polymer Science GA EE7AF UT WOS:000389765500010 ER PT J AU Oded, M Kelly, ST Gilles, MK Muller, AHE Shenhar, R AF Oded, Meirav Kelly, Stephen T. Gilles, Mary K. Mueller, Axel H. E. Shenhar, Roy TI From dots to doughnuts: Two-dimensionally confined deposition of polyelectrolytes on block copolymer templates SO POLYMER LA English DT Article DE Block copolymers; Layer-by-layer deposition; Patterning; Polyelectrolytes; Self-assembly ID LAYER-BY-LAYER; CATIONIC BIPOLAR AMPHIPHILES; ULTRATHIN MULTILAYER FILMS; SELF-ASSEMBLY PROCESS; X-RAY MICROSCOPY; THIN-FILMS; CONSECUTIVE ADSORPTION; SELECTIVE DEPOSITION; NANOPARTICLE ARRAYS; CHARGED SURFACES AB The combination of block copolymer templating with electrostatic self-assembly provides a simple and robust method for creating nano-patterned polyelectrolyte multilayers over large areas. The deposition of the first polyelectrolyte layer provides important insights on the initial stages of multilayer buildup. Here, we focus on two-dimensionally confined "dots" patterns afforded by block copolymer films featuring hexagonally-packed cylinders that are oriented normal to the substrate. Rendering the cylinder caps positively charged enables the selective deposition of negatively charged polyelectrolytes on them under salt-free conditions. The initially formed polyelectrolyte nanostructures adopt a toroidal ("doughnut") shape, which results from retraction of dangling polyelectrolyte segments into the "dots" upon drying. With increasing exposure time to the polyelectrolyte solution, the final shape of the deposited polyelectrolyte transitions from a doughnut to a hemisphere. These insights would enable the creation of patterned polyelectrolyte multilayers with increased control over adsorption selectivity of the additional incoming polyelectrolytes. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Oded, Meirav; Shenhar, Roy] Hebrew Univ Jerusalem, Inst Chem, IL-9190401 Jerusalem, Israel. [Oded, Meirav; Shenhar, Roy] Hebrew Univ Jerusalem, Ctr Nanosci & Nanotechnol, IL-9190401 Jerusalem, Israel. [Kelly, Stephen T.; Gilles, Mary K.] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Mueller, Axel H. E.] Johannes Gutenberg Univ Mainz, Inst Organ Chem, D-55099 Mainz, Germany. [Kelly, Stephen T.] Carl Zeiss Xray Microscopy Inc, Pleasanton, CA 94588 USA. RP Shenhar, R (reprint author), Hebrew Univ Jerusalem, Inst Chem, IL-9190401 Jerusalem, Israel.; Shenhar, R (reprint author), Hebrew Univ Jerusalem, Ctr Nanosci & Nanotechnol, IL-9190401 Jerusalem, Israel. EM roys@huji.ac.il FU Harry and Sylvia Hoffman Leadership and Responsibility Program; Dalia and Dan Maydan Fellowship; U.S. Department of Energy [DE-AC02-05CH11231]; Condensed Phase and Interfacial Molecular Sciences Program of U.S. Department of Energy FX M.O. thanks the Harry and Sylvia Hoffman Leadership and Responsibility Program, and the Dalia and Dan Maydan Fellowship for financial support. The Advanced Light Source (ALS) at Lawrence Berkeley National Laboratory (LBNL) is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. M.K.G., S.T.K and Beamline 11.0.2 were supported by the same contract as well as the Condensed Phase and Interfacial Molecular Sciences Program of the U.S. Department of Energy. The authors thank Dr. Vitaly Gutkin for assistance with the XPS measurements. NR 63 TC 0 Z9 0 U1 7 U2 7 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0032-3861 EI 1873-2291 J9 POLYMER JI Polymer PD DEC 19 PY 2016 VL 107 BP 406 EP 414 DI 10.1016/j.polymer.2016.07.016 PG 9 WC Polymer Science SC Polymer Science GA EE7AF UT WOS:000389765500044 ER PT J AU Hoffman, MJ Andrews, LC Price, SA Catania, GA Neumann, TA Luthi, MP Gulley, J Ryser, C Hawley, RL Morriss, B AF Hoffman, Matthew J. Andrews, Lauren C. Price, Stephen A. Catania, Ginny A. Neumann, Thomas A. Luthi, Martin P. Gulley, Jason Ryser, Claudia Hawley, Robert L. Morriss, Blaine TI Greenland subglacial drainage evolution regulated by weakly connected regions of the bed SO NATURE COMMUNICATIONS LA English DT Article ID SUPRAGLACIAL LAKE DRAINAGE; HAUT GLACIER DAROLLA; ICE-SHEET; WATER-PRESSURE; SURFACE MELT; SOUTHWEST GREENLAND; SEASONAL-CHANGES; WEST GREENLAND; SYSTEM; VELOCITY AB Penetration of surface meltwater to the bed of the Greenland Ice Sheet each summer causes an initial increase in ice speed due to elevated basal water pressure, followed by slowdown in late summer that continues into fall and winter. While this seasonal pattern is commonly explained by an evolution of the subglacial drainage system from an inefficient distributed to efficient channelized configuration, mounting evidence indicates that subglacial channels are unable to explain important aspects of hydrodynamic coupling in late summer and fall. Here we use numerical models of subglacial drainage and ice flow to show that limited, gradual leakage of water and lowering of water pressure in weakly connected regions of the bed can explain the dominant features in late and post melt season ice dynamics. These results suggest that a third weakly connected drainage component should be included in the conceptual model of subglacial hydrology. C1 [Hoffman, Matthew J.; Price, Stephen A.] Los Alamos Natl Lab, Fluid Dynam & Solid Mech Grp, Los Alamos, NM 87545 USA. [Andrews, Lauren C.; Neumann, Thomas A.] NASA, Goddard Space Flight Ctr, Cryospher Sci Lab, Greenbelt, MD 20771 USA. [Catania, Ginny A.] Univ Texas Austin, Jackson Sch Geosci, Inst Geophys, Austin, TX 78758 USA. [Catania, Ginny A.] Univ Texas Austin, Dept Geol Sci, Jackson Sch Geosci, Austin, TX 78758 USA. [Luthi, Martin P.] Univ Zurich, Glaciol & Geomorphodynam Grp, Dept Geog, CH-8057 Zurich, Switzerland. [Gulley, Jason] Univ S Florida, Sch Geosci, Tampa, FL 33620 USA. [Ryser, Claudia] Swiss Fed Inst Technol, Lab Hydraul Hydrol & Glaciol, CH-8093 Zurich, Switzerland. [Hawley, Robert L.] Dartmouth Coll, Dept Earth Sci, Hanover, NH 03755 USA. [Morriss, Blaine] Cold Reg Res & Engn Lab, Hanover, NH 03755 USA. RP Hoffman, MJ (reprint author), Los Alamos Natl Lab, Fluid Dynam & Solid Mech Grp, Los Alamos, NM 87545 USA. EM mhoffman@lanl.gov RI Neumann, Thomas/D-5264-2012; Catania, Ginny/B-9787-2008; Andrews, Lauren/D-8274-2017 OI Andrews, Lauren/0000-0003-3727-4737 FU Laboratory Directed Research and Development Early Career Research Program (LDRD-ECR) at Los Alamos National Laboratory, Climate Modeling Programs within the U.S. Department of Energy Office of Science; National Science Foundation [ANT-0424589]; National Science Foundation Division of Earth Sciences (EAR) Postdoctoral Fellowship [0946767]; United States National Science Foundation [OPP-0908156, OPP-0909454]; Swiss National Science Foundation [200021_127197]; National Geographic Society [9067-12]; NASA Cryospheric Sciences FX This work was supported by a grant to M.J.H. from the Laboratory Directed Research and Development Early Career Research Program (LDRD-ECR) at Los Alamos National Laboratory, Climate Modeling Programs within the U.S. Department of Energy Office of Science, and by the National Science Foundation, under grant ANT-0424589 to the Center for Remote Sensing of Ice Sheets (CReSIS). L.C.A. was supported by an appointment to the NASA Postdoctoral Program at the Goddard Space Flight Center, administered by Universities Space Research Association under contract with NASA, and UTIG Ewing-Worzel and Gale White Graduate Student Fellowships. J.G. was supported by National Science Foundation Division of Earth Sciences (EAR) Postdoctoral Fellowship (No. 0946767). Fieldwork resulting in the presented observations was supported by United States National Science Foundation grants OPP-0908156 and OPP-0909454, Swiss National Science Foundation grant 200021_127197, National Geographic Society grant 9067-12 and NASA Cryospheric Sciences. NR 65 TC 1 Z9 1 U1 20 U2 20 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 19 PY 2016 VL 7 AR 13903 DI 10.1038/ncomms13903 PG 11 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE8NJ UT WOS:000389882400001 PM 27991518 ER PT J AU Kumar, MA Beyerlein, IJ McCabe, RJ Tome, CN AF Kumar, M. Arul Beyerlein, I. J. McCabe, R. J. Tome, C. N. TI Grain neighbour effects on twin transmission in hexagonal close-packed materials SO NATURE COMMUNICATIONS LA English DT Article ID AZ31 MAGNESIUM ALLOY; STRUCTURAL INTERPRETATION; COMPATIBILITY FACTOR; DEFORMATION TWINS; NUCLEATION; HCP; GROWTH; ZR; BOUNDARIES; MORPHOLOGY AB Materials with a hexagonal close-packed (hcp) crystal structure such as Mg, Ti and Zr are being used in the transportation, aerospace and nuclear industry, respectively. Material strength and formability are critical qualities for shaping these materials into parts and a pervasive deformation mechanism that significantly affects their formability is deformation twinning. The interaction between grain boundaries and twins has an important influence on the deformation behaviour and fracture of hcp metals. Here, statistical analysis of large data sets reveals that whether twins transmit across grain boundaries depends not only on crystallography but also strongly on the anisotropy in crystallographic slip. We show that increases in crystal plastic anisotropy enhance the probability of twin transmission by comparing the relative ease of twin transmission in hcp materials such as Mg, Zr and Ti. C1 [Kumar, M. Arul; McCabe, R. J.; Tome, C. N.] Los Alamos Natl Lab, Mat Sci & Technol Div, Los Alamos, NM 87545 USA. [Beyerlein, I. J.] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Kumar, MA (reprint author), Los Alamos Natl Lab, Mat Sci & Technol Div, Los Alamos, NM 87545 USA. EM marulkr@lanl.gov FU U.S. Department of Energy, Office of Basic Energy Sciences [FWP 06SCPE401] FX The authors are grateful to Dr Ricardo Lebensohn for making available the FFT-EVPSC code used here for the simulations. This work is fully funded by the U.S. Department of Energy, Office of Basic Energy Sciences Project FWP 06SCPE401. NR 39 TC 0 Z9 0 U1 12 U2 12 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 19 PY 2016 VL 7 AR 13826 DI 10.1038/ncomms13826 PG 9 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE8MT UT WOS:000389880700001 ER PT J AU Song, Y Yamani, Z Cao, CD Li, Y Zhang, CL Chen, JS Huang, QZ Wu, H Tao, J Zhu, YM Tian, W Chi, SX Cao, HB Huang, YB Dantz, M Schmitt, T Yu, R Nevidomskyy, AH Morosan, E Si, QM Dai, PC AF Song, Yu Yamani, Zahra Cao, Chongde Li, Yu Zhang, Chenglin Chen, Justin S. Huang, Qingzhen Wu, Hui Tao, Jing Zhu, Yimei Tian, Wei Chi, Songxue Cao, Huibo Huang, Yao-Bo Dantz, Marcus Schmitt, Thorsten Yu, Rong Nevidomskyy, Andriy H. Morosan, Emilia Si, Qimiao Dai, Pengcheng TI A Mott insulator continuously connected to iron pnictide superconductors SO NATURE COMMUNICATIONS LA English DT Article ID HIGH-TEMPERATURE SUPERCONDUCTIVITY; ANTIFERROMAGNETIC INSULATOR; CHALCOGENIDES; ORDER AB Iron-based superconductivity develops near an antiferromagnetic order and out of a bad-metal normal state, which has been interpreted as originating from a proximate Mott transition. Whether an actual Mott insulator can be realized in the phase diagram of the iron pnictides remains an open question. Here we use transport, transmission electron microscopy, X-ray absorption spectroscopy, resonant inelastic X-ray scattering and neutron scattering to demonstrate that NaFe1-xCuxAs near x approximate to 0.5 exhibits real space Fe and Cu ordering, and are antiferromagnetic insulators with the insulating behaviour persisting above the Ne ' el temperature, indicative of a Mott insulator. On decreasing x from 0.5, the antiferromagnetic- ordered moment continuously decreases, yielding to superconductivity similar to x = 0.05. Our discovery of a Mott-insulating state in NaFe1-xCuxAs thus makes it the only known Fe-based material, in which superconductivity can be smoothly connected to the Mott-insulating state, highlighting the important role of electron correlations in the high-T-c superconductivity. C1 [Song, Yu; Cao, Chongde; Li, Yu; Zhang, Chenglin; Chen, Justin S.; Nevidomskyy, Andriy H.; Morosan, Emilia; Si, Qimiao; Dai, Pengcheng] Rice Univ, Dept Phys & Astron, Houston, TX 77005 USA. [Yamani, Zahra] Chalk River Labs, Canadian Neutron Beam Ctr, Chalk River, ON K0J 1J0, Canada. [Cao, Chongde] Northwestern Polytech Univ, Dept Appl Phys, Xian 710072, Peoples R China. [Huang, Qingzhen; Wu, Hui] NIST, Ctr Neutron Res, Gaithersburg, MD 20899 USA. [Wu, Hui] Univ Maryland, Dept Mat Sci & Engn, College Pk, MD 20742 USA. [Tao, Jing; Zhu, Yimei] Brookhaven Natl Natl Lab, Dept Condensed Matter Phys & Mat Sci, Upton, NY 11973 USA. [Tian, Wei; Chi, Songxue; Cao, Huibo] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Huang, Yao-Bo; Dantz, Marcus; Schmitt, Thorsten] Paul Scherrer Inst, Swiss Light Source, CH-5232 Villigen, Switzerland. [Huang, Yao-Bo] Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Beijing 100190, Peoples R China. [Huang, Yao-Bo] Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China. [Yu, Rong] Renmin Univ China, Dept Phys, Beijing 100872, Peoples R China. [Yu, Rong] Renmin Univ China, Beijing Key Lab Optoelect Funct Mat & Micronano D, Beijing 100872, Peoples R China. [Yu, Rong] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. [Yu, Rong] Collaborat Innovat Ctr Adv Microstruct, Nanjing 210093, Jiangsu, Peoples R China. RP Si, QM; Dai, PC (reprint author), Rice Univ, Dept Phys & Astron, Houston, TX 77005 USA. EM qmsi@rice.edu; pdai@rice.edu RI Dai, Pengcheng /C-9171-2012; Wu, Hui/C-6505-2008; Schmitt, Thorsten/A-7025-2010 OI Dai, Pengcheng /0000-0002-6088-3170; Wu, Hui/0000-0003-0296-5204; FU U.S. DOE, BES [DE-SC0012311]; Robert A. Welch Foundation [C-1839, C-1818, C-1411]; U.S. NSF [DMR-1350237, DMR-1611392]; Alexander von Humboldt Foundation; DOD PECASE; U.S. DOE, BES; Materials Sciences and Engineering Division [DE-AC02-98CH10886]; Scientific User Facilities Division, Office of BES, U.S. DOE; Swiss National Science Foundation within the D-A-CH programme (SNSF Research) [200021L 141325]; National Science Foundation of China [11374361]; Fundamental Research Funds for the Central Universities; Research Funds of Remnin University of China [14XNLF08]; National Natural Science Foundation of China [51471135]; National Key Research and Development Program of China [2016YFB1100101]; Shaanxi International Cooperation Program FX We thank X.H. Chen, B.J. Campbell and Lijun Wu for helpful discussions, Leland Harriger, Scott Carr, Weiyi Wang and Binod K. Rai for assisting with some experiments. The singlecrystal growth and neutron scattering work at Rice is supported by the U.S. DOE, BES under contract no. DE-SC0012311 (P.D.). A part of the material synthesis work at Rice is supported by the Robert A. Welch Foundation Grant No. C-1839 (P.D.). The theoretical work at Rice was in part supported by the Robert A. Welch Foundation Grant No. C-1818 (A.H.N.), C-1411 (Q.S), by U.S. NSF grants DMR-1350237 (A.H.N.) and DMR-1611392 (Q.S.), and by the Alexander von Humboldt Foundation (Q.S.). E.M. and J.C. acknowledge support from the DOD PECASE. The electron microscopy study at Brookhaven National Laboratory was supported by the U.S. DOE, BES, by the Materials Sciences and Engineering Division under Contract No. DE-AC02-98CH10886. The use of ORNL's High Flux Isotope Reactor was sponsored by the Scientific User Facilities Division, Office of BES, U.S. DOE. XAS and RIXS experiments have been performed at the Advanced Resonant Spectroscopy beamline of the Swiss Light Source at the Paul Scherrer Institute. T.S and M.D. acknowledge funding through the Swiss National Science Foundation within the D-A-CH programme (SNSF Research Grant 200021L 141325). R.Y. acknowledges the support from the National Science Foundation of China Grant number 11374361, and the Fundamental Research Funds for the Central Universities and the Research Funds of Remnin University of China Grant number 14XNLF08. C.C. acknowledges the support from the National Natural Science Foundation of China Grant No. 51471135, the National Key Research and Development Program of China Grant No. 2016YFB1100101 and Shaanxi International Cooperation Program. NR 50 TC 0 Z9 0 U1 20 U2 20 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 19 PY 2016 VL 7 AR 13879 DI 10.1038/ncomms13879 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE8NG UT WOS:000389882100001 PM 27991514 ER PT J AU Godinez, HC Yu, Y Lawrence, E Henderson, MG Larsen, B Jordanova, VK AF Godinez, H. C. Yu, Y. Lawrence, E. Henderson, M. G. Larsen, B. Jordanova, V. K. TI Ring current pressure estimation with RAM-SCB using data assimilation and Van Allen Probe flux data SO GEOPHYSICAL RESEARCH LETTERS LA English DT Article DE ring current; data assimilation; Van Allen Probes ID ENSEMBLE KALMAN FILTER; BELT DATA ASSIMILATION; MODEL; STORM; CODE; PROTON AB Capturing and subsequently modeling the influence of tail plasma injections on the inner magnetosphere is important for understanding the formation and evolution of the ring current. In this study, the ring current distribution is estimated with the Ring Current-Atmosphere Interactions Model with Self-Consistent Magnetic field (RAM-SCB) using, for the first time, data assimilation techniques and particle flux data from the Van Allen Probes. The state of the ring current within the RAM-SCB model is corrected via an ensemble based data assimilation technique by using proton flux from one of the Van Allen Probes, to capture the enhancement of the ring current following an isolated substorm event on 18 July 2013. The results show significant improvement in the estimation of the ring current particle distributions in the RAM-SCB model, leading to better agreement with observations. This newly implemented data assimilation technique in the global modeling of the ring current thus provides a promising tool to improve the characterization of particle distribution in the near-Earth regions. C1 [Godinez, H. C.; Yu, Y.; Lawrence, E.; Henderson, M. G.; Larsen, B.; Jordanova, V. K.] Los Alamos Natl Lab, Los Alamos, NM 87544 USA. [Yu, Y.] Beihang Univ, Sch Space & Environm, Beijing, Peoples R China. RP Yu, Y (reprint author), Los Alamos Natl Lab, Los Alamos, NM 87544 USA.; Yu, Y (reprint author), Beihang Univ, Sch Space & Environm, Beijing, Peoples R China. EM yiqunyu17@gmail.com RI Yu, Yiqun/E-2710-2012; Henderson, Michael/A-3948-2011; OI Yu, Yiqun/0000-0002-1013-6505; Henderson, Michael/0000-0003-4975-9029; Jordanova, Vania/0000-0003-0475-8743 FU Laboratory Directed Research and Development program within Los Alamos National Laboratory; JHU/APL under NASA [967399, NAS5-01072]; [NSFC-41574156] FX This research was conducted as part of the Space Hazards Induced near Earth by Large, Dynamic Storms (SHIELDS) project, funded by the Laboratory Directed Research and Development program within Los Alamos National Laboratory. We also acknowledge partial support by JHU/APL contract 967399 under NASA's prime contract NAS5-01072. Yu is supported by NSFC-41574156 while at Beihang University. We thank the RBSP-ECT team for providing Van Allen Probes data used in this study (http://www.rbsp-ect.lanl.gov). We also thank OMNIWeb from NASA Goddard Space Flight Center for providing the solar wind observation data and geomagnetic indices. Numerical data are available from the lead author upon request. NR 36 TC 1 Z9 1 U1 1 U2 1 PU AMER GEOPHYSICAL UNION PI WASHINGTON PA 2000 FLORIDA AVE NW, WASHINGTON, DC 20009 USA SN 0094-8276 EI 1944-8007 J9 GEOPHYS RES LETT JI Geophys. Res. Lett. PD DEC 16 PY 2016 VL 43 IS 23 BP 11948 EP 11956 DI 10.1002/2016GL071646 PG 9 WC Geosciences, Multidisciplinary SC Geology GA EI5DU UT WOS:000392515000006 ER PT J AU Mills, CM Cassano, JJ Cassano, EN AF Mills, Catrin M. Cassano, John J. Cassano, Elizabeth N. TI Midlatitude atmospheric responses to Arctic sensible heat flux anomalies in Community Climate Model, Version 4 SO GEOPHYSICAL RESEARCH LETTERS LA English DT Article DE sensible heat flux; self-organizing maps; SOMs; Arctic climate; midlatitudes ID SEA-ICE LOSS; AMPLIFICATION; IMPACTS; WEATHER AB Possible linkages between Arctic sea ice loss and midlatitude weather are strongly debated in the literature. We analyze a coupled model simulation to assess the possibility of Arctic ice variability forcing a midlatitude response, ensuring consistency between atmosphere, ocean, and ice components. We work with weekly running mean daily sensible heat fluxes with the self-organizing map technique to identify Arctic sensible heat flux anomaly patterns and the associated atmospheric response, without the need of metrics to define the Arctic forcing or measure the midlatitude response. We find that low-level warm anomalies during autumn can build planetary wave patterns that propagate downstream into the midlatitudes, creating robust surface cold anomalies in the eastern United States. C1 [Mills, Catrin M.] Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. [Mills, Catrin M.; Cassano, John J.; Cassano, Elizabeth N.] Univ Colorado, Cooperat Inst Res Environm Sci, Boulder, CO 80309 USA. [Cassano, John J.] Univ Colorado, Dept Atmospher & Ocean Sci, Boulder, CO 80309 USA. RP Mills, CM (reprint author), Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. EM catrin.mills@pnnl.gov OI CASSANO, JOHN/0000-0003-3176-3978 FU NASA [NNX14AH89G]; University of Colorado Cooperative Institute for Research in Environmental Sciences (CIRES) Visiting Fellows program; DOE, Office of Science, Biological and Environmental Research as part of the Regional and Global Climate Modeling program; DOE by Battelle Memorial Institute [DE-AC05-76RLO1830] FX This work was supported in part by NASA grant NNX14AH89G and the University of Colorado Cooperative Institute for Research in Environmental Sciences (CIRES) Visiting Fellows program. C. Mills also acknowledges support from the DOE, Office of Science, Biological and Environmental Research as part of the Regional and Global Climate Modeling program. The Pacific Northwest National Laboratory (PNNL) is operated for DOE by Battelle Memorial Institute under contract DE-AC05-76RLO1830. The NCAR CCSM4 model output used for the analysis is available at http://www.cesm.ucar.edu/experiments/cesm1.0/. We thank the two anonymous reviewers for their time and useful comments that helped improve this manuscript. NR 33 TC 1 Z9 1 U1 4 U2 4 PU AMER GEOPHYSICAL UNION PI WASHINGTON PA 2000 FLORIDA AVE NW, WASHINGTON, DC 20009 USA SN 0094-8276 EI 1944-8007 J9 GEOPHYS RES LETT JI Geophys. Res. Lett. PD DEC 16 PY 2016 VL 43 IS 23 BP 12270 EP 12277 DI 10.1002/2016GL071356 PG 8 WC Geosciences, Multidisciplinary SC Geology GA EI5DU UT WOS:000392515000028 ER PT J AU Kayode, O Wang, RY Pendlebury, DF Cohen, I Henin, RD Hockla, A Soares, AS Papo, N Caulfield, TR Radisky, ES AF Kayode, Olumide Wang, Ruiying Pendlebury, Devon F. Cohen, Itay Henin, Rachel D. Hockla, Alexandra Soares, Alexei S. Papo, Niv Caulfield, Thomas R. Radisky, Evette S. TI An Acrobatic Substrate Metamorphosis Reveals a Requirement for Substrate Conformational Dynamics in Trypsin Proteolysis SO JOURNAL OF BIOLOGICAL CHEMISTRY LA English DT Article ID STEERED MOLECULAR-DYNAMICS; SERINE-PROTEASE MECHANISM; PEPTIDE-BOND; REPLICA-EXCHANGE; LIMITED PROTEOLYSIS; HUMAN MESOTRYPSIN; ENERGY LANDSCAPE; CATIONIC TRYPSIN; ENZYME CATALYSIS; INHIBITOR AB The molecular basis of enzyme catalytic power and specificity derives from dynamic interactions between enzyme and substrate during catalysis. Although considerable effort has been devoted to understanding how conformational dynamics within enzymes affect catalysis, the role of conformational dynamics within protein substrates has not been addressed. Here, we examine the importance of substrate dynamics in the cleavage of Kunitz-bovine pancreatic trypsin inhibitor protease inhibitors by mesotrypsin, finding that the varied conformational dynamics of structurally similar substrates can profoundly impact the rate of catalysis. A 1.4-angstrom crystal structure of a mesotrypsin-product complex formed with a rapidly cleaved substrate reveals a dramatic conformational change in the substrate upon proteolysis. By using long all-atom molecular dynamics simulations of acyl-enzyme intermediates with proteolysis rates spanning 3 orders of magnitude, we identify global and local dynamic features of substrates on the nanosecond-microsecond time scale that correlate with enzymatic rates and explain differential susceptibility to proteolysis. By integrating multiple enhanced sampling methods for molecular dynamics, we model a viable conformational pathway between substrate-like and product-like states, linking substrate dynamics on the nanosecond-microsecond time scale with large collective substrate motions on the much slower time scale of catalysis. Our findings implicate substrate flexibility as a critical determinant of catalysis. C1 [Kayode, Olumide; Wang, Ruiying; Pendlebury, Devon F.; Henin, Rachel D.; Hockla, Alexandra; Radisky, Evette S.] Mayo Clin, Coll Med, Dept Canc Biol, Jacksonville, FL 32224 USA. [Caulfield, Thomas R.] Mayo Clin, Coll Med, Dept Neurosci, Jacksonville, FL 32224 USA. [Cohen, Itay; Papo, Niv] Ben Gurion Univ Negev, Dept Biotechnol Engn, IL-84105 Beer Sheva, Israel. [Cohen, Itay; Papo, Niv] Ben Gurion Univ Negev, Natl Inst Biotechnol Negev, IL-84105 Beer Sheva, Israel. [Soares, Alexei S.] Brookhaven Natl Lab, Photon Sci Directorate, Upton, NY 11973 USA. [Pendlebury, Devon F.] Univ Michigan, Program Chem Biol, Ann Arbor, MI 48109 USA. RP Caulfield, TR (reprint author), Mayo Clin, Dept Neurosci, 310 Birdsall Bldg,4500 San Pablo Rd, Jacksonville, FL 32224 USA.; Radisky, ES (reprint author), Mayo Clin, Dept Canc Biol, 310 Griffin Bldg,4500 San Pablo Rd, Jacksonville, FL 32224 USA. EM caulfield.thomas@mayo.edu; radisky.evette@mayo.edu FU National Institutes of Health [R01CA154387]; European Research Council [33604]; Prostate Cancer Foundation FX This work was supported by National Institutes of Health Grant R01CA154387 (to E. S. R.), European Research Council "Ideas Program" ERC-2013-StG Grant 33604 (to N. P.), and a Prostate Cancer Foundation grant (to N. P.). The authors declare that they have no conflicts of interest with the contents of this article. The content is solely the responsibility of the authors and does not necessarily represent the official views of the National Institutes of Health. NR 79 TC 0 Z9 0 U1 3 U2 3 PU AMER SOC BIOCHEMISTRY MOLECULAR BIOLOGY INC PI BETHESDA PA 9650 ROCKVILLE PIKE, BETHESDA, MD 20814-3996 USA SN 0021-9258 EI 1083-351X J9 J BIOL CHEM JI J. Biol. Chem. PD DEC 16 PY 2016 VL 291 IS 51 BP 26304 EP 26319 DI 10.1074/jbc.M116.758417 PG 16 WC Biochemistry & Molecular Biology SC Biochemistry & Molecular Biology GA EH1ZY UT WOS:000391568200006 PM 27810896 ER PT J AU Radchenko, V Meyer, CAL Engle, JW Naranjo, CM Unc, GA Mastren, T Brugh, M Birnbaum, ER John, KD Nortier, FM Fassbender, ME AF Radchenko, V. Meyer, C. A. L. Engle, J. W. Naranjo, C. M. Unc, G. A. Mastren, T. Brugh, M. Birnbaum, E. R. John, K. D. Nortier, F. M. Fassbender, M. E. TI Separation of Ti-44 from proton irradiated scandium by using solid-phase extraction chromatography and design of Ti-44/(44)sc generator system SO JOURNAL OF CHROMATOGRAPHY A LA English DT Article DE Ti-44; Sc-44g; Scandium metal target; Solid phase extraction chromatography; BDGA; ZR resin ID CYCLOTRON PRODUCTION; IN-VITRO; SC-44; RADIONUCLIDE; PET; RADIOPHARMACEUTICALS; COMPLEXES; ISOTOPE; TARGET; RESIN AB Scandium-44g (half-life 3.97h [1]) shows promise for positron emission tomography (PET) imaging of longer biological processes than that of the current gold standard, F-18, due to its favorable decay parameters. One source of (44)gSc is the long-lived parent nuclide Ti-44 (half-life 60.0 a). A Ti-44/(44)gsc generator would have the ability to provide radionuclidically pure (44)gSc on a daily basis. The production of Ti-44 via the Sc-45(p,2n) reaction requires high proton beam currents and long irradiation times. Recovery and purification of no-carrier added (nca) Ti-44 from scandium metal targets involves complex separation chemistry. In this study, separation systems based on solid phase extraction chromatography were investigated, including branched diglycolamide (BDGA) resin and hydroxamate based ZR resin. Results indicate that ZR resin in HCl media represents an effective Ti-44/(44)gSc separation system. (C) 2016 Elsevier B.V. All rights reserved. C1 [Radchenko, V.; Meyer, C. A. L.; Engle, J. W.; Naranjo, C. M.; Unc, G. A.; Mastren, T.; Brugh, M.; Birnbaum, E. R.; John, K. D.; Nortier, F. M.; Fassbender, M. E.] Los Alamos Natl Lab, Div Chem, POB 1663, Los Alamos, NM 87545 USA. RP Fassbender, ME (reprint author), Los Alamos Natl Lab, Div Chem, POB 1663, Los Alamos, NM 87545 USA. EM mifa@lanl.gov OI John, Kevin/0000-0002-6181-9330 FU United States Department of Energy, Office of Science, Office of Nuclear Physics, via Isotope Development and Production for Research and Applications subprogram FX This study was supported by the United States Department of Energy, Office of Science, Office of Nuclear Physics, via funding from the Isotope Development and Production for Research and Applications subprogram. A special thanks to Dr. Steffen Happel from Triskem International for providing a sample of the ZR (hydroxamate) resin. NR 24 TC 0 Z9 0 U1 5 U2 5 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0021-9673 EI 1873-3778 J9 J CHROMATOGR A JI J. Chromatogr. A PD DEC 16 PY 2016 VL 1477 BP 39 EP 46 DI 10.1016/j.chroma.2016.11.047 PG 8 WC Biochemical Research Methods; Chemistry, Analytical SC Biochemistry & Molecular Biology; Chemistry GA EG0LH UT WOS:000390723800005 PM 27903405 ER PT J AU Graham, EB Crump, AR Resch, CT Fansler, S Arntzen, E Kennedy, DW Fredrickson, JK Stegen, JC AF Graham, Emily B. Crump, Alex R. Resch, Charles T. Fansler, Sarah Arntzen, Evan Kennedy, David W. Fredrickson, Jim K. Stegen, James C. TI Coupling Spatiotemporal Community Assembly Processes to Changes in Microbial Metabolism SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE niche; selection; dispersal; microbial community structure; aerobic respiration; ammonia oxidation; hyporheic; Hanford ID GEN.-NOV.; ECOSYSTEM FUNCTION; DISPERSAL LIMITATION; PLANT DIVERSITY; SPECIES TRAITS; HYPORHEIC ZONE; BACTERIAL; BIODIVERSITY; GROUNDWATER; ECOLOGY AB Community assembly processes generate shifts in species abundances that influence ecosystem cycling of carbon and nutrients, yet our understanding of assembly remains largely separate from ecosystem-level functioning. Here, we investigate relationships between assembly and changes in microbial metabolism across space and time in hyporheic microbial communities. We pair sampling of two habitat types (i.e., attached and planktonic) through seasonal and sub-hourly hydrologic fluctuation with null modeling and temporally explicit multivariate statistics. We demonstrate that multiple selective pressures imposed by sediment and porewater physicochemistry-integrate to generate changes in microbial community composition at distinct timescales among habitat types. These changes in composition are reflective of contrasting associations of Betaproteobacteria and Thaumarchaeota with ecological selection and with seasonal changes in microbial metabolism. We present a conceptual model based on our results in which metabolism increases when oscillating selective pressures oppose temporally stable selective pressures. Our conceptual model is pertinent to both macrobial and microbial systems experiencing multiple selective pressures and presents an avenue for assimilating community assembly processes into predictions of ecosystem-level functioning. C1 [Graham, Emily B.; Crump, Alex R.; Resch, Charles T.; Fansler, Sarah; Arntzen, Evan; Kennedy, David W.; Fredrickson, Jim K.; Stegen, James C.] Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99354 USA. RP Graham, EB (reprint author), Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99354 USA. EM emily.graham@pnnl.gov OI Graham, Emily/0000-0002-4623-7076; Crump, Alex/0000-0002-2443-6146 FU US Department of Energy (DOE), Office of Biological and Environmental Research (BER), Subsurface Biogeochemical Research Program's Scientific Focus Area (SFA) at the Pacific Northwest National Laboratory (PNNL); DOE [DE-AC06-76RLO 1830] FX This research was supported by the US Department of Energy (DOE), Office of Biological and Environmental Research (BER), as part of Subsurface Biogeochemical Research Program's Scientific Focus Area (SFA) at the Pacific Northwest National Laboratory (PNNL). PNNL is operated for DOE by Battelle under contract DE-AC06-76RLO 1830. A portion of the research was performed using Institutional Computing at PNNL. NR 76 TC 0 Z9 0 U1 17 U2 17 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 16 PY 2016 VL 7 AR 1949 DI 10.3389/fmicb.2016.01949 PG 13 WC Microbiology SC Microbiology GA EE9LH UT WOS:000389947500001 PM 28123379 ER PT J AU Morimoto, T Zhong, SD Orenstein, J Moore, JE AF Morimoto, Takahiro Zhong, Shudan Orenstein, Joseph Moore, Joel E. TI Semiclassical theory of nonlinear magneto-optical responses with applications to topological Dirac/Weyl semimetals SO PHYSICAL REVIEW B LA English DT Article ID TRANSPORT; SPIN AB We study nonlinear magneto-optical responses of metals by a semiclassical Boltzmann equation approach. We derive general formulas for linear and second-order nonlinear optical effects in the presence of magnetic fields that include both the Berry curvature and the orbital magnetic moment. Applied to Weyl fermions, the semiclassical approach (i) captures the directional anisotropy of linear conductivity under a magnetic field as a consequence of an anisotropic B-2 contribution, which may explain the low-field regime of recent experiments; and (ii) predicts strong second harmonic generation proportional to B that is enhanced as the Fermi energy approaches the Weyl point, leading to large nonlinear Kerr rotation. Moreover, we show that the semiclassical formula for the circular photogalvanic effect arising from the Berry curvature dipole is reproduced by a full quantum calculation using a Floquet approach. C1 [Morimoto, Takahiro; Zhong, Shudan; Orenstein, Joseph; Moore, Joel E.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Orenstein, Joseph; Moore, Joel E.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. RP Morimoto, T (reprint author), Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. EM tmorimoto@berkeley.edu FU Gordon and Betty Moore Foundation's EPiQS Initiative Theory Center Grant [GBMF4537]; NSF [DMR-1507141]; DOE Quantum Materials program of Lawrence Berkeley National Laboratory FX We thank M. Kolodrubetz, B. M. Fregoso, and L. Wu for fruitful discussions. This work was supported by the Gordon and Betty Moore Foundation's EPiQS Initiative Theory Center Grant (T.M.), NSF Grant No. DMR-1507141 (S.Z.), the Gordon and Betty Moore Foundation's EPiQS Initiative through Grant No. GBMF4537 (J.O.), and the DOE Quantum Materials program of Lawrence Berkeley National Laboratory, with travel support from the Simons Foundation (J.E.M.). NR 33 TC 2 Z9 2 U1 11 U2 11 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 16 PY 2016 VL 94 IS 24 AR 245121 DI 10.1103/PhysRevB.94.245121 PG 15 WC Physics, Condensed Matter SC Physics GA EF3XQ UT WOS:000390258800001 ER PT J AU Adamson, P Anghel, I Aurisano, A Barr, G Bishai, M Blake, A Bock, GJ Bogert, D Cao, SV Carroll, TJ Castromonte, CM Chen, R Childress, S Coelho, JAB Corwin, L Cronin-Hennessy, D de Jong, JK De Rijck, S Devan, AV Devenish, NE Diwan, MV Escobar, CO Evans, JJ Falk, E Feldman, GJ Flanagan, W Frohne, MV Gabrielyan, M Gallagher, HR Germani, S Gomes, RA Goodman, MC Gouffon, P Graf, N Gran, R Grzelak, K Habig, A Hahn, SR Hartnell, J Hatcher, R Holin, A Huang, J Hylen, J Irwin, GM Isvan, Z James, C Jensen, D Kafka, T Kasahara, SMS Koizumi, G Kordosky, M Kreymer, A Lang, K Ling, J Litchfield, PJ Lucas, P Mann, WA Marshak, ML Mayer, N McGivern, C Medeiros, MM Mehdiyev, R Meier, JR Messier, MD Miller, WH Mishra, SR Sher, SM Moore, CD Mualem, L Musser, J Naples, D Nelson, JK Newman, HB Nichol, RJ Nowak, JA O'Connor, J Orchanian, M Pahlka, RB Paley, J Patterson, RB Pawloski, G Perch, A Pfutzner, MM Phan, DD Phan-Budd, S Plunkett, RK Poonthottathil, N Qiu, X Radovic, A Rebel, B Rosenfeld, C Rubin, HA Sail, P Sanchez, MC Schneps, J Schreckenberger, A Schreiner, P Sharma, R Sousa, A Tagg, N Talaga, RL Thomas, J Thomson, MA Tian, X Timmons, A Todd, J Tognini, SC Toner, R Torretta, D Tzanakos, G Urheim, J Vahle, P Viren, B Weber, A Webb, RC White, C Whitehead, L Whitehead, LH Wojcicki, SG Zwaska, R AF Adamson, P. Anghel, I. Aurisano, A. Barr, G. Bishai, M. Blake, A. Bock, G. J. Bogert, D. Cao, S. V. Carroll, T. J. Castromonte, C. M. Chen, R. Childress, S. Coelho, J. A. B. Corwin, L. Cronin-Hennessy, D. de Jong, J. K. De Rijck, S. Devan, A. V. Devenish, N. E. Diwan, M. V. Escobar, C. O. Evans, J. J. Falk, E. Feldman, G. J. Flanagan, W. Frohne, M. V. Gabrielyan, M. Gallagher, H. R. Germani, S. Gomes, R. A. Goodman, M. C. Gouffon, P. Graf, N. Gran, R. Grzelak, K. Habig, A. Hahn, S. R. Hartnell, J. Hatcher, R. Holin, A. Huang, J. Hylen, J. Irwin, G. M. Isvan, Z. James, C. Jensen, D. Kafka, T. Kasahara, S. M. S. Koizumi, G. Kordosky, M. Kreymer, A. Lang, K. Ling, J. Litchfield, P. J. Lucas, P. Mann, W. A. Marshak, M. L. Mayer, N. McGivern, C. Medeiros, M. M. Mehdiyev, R. Meier, J. R. Messier, M. D. Miller, W. H. Mishra, S. R. Sher, S. Moed Moore, C. D. Mualem, L. Musser, J. Naples, D. Nelson, J. K. Newman, H. B. Nichol, R. J. Nowak, J. A. O'Connor, J. Orchanian, M. Pahlka, R. B. Paley, J. Patterson, R. B. Pawloski, G. Perch, A. Pfutzner, M. M. Phan, D. D. Phan-Budd, S. Plunkett, R. K. Poonthottathil, N. Qiu, X. Radovic, A. Rebel, B. Rosenfeld, C. Rubin, H. A. Sail, P. Sanchez, M. C. Schneps, J. Schreckenberger, A. Schreiner, P. Sharma, R. Sousa, A. Tagg, N. Talaga, R. L. Thomas, J. Thomson, M. A. Tian, X. Timmons, A. Todd, J. Tognini, S. C. Toner, R. Torretta, D. Tzanakos, G. Urheim, J. Vahle, P. Viren, B. Weber, A. Webb, R. C. White, C. Whitehead, L. Whitehead, L. H. Wojcicki, S. G. Zwaska, R. CA MINOS Collaboration TI Constraints on large extra dimensions from the MINOS experiment SO PHYSICAL REVIEW D LA English DT Article ID NEUTRINO OSCILLATIONS; LEPTON CHARGE; MATTER; MASS AB We report new constraints on the size of large extra dimensions from data collected by the MINOS experiment between 2005 and 2012. Our analysis employs a model in which sterile neutrinos arise as Kaluza-Klein states in large extra dimensions and thus modify the neutrino oscillation probabilities due to mixing between active and sterile neutrino states. Using Fermilab's Neutrinos at the Main Injector beam exposure of 10.56 x 10(20) protons on target, we combine muon neutrino charged current and neutral current data sets from the Near and Far Detectors and observe no evidence for deviations from standard three-flavor neutrino oscillations. The ratios of reconstructed energy spectra in the two detectors constrain the size of large extra dimensions to be smaller than 0.45 mu m at 90% C.L. in the limit of a vanishing lightest active neutrino mass. Stronger limits are obtained for nonvanishing masses. C1 [Anghel, I.; Aurisano, A.; Goodman, M. C.; Paley, J.; Phan-Budd, S.; Sanchez, M. C.; Schreiner, P.; Talaga, R. L.] Argonne Natl Lab, Argonne, IL 60439 USA. [Tzanakos, G.] Univ Athens, Dept Phys, GR-15771 Athens, Greece. [Diwan, M. V.; Isvan, Z.; Ling, J.; Viren, B.] Brookhaven Natl Lab, Upton, NY 11973 USA. CALTECH, Lauritsen Lab, Pasadena, CA 91125 USA. [Mualem, L.; Newman, H. B.; Orchanian, M.; Patterson, R. B.] Univ Cambridge, Cavendish Lab, Cambridge CB3 0HE, England. [Blake, A.; Thomson, M. A.] Univ Estadual Campinas, IFGW, CP 6165, BR-13083970 Campinas, SP, Brazil. [Escobar, C. O.] Univ Cincinnati, Dept Phys, Cincinnati, OH 45221 USA. [Aurisano, A.; Sousa, A.; Todd, J.] Fermilab Natl Accelerator Lab, Batavia, IL 60510 USA. [Adamson, P.; Bock, G. J.; Bogert, D.; Childress, S.; Hahn, S. R.; Hatcher, R.; Hylen, J.; James, C.; Jensen, D.; Koizumi, G.; Kreymer, A.; Lucas, P.; Sher, S. Moed; Moore, C. D.; Pahlka, R. B.; Plunkett, R. K.; Poonthottathil, N.; Rebel, B.; Sharma, R.; Torretta, D.; Zwaska, R.] Univ Fed Goias, Inst Fis, BR-74690900 Goiania, Go, Brazil. [Castromonte, C. M.; Gomes, R. A.; Medeiros, M. M.; Tognini, S. C.] Harvard Univ, Dept Phys, Cambridge, MA 02138 USA. [Feldman, G. J.; Toner, R.] Coll Holy Cross, Notre Dame, IN 46556 USA. [Frohne, M. V.] Univ Houston, Dept Phys, Houston, TX 77204 USA. [Whitehead, L.] IIT, Dept Phys, Chicago, IL 60616 USA. [Rubin, H. A.; White, C.] Indiana Univ, Bloomington, IN 47405 USA. [Corwin, L.; Messier, M. D.; Musser, J.; Urheim, J.] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [Anghel, I.; Sanchez, M. C.] Univ Lancaster, Lancaster LA1 4YB, England. [Blake, A.] UCL, Dept Phys & Astron, London WC1E 6BT, England. [Germani, S.; Holin, A.; Nichol, R. J.; O'Connor, J.; Perch, A.; Pfutzner, M. M.; Thomas, J.; Timmons, A.; Whitehead, L. H.] Univ Manchester, Sch Phys & Astron, Manchester M13 9PL, Lancs, England. [Chen, R.; Evans, J. J.] Univ Minnesota, Minneapolis, MN 55455 USA. [Cronin-Hennessy, D.; Gabrielyan, M.; Kasahara, S. M. S.; Litchfield, P. J.; Marshak, M. L.; Meier, J. R.; Miller, W. H.; Nowak, J. A.; Pawloski, G.] Univ Minnesota, Dept Phys, Duluth, MN 55812 USA. [Gran, R.; Habig, A.] Otterbein Univ, Westerville, OH 43081 USA. [Tagg, N.] Univ Oxford, Subdept Particle Phys, Oxford OX1 3RH, England. [Barr, G.; de Jong, J. K.; Weber, A.] Univ Pittsburgh, Dept Phys & Astron, Pittsburgh, PA 15260 USA. [Graf, N.; McGivern, C.; Naples, D.] Sci & Technol Facil Council, Rutherford Appleton Lab, Didcot OX11 0QX, Oxon, England. [Litchfield, P. J.; Weber, A.] Univ Sao Paulo, Inst Fis, CP 66318, BR-05315970 Sao Paulo, SP, Brazil. [Webb, R. C.] Univ South Carolina, Dept Phys & Astron, Columbia, SC 29208 USA. [Mishra, S. R.; Rosenfeld, C.; Tian, X.] Stanford Univ, Dept Phys, Stanford, CA 94305 USA. [Irwin, G. M.; Qiu, X.; Wojcicki, S. G.] Univ Sussex, Dept Phys & Astron, Brighton BN1 9QH, E Sussex, England. [Devenish, N. E.; Falk, E.; Gouffon, P.; Hartnell, J.] Texas A&M Univ, Dept Phys, College Stn, TX 77843 USA. [Webb, R. C.] Univ Texas Austin, Dept Phys, Austin, TX 78712 USA. [Cao, S. V.; Carroll, T. J.; De Rijck, S.; Flanagan, W.; Huang, J.; Lang, K.; Mehdiyev, R.; Phan, D. D.; Sail, P.; Schreckenberger, A.] Tufts Univ, Dept Phys, Medford, MA 02155 USA. [Coelho, J. A. B.; Gallagher, H. R.; Kafka, T.; Mann, W. A.; Mayer, N.; Schneps, J.] Univ Warsaw, Dept Phys, PL-02093 Warsaw, Poland. [Grzelak, K.] Coll William & Mary, Dept Phys, Williamsburg, VA 23187 USA. [Bishai, M.; Corwin, L.; Devan, A. V.; Kordosky, M.; Nelson, J. K.; Radovic, A.; Vahle, P.] South Dakota Sch Mines & Technol, Rapid City, SD 57701 USA. [Nowak, J. A.] Univ Lancaster, Lancaster LA1 4YB, England. RP Adamson, P (reprint author), Univ Fed Goias, Inst Fis, BR-74690900 Goiania, Go, Brazil. RI Gomes, Ricardo/B-6899-2008; OI Gomes, Ricardo/0000-0003-0278-4876; Nowak, Jaroslaw/0000-0001-8637-5433 FU U.S. Department of Energy; United Kingdom Science and Technology Facilities Council; U.S. National Science Foundation; State and University of Minnesota; Brazil Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (FAPESP); Brazil Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq); Brazil Coordenacao de Aperfeicoamento de Pessoal de Nivel Superior (CAPES) FX This work was supported by the U.S. Department of Energy; the United Kingdom Science and Technology Facilities Council; the U.S. National Science Foundation; the State and University of Minnesota; and Brazil's Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (FAPESP), Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq), and Coordenacao de Aperfeicoamento de Pessoal de Nivel Superior (CAPES). We are grateful to the Minnesota Department of Natural Resources and the personnel of the Soudan Laboratory and Fermilab. We thank the Texas Advanced Computing Center at The University of Texas at Austin for the provision of computing resources. We wish to thank P. A. N. Machado for providing insightful comments on the LED model. NR 50 TC 0 Z9 0 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 16 PY 2016 VL 94 IS 11 AR 111101 DI 10.1103/PhysRevD.94.111101 PG 7 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF4DT UT WOS:000390275600001 ER PT J AU Shuve, B Peskin, ME AF Shuve, Brian Peskin, Michael E. TI Revision of the LHCb limit on Majorana neutrinos SO PHYSICAL REVIEW D LA English DT Article ID LEPTON; DECAYS AB We revisit the recent limits from LHCb on a Majorana neutrino N in the mass range 250-5000 MeV [R. Aaij et al. (LHCb Collaboration), Phys. Rev. Lett. 112, 131802 (2014).]. These limits are among the best currently available, and they will be improved soon by the addition of data from Run 2 of the LHC. LHCb presented a model-independent constraint on the rate of like-sign leptonic decays, and then derived a constraint on the mixing angle V mu(4) based on a theoretical model for the B decay width to N and the N lifetime. The model used is unfortunately unsound. We revise the conclusions of the paper based on a decay model similar to the one used for the tau lepton and provide formulas useful for future analyses. C1 [Shuve, Brian; Peskin, Michael E.] Stanford Univ, SLAC, Menlo Pk, CA 94025 USA. RP Shuve, B (reprint author), Stanford Univ, SLAC, Menlo Pk, CA 94025 USA. FU U.S. Department of Energy [DE-AC02-76SF00515] FX We are grateful to Sheldon Stone for his encouragement and for his help in understanding the LHCb analysis. We thank Dmitri Liventsev for discussions of the Belle analysis. This work was supported by the U.S. Department of Energy under Contract No. DE-AC02-76SF00515. NR 15 TC 0 Z9 0 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 16 PY 2016 VL 94 IS 11 AR 113007 DI 10.1103/PhysRevD.94.113007 PG 4 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF4DT UT WOS:000390275600003 ER PT J AU Erdenemunkh, U Koopman, B Fu, L Chatterjee, K Wise, WD Gu, GD Hudson, EW Boyer, MC AF Erdenemunkh, Unurbat Koopman, Brian Fu, Ling Chatterjee, Kamalesh Wise, W. D. Gu, G. D. Hudson, E. W. Boyer, Michael C. TI Suppression of Superfluid Density and the Pseudogap State in the Cuprates by Impurities SO PHYSICAL REVIEW LETTERS LA English DT Article ID T-C SUPERCONDUCTIVITY; EFFECTIVE IONIC-RADII; MAGNETIC-PROPERTIES; EXCITATION SPECTRUM; COPPER OXIDES; ENERGY-GAP; ZN; NI; BI2SR2CACU2O8+DELTA; SUBSTITUTION AB We use scanning tunneling microscopy (STM) to study magnetic Fe impurities intentionally doped into the high-temperature superconductor Bi2Sr2CaCu2O8+delta. Our spectroscopic measurements reveal that Fe impurities introduce low-lying resonances in the density of states at Omega(1) approximate to 4 meV and Omega(2) approximate to 15 meV, allowing us to determine that, despite having a large magnetic moment, potential scattering of quasiparticles by Fe impurities dominates magnetic scattering. In addition, using high-resolution spatial characterizations of the local density of states near and away from Fe impurities, we detail the spatial extent of impurity-affected regions as well as provide a local view of impurity-induced effects on the superconducting and pseudogap states. Our studies of Fe impurities, when combined with a reinterpretation of earlier STM work in the context of a two-gap scenario, allow us to present a unified view of the atomic-scale effects of elemental impurities on the pseudogap and superconducting states in hole-doped cuprates; this may help resolve a previously assumed dichotomy between the effects of magnetic and nonmagnetic impurities in these materials. C1 [Erdenemunkh, Unurbat; Koopman, Brian; Fu, Ling; Boyer, Michael C.] Clark Univ, Dept Phys, Worcester, MA 01610 USA. [Chatterjee, Kamalesh; Wise, W. D.; Hudson, E. W.; Boyer, Michael C.] MIT, Dept Phys, Cambridge, MA 02139 USA. [Gu, G. D.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Hudson, E. W.] Penn State Univ, Dept Phys, State Coll, PA 16802 USA. RP Boyer, MC (reprint author), Clark Univ, Dept Phys, Worcester, MA 01610 USA.; Boyer, MC (reprint author), MIT, Dept Phys, Cambridge, MA 02139 USA. EM mboyer@clarku.edu OI Hudson, Eric/0000-0001-7064-0351 FU NSF [DMR-1341286]; Clark University; DOE, Office of Science [DE-SC0012704] FX We thank Bill Atkinson and Kyle Shen for useful conversations. The authors thank J.C. Davis for access to Zn and Ni doped Bi-2212 data. This work is supported by NSF Grant No. DMR-1341286 and Clark University (university and physics department research student support). The work at BNL was supported by DOE, Office of Science under DE-SC0012704. NR 64 TC 0 Z9 0 U1 8 U2 8 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 16 PY 2016 VL 117 IS 25 AR 257003 DI 10.1103/PhysRevLett.117.257003 PG 6 WC Physics, Multidisciplinary SC Physics GA EF3MN UT WOS:000390228600010 PM 28036192 ER PT J AU Varjas, D Grushin, AG Ilan, R Moore, JE AF Varjas, Daniel Grushin, Adolfo G. Ilan, Roni Moore, Joel E. TI Dynamical Piezoelectric and Magnetopiezoelectric Effects in Polar Metals from Berry Phases and Orbital Moments SO PHYSICAL REVIEW LETTERS LA English DT Article ID CRYSTALLINE SOLIDS; TRANSPORT; PHYSICS; QUANTIZATION; POLARIZATION AB The polarization of a material and its response to applied electric and magnetic fields are key solid-state properties with a long history in insulators, although a satisfactory theory required new concepts such as Berry-phase gauge fields. In metals, quantities such as static polarization and the magnetoelectric. term cease to be well defined. In polar metals, there can be analogous dynamical current responses, which we study in a common theoretical framework. We find that current responses to dynamical strain in polar metals depend on both the first and second Chern forms, related to polarization and magnetoelectricity in insulators as well as the orbital magnetization on the Fermi surface. We provide realistic estimates that predict that the latter contribution will dominate, and we investigate the feasibility of experimental detection of this effect. C1 [Varjas, Daniel; Grushin, Adolfo G.; Ilan, Roni; Moore, Joel E.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Moore, Joel E.] Lawrence Berkeley Natl Lab, Mat Sci Div, Berkeley, CA 94720 USA. [Varjas, Daniel] Delft Univ Technol, QuTech & Kavli Inst Nanosci, NL-2600 GA Delft, Netherlands. [Ilan, Roni] Tel Aviv Univ, Raymond & Beverly Sackler Sch Phys & Astron, IL-69978 Tel Aviv, Israel. RP Varjas, D (reprint author), Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. FU Marie Curie Programme under EC [653846]; NSF [DMR-1507141]; AFOSR MURI; Quantum Materials Program of LBNL; Simons Center for Geometry and Physics; Simons Investigator Program FX We are grateful to Fernando de Juan and Hannah Price for enlightening discussions and correspondence. We acknowledge financial support from the Marie Curie Programme under EC Grant Agreement No. 653846. (A. G. G.), NSF Grant No. DMR-1507141 (D. V.), AFOSR MURI (R. I.), and the Quantum Materials Program of LBNL (J. E. M.). J. E. M. acknowledges support from the Simons Center for Geometry and Physics and the Simons Investigator Program. NR 56 TC 1 Z9 1 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 16 PY 2016 VL 117 IS 25 AR 257601 DI 10.1103/PhysRevLett.117.257601 PG 6 WC Physics, Multidisciplinary SC Physics GA EF3MN UT WOS:000390228600012 PM 28036206 ER PT J AU Horng, J Balch, HB McGuire, AF Tsai, HZ Forrester, PR Crommie, MF Cui, BX Wang, F AF Horng, Jason Balch, Halleh B. McGuire, Allister F. Tsai, Hsin-Zon Forrester, Patrick R. Crommie, Michael F. Cui, Bianxiao Wang, Feng TI Imaging electric field dynamics with graphene optoelectronics SO NATURE COMMUNICATIONS LA English DT Article ID POTENTIALS; DIELECTROPHORESIS; RESOLUTION; PLASMONS; DROPLETS; CELLS; LIGHT AB The use of electric fields for signalling and control in liquids is widespread, spanning bioelectric activity in cells to electrical manipulation of microstructures in lab-on-a-chip devices. However, an appropriate tool to resolve the spatio-temporal distribution of electric fields over a large dynamic range has yet to be developed. Here we present a label-free method to image local electric fields in real time and under ambient conditions. Our technique combines the unique gate-variable optical transitions of graphene with a critically coupled planar waveguide platform that enables highly sensitive detection of local electric fields with a voltage sensitivity of a few microvolts, a spatial resolution of tens of micrometres and a frequency response over tens of kilohertz. Our imaging platform enables parallel detection of electric fields over a large field of view and can be tailored to broad applications spanning labon- a-chip device engineering to analysis of bioelectric phenomena. C1 [Horng, Jason; Balch, Halleh B.; Tsai, Hsin-Zon; Forrester, Patrick R.; Crommie, Michael F.; Wang, Feng] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Horng, Jason; Balch, Halleh B.; Crommie, Michael F.; Wang, Feng] Univ Calif Berkeley, Kavli Energy NanoSci Inst, Berkeley, CA 94720 USA. [Horng, Jason; Balch, Halleh B.; Crommie, Michael F.; Wang, Feng] Univ Calif Berkeley, Berkeley, CA 94720 USA. [McGuire, Allister F.; Cui, Bianxiao] Stanford Univ, Dept Chem, Stanford, CA 94305 USA. [Crommie, Michael F.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. RP Wang, F (reprint author), Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA.; Wang, F (reprint author), Univ Calif Berkeley, Kavli Energy NanoSci Inst, Berkeley, CA 94720 USA.; Wang, F (reprint author), Univ Calif Berkeley, Berkeley, CA 94720 USA. EM fengwang76@berkeley.edu FU National Science Foundation [DMR-1344302]; U.S. Department of Energy Office of Basic Energy Sciences [DE-AC02-05CH11231]; David and Lucile Packard fellowship; NSF Graduate Research Fellowship [DGE 1106400]; Stanford Bio-X Graduate Fellowship FX The authors thank Felix Alfonso, Hui-Ling Han, Sufei Shi and Zhiwen Shi for helpful discussions and thank Andreas Bastian and the Ember Team at Autodesk for help designing and printing the device mount and solution holder. This work was supported by the National Science Foundation grant DMR-1344302 (optical measurements, simulations, device fabrication), and by the U.S. Department of Energy Office of Basic Energy Sciences contract no. DE-AC02-05CH11231 Nanomachine program (graphene fabrication). F.W. and B.C. acknowledge support from the David and Lucile Packard fellowship. H.B.B. acknowledges support from the NSF Graduate Research Fellowship (grant DGE 1106400). A.F.M. acknowledges support from the Stanford Bio-X Graduate Fellowship. NR 35 TC 0 Z9 0 U1 12 U2 12 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 16 PY 2016 VL 7 AR 13704 DI 10.1038/ncomms13704 PG 7 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE8CW UT WOS:000389853500001 PM 27982125 ER PT J AU Bu, LZ Zhang, N Guo, SJ Zhang, X Li, J Yao, JL Wu, T Lu, G Ma, JY Su, D Huang, XQ AF Bu, Lingzheng Zhang, Nan Guo, Shaojun Zhang, Xu Li, Jing Yao, Jianlin Wu, Tao Lu, Gang Ma, Jing-Yuan Su, Dong Huang, Xiaoqing TI Biaxially strained PtPb/Pt core/shell nanoplate boosts oxygen reduction catalysis SO SCIENCE LA English DT Article ID COMPUTATIONAL DESIGN; PLATINUM; ELECTROCATALYSTS; SURFACES; NANOPARTICLES; NANOCRYSTALS; NANOSHEETS; METHANOL; FACETS; ALLOY AB Compressive surface strains have been necessary to boost oxygen reduction reaction (ORR) activity in core/shell M/platinum (Pt) catalysts (where M can be nickel, cobalt, or iron). We report on a class of platinum-lead/platinum (PtPb/Pt) core/shell nanoplate catalysts that exhibit large biaxial strains. The stable Pt (110) facets of the nanoplates have high ORR specific and mass activities that reach 7.8 milliampere (mA) per centimeter squared and 4.3 ampere per milligram of platinum at 0.9 volts versus the reversible hydrogen electrode (RHE), respectively. Density functional theory calculations reveal that the edge-Pt and top (bottom)-Pt (110) facets undergo large tensile strains that help optimize the Pt-O bond strength. The intermetallic core and uniform four layers of Pt shell of the PtPb/Pt nanoplates appear to underlie the high endurance of these catalysts, which can undergo 50,000 voltage cycles with negligible activity decay and no apparent structure and composition changes. C1 [Bu, Lingzheng; Zhang, Nan; Yao, Jianlin; Wu, Tao; Huang, Xiaoqing] Soochow Univ, Coll Chem Chem Engn & Mat Sci, Suzhou 215123, Jiangsu, Peoples R China. [Guo, Shaojun] Peking Univ, Coll Engn, Dept Mat Sci & Engn, Beijing 100871, Peoples R China. [Guo, Shaojun] Peking Univ, Coll Engn, Dept Energy & Resources Engn, Beijing 100871, Peoples R China. [Guo, Shaojun] Peking Univ, Beijing Innovat Ctr Engn Sci & Adv Technol BIC ES, Coll Engn, Beijing 100871, Peoples R China. [Guo, Shaojun] Peking Univ, Key Lab Theory & Technol Adv Batteries Mat, Coll Engn, Beijing 100871, Peoples R China. [Zhang, Xu; Lu, Gang] Calif State Univ Northridge, Dept Phys & Astron, Northridge, CA 91330 USA. [Li, Jing; Su, Dong] Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. [Ma, Jing-Yuan] Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai Synchrotron Radiat Facil, Shanghai 201204, Peoples R China. RP Huang, XQ (reprint author), Soochow Univ, Coll Chem Chem Engn & Mat Sci, Suzhou 215123, Jiangsu, Peoples R China.; Guo, SJ (reprint author), Peking Univ, Coll Engn, Dept Mat Sci & Engn, Beijing 100871, Peoples R China.; Guo, SJ (reprint author), Peking Univ, Coll Engn, Dept Energy & Resources Engn, Beijing 100871, Peoples R China.; Guo, SJ (reprint author), Peking Univ, Beijing Innovat Ctr Engn Sci & Adv Technol BIC ES, Coll Engn, Beijing 100871, Peoples R China.; Guo, SJ (reprint author), Peking Univ, Key Lab Theory & Technol Adv Batteries Mat, Coll Engn, Beijing 100871, Peoples R China.; Su, D (reprint author), Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. EM guosj@pku.edu.cn; dsu@bnl.gov; hxq006@suda.edu.cn RI Guo, Shaojun/A-8449-2011; Su, Dong/A-8233-2013; Wu, Tao/H-5754-2012 OI Guo, Shaojun/0000-0002-5941-414X; Su, Dong/0000-0002-1921-6683; FU National Key Research and Development Program of China [2016YEB0100201]; National Natural Science Foundation of China [21571135, 51671003]; Ministry of Science and Technology [2016YFA0204100]; Soochow University; Peking University; Young Thousand Talented Program; Priority Academic Program Development of Jiangsu Higher Education Institutions (PAPD); U.S. Department of Energy (DOE), Office of Basic Energy Science [DE-SC0012704]; U.S. Army Research Office via the MURI grant [W911NF-11-1-0353] FX This work was financially supported by the National Key Research and Development Program of China (2016YEB0100201), the National Natural Science Foundation of China (21571135 and 51671003), the Ministry of Science and Technology (2016YFA0204100), the start-up funding from Soochow University and Peking University, Young Thousand Talented Program, and the Priority Academic Program Development of Jiangsu Higher Education Institutions (PAPD). Part of the electron microscopy work was performed at the Center for Functional Nanomaterials, Brookhaven National Laboratory, which is supported by the U.S. Department of Energy (DOE), Office of Basic Energy Science, under contract DE-SC0012704. The work at California State University Northridge was supported by the U.S. Army Research Office via the MURI grant W911NF-11-1-0353. We thank S. Cheng for his help in the simulation of STEM imaging. All data are reported in the main text and supplementary materials. NR 36 TC 5 Z9 5 U1 164 U2 164 PU AMER ASSOC ADVANCEMENT SCIENCE PI WASHINGTON PA 1200 NEW YORK AVE, NW, WASHINGTON, DC 20005 USA SN 0036-8075 EI 1095-9203 J9 SCIENCE JI Science PD DEC 16 PY 2016 VL 354 IS 6318 BP 1410 EP 1414 DI 10.1126/science.aah6133 PG 5 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF3YN UT WOS:000390261300040 PM 27980207 ER PT J AU Li, MF Zhao, ZP Cheng, T Fortunelli, A Chen, CY Yu, R Zhang, QH Gu, L Merinov, BV Lin, ZY Zhu, EB Yu, T Jia, QY Guo, JH Zhang, L Goddard, WA Huang, Y Duan, XF AF Li, Mufan Zhao, Zipeng Cheng, Tao Fortunelli, Alessandro Chen, Chih-Yen Yu, Rong Zhang, Qinghua Gu, Lin Merinov, Boris V. Lin, Zhaoyang Zhu, Enbo Yu, Ted Jia, Qingying Guo, Jinghua Zhang, Liang Goddard, William A., III Huang, Yu Duan, Xiangfeng TI Ultrafine jagged platinum nanowires enable ultrahigh mass activity for the oxygen reduction reaction SO SCIENCE LA English DT Article ID ELECTROCATALYTIC PROPERTIES; ALLOY ELECTROCATALYSTS; ADSORPTION PROPERTIES; MOLECULAR-DYNAMICS; SURFACE-CHEMISTRY; PT-SKIN; NANOPARTICLES; CATALYSTS; STABILITY; CLUSTERS AB Improving the platinum (9Pt) mass activity for the oxygen reduction reaction (ORR) requires optimization of both the specific activity and the electrochemically active surface area (ECSA). We found that solution-synthesized Pt/NiO core/shell nanowires can be converted into PtNi alloy nanowires through a thermal annealing process and then transformed into jagged Pt nanowires via electrochemical dealloying. The jagged nanowires exhibit an ECSA of 118 square meters per gram of Pt and a specific activity of 11.5 milliamperes per square centimeter for ORR 9 (at 0.9 volts versus reversible hydrogen electrode), yielding a mass activity of 13.6 amperes per milligram of Pt, nearly double previously reported best values. Reactive molecular dynamics simulations suggest that highly stressed, undercoordinated rhombus-rich surface configurations of the jagged nanowires enhance ORR activity versus more relaxed surfaces. C1 [Li, Mufan; Lin, Zhaoyang; Duan, Xiangfeng] Univ Calif Los Angeles, Dept Chem & Biochem, Los Angeles, CA 90095 USA. [Zhao, Zipeng; Chen, Chih-Yen; Zhu, Enbo; Huang, Yu] Univ Calif Los Angeles, Dept Mat Sci & Engn, Los Angeles, CA 90095 USA. [Cheng, Tao; Fortunelli, Alessandro; Merinov, Boris V.; Yu, Ted; Goddard, William A., III] CALTECH, Mat & Proc Simulat Ctr, Pasadena, CA 91125 USA. [Fortunelli, Alessandro] CNR, ICCOM, I-56124 Pisa, Italy. [Yu, Rong] Tsinghua Univ, Sch Mat Sci & Engn, Natl Ctr Electron Microscopy Beijing, Beijing 100084, Peoples R China. [Zhang, Qinghua; Gu, Lin] Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China. [Yu, Ted] Calif State Univ Long Beach, Dept Chem Engn, Long Beach, CA 90840 USA. [Jia, Qingying] Northeastern Univ, Dept Chem & Chem Biol, Boston, MA 02115 USA. [Guo, Jinghua; Zhang, Liang] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Huang, Yu; Duan, Xiangfeng] Univ Calif Los Angeles, California NanoSyst Inst, Los Angeles, CA 90095 USA. RP Duan, XF (reprint author), Univ Calif Los Angeles, Dept Chem & Biochem, Los Angeles, CA 90095 USA.; Huang, Y (reprint author), Univ Calif Los Angeles, Dept Mat Sci & Engn, Los Angeles, CA 90095 USA.; Goddard, WA (reprint author), CALTECH, Mat & Proc Simulat Ctr, Pasadena, CA 91125 USA.; Huang, Y; Duan, XF (reprint author), Univ Calif Los Angeles, California NanoSyst Inst, Los Angeles, CA 90095 USA. EM wag@wag.caltech.edu; yhuang@seas.ucla.edu; xduan@chem.ucla.edu RI Gu, Lin/D-9631-2011; Zhang, Qinghua/D-1920-2011; OI Gu, Lin/0000-0002-7504-031X; Zhang, Qinghua/0000-0001-9086-7000; Cheng, Tao/0000-0003-4830-177X FU DOE Office of Basic Energy Sciences, Division of Materials Science and Engineering [DE-SC0008055]; NSF [CHE-1508692, CBET-1512159]; National Natural Science Foundation of China [51525102, 51390475, 51371102]; Office of Science, Office of Basic Energy Sciences, of DOE [DE-AC02-05CH11231] FX Supported by DOE Office of Basic Energy Sciences, Division of Materials Science and Engineering, award DE-SC0008055 (X.D., M.L., and Z.L. for materials synthesis and characterizations); NSF grant CHE-1508692 (Y.H., Z.Z., and E.Z. for electrochemical studies); NSF grant CBET-1512159 (W.A.G., A.F., B.V.M. and T.C. for theoretical computations); and National Natural Science Foundation of China project numbers 51525102, 51390475, and 51371102 (R.Y. for STEM studies). The Advanced Light Source is supported by the Office of Science, Office of Basic Energy Sciences, of DOE under contract DE-AC02-05CH11231. We thank M. A. Marcus for support during the acquisition of MS data and C. Wu for help oath EXAFS data analysis. The aberration-corrected TEM results were achieved (in part) using Titan 80-300 and JEM-ARM 200F. In this work we used the resources of the National Center for Electron Microscopy in Beijing. A patent application on this subject has been filed [UC case no. 2017-108-1-LA (102352-0512)]. NR 35 TC 5 Z9 5 U1 167 U2 167 PU AMER ASSOC ADVANCEMENT SCIENCE PI WASHINGTON PA 1200 NEW YORK AVE, NW, WASHINGTON, DC 20005 USA SN 0036-8075 EI 1095-9203 J9 SCIENCE JI Science PD DEC 16 PY 2016 VL 354 IS 6318 BP 1414 EP 1419 DI 10.1126/science.aaf9050 PG 7 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF3YN UT WOS:000390261300041 PM 27856847 ER PT J AU He, F Maslov, S AF He, Fei Maslov, Sergei TI Pan- and core- network analysis of co-expression genes in a model plant SO SCIENTIFIC REPORTS LA English DT Article ID SCALE-FREE NETWORKS; MICROARRAY DATA; ARABIDOPSIS-THALIANA; FUNCTIONAL MODULES; STRESS-RESPONSE; DNA-DAMAGE; DATA SETS; GENOME; IDENTIFICATION; BIOSYNTHESIS AB Genome-wide gene expression experiments have been performed using the model plant Arabidopsis during the last decade. Some studies involved construction of coexpression networks, a popular technique used to identify groups of co-regulated genes, to infer unknown gene functions. One approach is to construct a single coexpression network by combining multiple expression datasets generated in different labs. We advocate a complementary approach in which we construct a large collection of 134 coexpression networks based on expression datasets reported in individual publications. To this end we reanalyzed public expression data. To describe this collection of networks we introduced concepts of 'pan-network' and 'core-network' representing union and intersection between a sizeable fractions of individual networks, respectively. We showed that these two types of networks are different both in terms of their topology and biological function of interacting genes. For example, the modules of the pan-network are enriched in regulatory and signaling functions, while the modules of the core-network tend to include components of large macromolecular complexes such as ribosomes and photosynthetic machinery. Our analysis is aimed to help the plant research community to better explore the information contained within the existing vast collection of gene expression data in Arabidopsis. C1 [He, Fei; Maslov, Sergei] Brookhaven Natl Lab, Dept Biol, Upton, NY 11973 USA. [Maslov, Sergei] Univ Illinois, Dept Bioengn, Urbana, IL 61801 USA. [Maslov, Sergei] Univ Illinois, Carl R Woese Inst Genom Biol, Urbana, IL 61801 USA. [Maslov, Sergei] Univ Illinois, Natl Ctr Supercomp Applicat, Urbana, IL 61801 USA. RP He, F; Maslov, S (reprint author), Brookhaven Natl Lab, Dept Biol, Upton, NY 11973 USA.; Maslov, S (reprint author), Univ Illinois, Dept Bioengn, Urbana, IL 61801 USA.; Maslov, S (reprint author), Univ Illinois, Carl R Woese Inst Genom Biol, Urbana, IL 61801 USA.; Maslov, S (reprint author), Univ Illinois, Natl Ctr Supercomp Applicat, Urbana, IL 61801 USA. EM plane83@gmail.com; maslov@illinois.edu OI He, Fei/0000-0002-1165-3248 FU Office of Biological Research of the U.S. Department of Energy [PM-031] FX We thank Shinjae Yoo, Daifeng Wang, Mark Gerstein, Sunita Kumari and Doreen Ware for helpful discussions. We also appreciate editing provided by Claudia Lutz from the University of Illinois at Urbana-Champaign. This work was supported by grants PM-031 from the Office of Biological Research of the U.S. Department of Energy. NR 71 TC 0 Z9 0 U1 10 U2 10 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 16 PY 2016 VL 6 AR 38956 DI 10.1038/srep38956 PG 11 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE8NI UT WOS:000389882300001 PM 27982071 ER PT J AU Ben-Naim, E Krapivsky, PL AF Ben-Naim, E. Krapivsky, P. L. TI Escape and finite-size scaling in diffusion-controlled annihilation SO Journal of Physics A-Mathematical and Theoretical LA English DT Article DE reaction kinetics; finite-size scaling; reaction-diffusion processes; stochastic processes ID ONE-DIMENSION; KINETICS; SYSTEMS AB We study diffusion-controlled single-species annihilation with a finite number of particles. In this reaction-diffusion process, each particle undergoes ordinary diffusion, and when two particles meet, they annihilate. We focus on spatial dimensions d > 2 where a finite number of particles typically survive the annihilation process. Using scaling techniques we investigate the average number of surviving particles, M, as a function of the initial number of particles, N. In three dimensions, for instance, we find the scaling law M similar to N-1/3 in the asymptotic regime N >> 1. We show that two time scales govern the reaction kinetics: the diffusion time scale, T similar to N-2/3, and the escape time scale, tau similar to N-4/3. The vast majority of annihilation events occur on the diffusion time scale, while no annihilation events occur beyond the escape time scale. C1 [Ben-Naim, E.] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. [Ben-Naim, E.] Los Alamos Natl Lab, Ctr Nonlinear Studies, Los Alamos, NM 87545 USA. [Krapivsky, P. L.] Boston Univ, Dept Phys, Boston, MA 02215 USA. RP Ben-Naim, E (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA.; Ben-Naim, E (reprint author), Los Alamos Natl Lab, Ctr Nonlinear Studies, Los Alamos, NM 87545 USA. EM ebn@lanl.gov RI Krapivsky, Pavel/A-4612-2014; Ben-Naim, Eli/C-7542-2009 OI Ben-Naim, Eli/0000-0002-2444-7304 FU US-DOE grant [DE-AC52-06NA25396] FX We are indebted to Nadav Shnerb for useful discussions and we acknowledge support from US-DOE grant DE-AC52-06NA25396 (EB). NR 37 TC 1 Z9 1 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1751-8113 EI 1751-8121 J9 J PHYS A-MATH THEOR JI J. Phys. A-Math. Theor. PD DEC 16 PY 2016 VL 49 IS 50 AR 504004 DI 10.1088/1751-8113/49/50/504004 PG 9 WC Physics, Multidisciplinary; Physics, Mathematical SC Physics GA ED9FN UT WOS:000389175700001 ER PT J AU Seol, D Jesse, S Park, SJ Lee, W Kalinin, SV Kim, Y AF Seol, Daehee Jesse, Stephen Park, Sang-Joon Lee, Woo Kalinin, Sergei V. Kim, Yunseok TI Nanosculpting of complex oxides by massive ionic transfer SO NANOTECHNOLOGY LA English DT Article DE atomic force microscopy; nanosculpting; electrochemical phenomena; oxides ID FERROELECTRIC THIN-FILMS; DIP-PEN NANOLITHOGRAPHY; ELECTROCHEMICAL PHENOMENA; MICROSCOPY; CONDUCTION; SURFACE AB Scanning probe microscopy (SPM)-based approaches have been extensively studied as methods to control the structure and properties of materials on the nanoscale. In many cases, the SPM probe is physically utilized to control structure and properties. In addition to physical modulation, it has been reported that voltage can be effectively used to modulate electrochemical phenomena on the sample surface. These studies suggest that electrochemical modulation of the structure and properties is possible by applying a voltage. Herein, in order to demonstrate voltage induced modulation of surface structure, we explored surface nanosculpting by creating electrochemically induced pits on the surface of TiO2 thin films through the application of voltage using the atomic force microscope tip. Using a unipolar negative voltage sweep, pits were successfully generated. Further, the electric potential distribution was simulated to unravel the relationship between the pit volume and the magnitude of the applied voltage. Finally, surface protrusion induced by positive voltage sweep was also observed to elucidate the complete process of electrochemically induced surface modulation. These results can offer fundamental information for understanding how surface structure can be modulated by electrochemical phenomena. C1 [Seol, Daehee; Kim, Yunseok] Sungkyunkwan Univ SKKU, Sch Adv Mat Sci & Engn, Suwon 440746, Gyeonggi Do, South Korea. [Jesse, Stephen; Kalinin, Sergei V.; Kim, Yunseok] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Park, Sang-Joon; Lee, Woo] KRISS, Daejeon 305340, South Korea. RP Kim, Y (reprint author), Sungkyunkwan Univ SKKU, Sch Adv Mat Sci & Engn, Suwon 440746, Gyeonggi Do, South Korea.; Kalinin, SV; Kim, Y (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. EM sergei2@ornl.gov; yunseokkim@skku.edu FU Basic Science Research Program through the National Research Foundation of Korea (NRF) - Ministry of Science, ICT & Future Planning [NRF-2014R1A1A1008061, NRF-2014R1A4A1008474] FX This research was supported by Basic Science Research Program through the National Research Foundation of Korea (NRF) funded by the Ministry of Science, ICT & Future Planning (NRF-2014R1A1A1008061 and NRF-2014R1A4A1008474). A portion of this research was conducted at the Center for Nanophase Materials Sciences (SJ, SK, YK), which is a DOE Office of Science User Facility. NR 27 TC 0 Z9 0 U1 6 U2 6 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0957-4484 EI 1361-6528 J9 NANOTECHNOLOGY JI Nanotechnology PD DEC 16 PY 2016 VL 27 IS 50 AR 505703 DI 10.1088/0957-4484/27/50/505703 PG 6 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied SC Science & Technology - Other Topics; Materials Science; Physics GA ED4JF UT WOS:000388813200001 PM 27861168 ER PT J AU McCorkle, EP Berhe, AA Hunsaker, CT Johnson, DW McFarlane, KJ Fogel, ML Hart, SC AF McCorkle, Emma P. Berhe, Asmeret Asefaw Hunsaker, Carolyn T. Johnson, Dale W. McFarlane, Karis J. Fogel, Marilyn L. Hart, Stephen C. TI Tracing the source of soil organic matter eroded from temperate forest catchments using carbon and nitrogen isotopes SO CHEMICAL GEOLOGY LA English DT Article; Proceedings Paper CT Fall AGU Conference on Deciphering Isotope Signatures of Earth Surface and Critical Zone Processes CY DEC, 2014 CL San Francisco, CA SP AGU DE Erosion; Radiocarbon; Sediment sources; Sierra Nevada; Soil organic matter; Stable isotopes ID SIERRA-NEVADA; EROSION; CYCLE; DEPOSITION; RADIOCARBON; LAND; SEDIMENTATION; REPLACEMENT; DEGRADATION; PERSISTENCE AB Soil erosion continuously redistributes soil and associated soil organic matter (SOM) on the Earth's surface, with important implications for biogeochemical cycling of essential elements and terrestrial carbon sequestration. Despite the importance of soil erosion, surprisingly few studies have evaluated the sources of eroded carbon (C). We used natural abundance levels of the stable and radioactive isotopes of C (C-13 and C-14) and stable isotope of nitrogen (N-15) to elucidate the origins of SOM eroded from low-order catchments along the western slopes of the Sierra Nevada of California, USA. Our work was conducted in two relatively undisturbed catchments (low elevation = 1800 m, and high elevation = 2300 m) of the Kings River Experimental Watersheds (KREW) in the Sierra National Forest. Sediment captured in basins at the outlet of each gauged watershed were compared to possible source materials, which included: upland surficial organic horizons (i.e., forest floor) and mineral soils (0-0.6 m) from three landform positions (i.e., crest, backslope, and toeslope), stream bank soils (0-0.6 m), and stream-bed materials (0-0.05 m). We found that most of the organic matter (OM) in the captured sediments was composed of O-horizon material that had high C concentrations. Radiocarbon analyses also showed that the captured OM is composed of modern (post-1950) C, with fraction modern values at or above 1.0. Our results suggest that surface (sheet) erosion, as opposed to channeling through established streams and episodic mass wasting events, is likely the largest source of sediment exported out of these minimally disturbed, headwater catchments. The erosional export of sediment with a high concentration of C, especially in the form of relatively undecomposed litter from the O horizon, suggests that a large fraction of the exported C is likely to be decomposed during or after erosion; hence, it is unlikely that soil erosion acts as a significant net sink for atmospheric CO2 in these low-order, temperate forest catchments. (C) 2016 Elsevier B.V. All rights reserved. C1 [McCorkle, Emma P.] Univ Calif, Environm Syst Grad Grp, Merced, CA USA. [Berhe, Asmeret Asefaw; Fogel, Marilyn L.; Hart, Stephen C.] Univ Calif, Life & Environm Sci, Merced, CA USA. [Berhe, Asmeret Asefaw; Fogel, Marilyn L.; Hart, Stephen C.] Univ Calif, Sierra Nevada Res Inst, Merced, CA USA. [Hunsaker, Carolyn T.] US Forest Serv, Pacific Southwest Res Stn, USDA, Fresno, CA USA. [Johnson, Dale W.] Univ Nevada, Dept Nat Resources & Environm Sci, Reno, NV 89557 USA. [McFarlane, Karis J.] Lawrence Livermore Natl Lab, Ctr Accelerator Mass Spectrometry, Livermore, CA USA. RP McCorkle, EP (reprint author), Idaho State Univ, Reynolds Creek Crit Zone Observ, Pocatello, ID 83209 USA. EM mccoemma@isu.edu OI McFarlane, Karis/0000-0001-6390-7863 NR 73 TC 0 Z9 0 U1 20 U2 20 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0009-2541 EI 1878-5999 J9 CHEM GEOL JI Chem. Geol. PD DEC 16 PY 2016 VL 445 BP 172 EP 184 DI 10.1016/j.chemgeo.2016.04.025 PG 13 WC Geochemistry & Geophysics SC Geochemistry & Geophysics GA ED8AC UT WOS:000389093100014 ER PT J AU Maccarini, M Watkins, EB Stidder, B Alcaraz, JP Cornell, BA Martin, DK AF Maccarini, Marco Watkins, Erik B. Stidder, Barry Alcaraz, Jean-Pierre Cornell, Bruce A. Martin, Donald K. TI Nanostructural determination of a lipid bilayer tethered to a gold substrate SO EUROPEAN PHYSICAL JOURNAL E LA English DT Article ID SPECULAR REFLECTION; MEMBRANES; SCATTERING; PHASE; NANOPARTICLES; TEMPERATURE; NEUTRONS; SURFACES; DENSITY; ANCHOR AB Tethered lipid bilayer membranes (tBLM) are planar membranes composed of free lipids and molecules tethered to a solid planar substrate providing a useful model of biological membranes for a wide range of biophysical studies and biotechnological applications. The properties of the tBLM depend on the free lipids and on the chemistry of the tethering molecules. We present a nanoscale characterization of a tBLM composed of deuterated 1,2-dimyristoyl-sn-glycero-3-phosphocholine (d-DMPC) free lipids, benzyl disulfide undecaethylene glycol phytanol (DLP) tethering molecules, and benzyl disulfiide tetraethylene glycol polar spacer molecules (PSM) used to control the areal density of tethering molecules through coadsorption. The use of selected isotopic substitution provides a way to distinguish the conformation and location of the tethered lipids from the free lipids and to elucidate how the two components influence the structure of the tBLM. These findings provide useful information to optimise the insertion of transmembrane proteins into the tethered bilayer system. C1 [Maccarini, Marco; Stidder, Barry; Alcaraz, Jean-Pierre; Martin, Donald K.] Univ Grenoble Alpes, TIMC IMAG UMR 5525, Grenoble, France. [Watkins, Erik B.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Cornell, Bruce A.] SDx Tethered Membranes Pty Ltd U6 30 32, Barcoo St, Roseville, NSW 2069, Australia. RP Maccarini, M (reprint author), Univ Grenoble Alpes, TIMC IMAG UMR 5525, Grenoble, France. EM marco.maccarini@imag.fr OI Maccarini, Marco/0000-0002-4555-3288 NR 37 TC 0 Z9 0 U1 1 U2 1 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1292-8941 EI 1292-895X J9 EUR PHYS J E JI Eur. Phys. J. E PD DEC 15 PY 2016 VL 39 IS 12 AR 123 DI 10.1140/epje/i2016-16123-5 PG 8 WC Chemistry, Physical; Materials Science, Multidisciplinary; Physics, Applied; Polymer Science SC Chemistry; Materials Science; Physics; Polymer Science GA EP3ZC UT WOS:000397319200001 PM 27966072 ER PT J AU Yang, H Gao, P Rajashankar, KR Patel, DJ AF Yang, Hui Gao, Pu Rajashankar, Kanagalaghatta R. Patel, Dinshaw J. TI PAM-Dependent Target DNA Recognition and Cleavage by C2c1 CRISPR-Cas Endonuclease SO CELL LA English DT Article ID GUIDED SURVEILLANCE COMPLEX; CRYSTAL-STRUCTURE; BACTERIAL IMMUNITY; RNA; SYSTEMS; CPF1; RESISTANCE; CLASSIFICATION AB C2c1 is a newly identified guide RNA-mediated type V-B CRISPR-Cas endonuclease that site-specifically targets and cleaves both strands of target DNA. We have determined crystal structures of Alicyclo-bacillus acidoterrestris C2c1 (AacC2c1) bound to sgRNA as a binary complex and to target DNAs as ternary complexes, thereby capturing catalytically competent conformations of AacC2c1 with both target and non-target DNA strands independently positioned within a single RuvC catalytic pocket. Moreover, C2c1-mediated cleavage results in a staggered seven-nucleotide break of target DNA. crRNA adopts a pre-ordered five-nucleotide A-form seed sequence in the binary complex, with release of an inserted tryptophan, facilitating zippering up of 20-bp guide RNA: target DNA heteroduplex on ternary complex formation. Notably, the PAM-interacting cleft adopts a "locked'' conformation on ternary complex formation. Structural comparison of C2c1 ternary complexes with their Cas9 and Cpf1 counterparts highlights the diverse mechanisms adopted by these distinct CRISPR-Cas systems, thereby broadening and enhancing their applicability as genome editing tools. C1 [Yang, Hui; Gao, Pu; Patel, Dinshaw J.] Mem Sloan Kettering Canc Ctr, Structurel Biol Program, New York, NY 10065 USA. [Gao, Pu] Chinese Acad Sci, Inst Biophys, CAS Ctr Excellence Biomacromol, Key Lab Infect & Immun, Beijing 100101, Peoples R China. [Rajashankar, Kanagalaghatta R.] Cornell Univ, Dept Chem & Chem Biol, Ithaca, NY 14853 USA. [Rajashankar, Kanagalaghatta R.] Argonne Natl Lab, NE CAT, Adv Photon Source, Argonne, IL 60349 USA. RP Yang, H; Patel, DJ (reprint author), Mem Sloan Kettering Canc Ctr, Structurel Biol Program, New York, NY 10065 USA. EM yangh3@mskcc.org; pateld@mskcc.org FU NIGMS [P41 GM103403]; U.S. Department of Energy [DE-AC02-06CH11357]; NIHORIP HEI grant [S10 RR029205]; NIH [GM104962]; Memorial Sloan Kettering Cancer Center Core Grant [P30CA008748]; Cancer Research Institute Irvington Postdoctoral Fellowship; Institute of Biophysics, Beijing, China FX Wethank Satoko Ishibi-Murakami for technical assistance in generation of C2c1 mutants. X-ray diffraction studies were conducted at the Advanced Photon Source on the Northeastern Collaborative Access Team beamlines, which are supported by NIGMS grant P41 GM103403 and U.S. Department of Energy grant DE-AC02-06CH11357. The Pilatus 6M detector on 24-ID-C beam line is funded by a NIHORIP HEI grant (S10 RR029205). The research was supported by NIH grant GM104962 to D.J.P., the Memorial Sloan Kettering Cancer Center Core Grant (P30CA008748), Cancer Research Institute Irvington Postdoctoral Fellowship, and start-up funds from the Institute of Biophysics, Beijing, China to P.G. NR 34 TC 3 Z9 3 U1 9 U2 9 PU CELL PRESS PI CAMBRIDGE PA 600 TECHNOLOGY SQUARE, 5TH FLOOR, CAMBRIDGE, MA 02139 USA SN 0092-8674 EI 1097-4172 J9 CELL JI Cell PD DEC 15 PY 2016 VL 167 IS 7 BP 1814 EP + DI 10.1016/j.cell.2016.11.053 PG 27 WC Biochemistry & Molecular Biology; Cell Biology SC Biochemistry & Molecular Biology; Cell Biology GA EJ3LW UT WOS:000393114700019 PM 27984729 ER PT J AU Sun, N Yearsley, J Baptiste, M Cao, Q Lettenmaier, DP Nijssen, B AF Sun, Ning Yearsley, John Baptiste, Marisa Cao, Qian Lettenmaier, Dennis P. Nijssen, Bart TI A spatially distributed model for assessment of the effects of changing land use and climate on urban stream quality SO HYDROLOGICAL PROCESSES LA English DT Article DE stream water quality; land use change; climate change; non-point source pollution ID SOIL-VEGETATION MODEL; SURFACE-WATER QUALITY; PUGET-SOUND BASIN; UNITED-STATES; IMPACTS; HYDROLOGY; PREDICTION; SYSTEM; COVER; AREAS AB While the effects of land use change in urban areas have been widely examined, the combined effects of climate and land use change on the quality of urban and urbanizing streams have received much less attention. We describe a modelling framework that is applicable to the evaluation of potential changes in urban water quality and associated hydrologic changes in response to ongoing climate and landscape alteration. The grid-based spatially distributed model, Distributed Hydrology Soil Vegetation Model-Water Quality (DHSVM-WQ), is an outgrowth of DHSVM that incorporates modules for assessing hydrology and water quality in urbanized watersheds at a high-spatial and high-temporal resolution. DHSVM-WQ simulates surface run-off quality and in-stream processes that control the transport of non-point source pollutants into urban streams. We configure DHSVM-WQ for three partially urbanized catchments in the Puget Sound region to evaluate the water quality responses to current conditions and projected changes in climate and/or land use over the next century. Here, we focus on total suspended solids (TSS) and total phosphorus (TP) from non-point sources (run-off), as well as stream temperature. The projection of future land use is characterized by a combination of densification in existing urban or partially urban areas and expansion of the urban footprint. The climate change scenarios consist of individual and concurrent changes in temperature and precipitation. Future precipitation is projected to increase in winter and decrease in summer, while future temperature is projected to increase throughout the year. Our results show that urbanization has a much greater effect than climate change on both the magnitude and seasonal variability of streamflow, TSS and TP loads largely because of substantially increased streamflow and particularly winter flow peaks. Water temperature is more sensitive to climate warming scenarios than to urbanization and precipitation changes. Future urbanization and climate change together are predicted to significantly increase annual mean streamflow (up to 55%), water temperature (up to 1.9 degrees C), TSS load (up to 182%) and TP load (up to 74%). Copyright (C) 2016 John Wiley & Sons, Ltd. C1 [Sun, Ning; Yearsley, John; Baptiste, Marisa; Nijssen, Bart] Univ Washington, Dept Civil & Environm Engn, Seattle, WA 98195 USA. [Sun, Ning] Pacific Northwest Natl Lab, Richland, WA USA. [Cao, Qian; Lettenmaier, Dennis P.] Univ Calif Los Angeles, Dept Geog, Los Angeles, CA 90024 USA. RP Nijssen, B (reprint author), Univ Washington, Dept Civil & Environm Engn, Seattle, WA 98195 USA. EM nijssen@uw.edu FU US Environmental Protection Agency [R835195]; Northwest Climate Science Center (NW CSC) US Geological Survey [G11AC20256]; Climate Impact Research Consortium partners at the University of Idaho; Oregon State University FX This research was funded in part by US Environmental Protection Agency Science to Achieve Results (STAR) grant no. R835195 to the University of Washington. The authors gratefully acknowledge the assistance of the Hydrologic Services Group of King County, the Utilities Department of the City of Bellevue and the US Geological Survey that provided observations used herein. Climate scenarios were developed under Northwest Climate Science Center (NW CSC) US Geological Survey grant no. G11AC20256 in collaboration with Climate Impact Research Consortium partners at the University of Idaho and Oregon State University. NR 60 TC 0 Z9 0 U1 14 U2 14 PU WILEY-BLACKWELL PI HOBOKEN PA 111 RIVER ST, HOBOKEN 07030-5774, NJ USA SN 0885-6087 EI 1099-1085 J9 HYDROL PROCESS JI Hydrol. Process. PD DEC 15 PY 2016 VL 30 IS 25 BP 4779 EP 4798 DI 10.1002/hyp.10964 PG 20 WC Water Resources SC Water Resources GA EJ2HK UT WOS:000393030500008 ER PT J AU Young, ID Ibrahim, M Chatterjee, R Gul, S Fuller, FD Koroidov, S Brewster, AS Tran, R Alonso-Mori, R Kroll, T Michels-Clark, T Laksmono, H Sierra, RG Stan, CA Hussein, R Zhang, M Douthit, L Kubin, M de Lichtenberg, C Pham, LV Nilsson, H Cheah, MH Shevela, D Saracini, C Bean, MA Seuffert, I Sokaras, D Weng, TC Pastor, E Weninger, C Fransson, T Lassalle, L Brauer, P Aller, P Docker, PT Andi, B Orville, AM Glownia, JM Nelson, S Sikorski, M Zhu, DL Hunter, MS Lane, TJ Aquila, A Koglin, JE Robinson, J Liang, MN Boutet, S Lyubimov, AY Uervirojnangkoorn, M Moriarty, NW Liebschner, D Afonine, PV Waterman, DG Evans, G Wernet, P Dobbek, H Weis, WI Brunger, AT Zwart, PH Adams, PD Zouni, A Messinger, J Bergmann, U Sauter, NK Kern, J Yachandra, VK Yano, J AF Young, Iris D. Ibrahim, Mohamed Chatterjee, Ruchira Gul, Sheraz Fuller, Franklin D. Koroidov, Sergey Brewster, Aaron S. Tran, Rosalie Alonso-Mori, Roberto Kroll, Thomas Michels-Clark, Tara Laksmono, Hartawan Sierra, Raymond G. Stan, Claudiu A. Hussein, Rana Zhang, Miao Douthit, Lacey Kubin, Markus de Lichtenberg, Casper Long Vo Pham Nilsson, Hakan Cheah, Mun Hon Shevela, Dmitriy Saracini, Claudio Bean, Mackenzie A. Seuffert, Ina Sokaras, Dimosthenis Weng, Tsu-Chien Pastor, Ernest Weninger, Clemens Fransson, Thomas Lassalle, Louise Braeuer, Philipp Aller, Pierre Docker, Peter T. Andi, Babak Orville, Allen M. Glownia, James M. Nelson, Silke Sikorski, Marcin Zhu, Diling Hunter, Mark S. Lane, Thomas J. Aquila, Andy Koglin, Jason E. Robinson, Joseph Liang, Mengning Boutet, Sebastien Lyubimov, Artem Y. Uervirojnangkoorn, Monarin Moriarty, Nigel W. Liebschner, Dorothee Afonine, Pavel V. Waterman, David G. Evans, Gwyndaf Wernet, Philippe Dobbek, Holger Weis, William I. Brunger, Axel T. Zwart, Petrus H. Adams, Paul D. Zouni, Athina Messinger, Johannes Bergmann, Uwe Sauter, Nicholas K. Kern, Jan Yachandra, Vittal K. Yano, Junko TI Structure of photosystem II and substrate binding at room temperature SO NATURE LA English DT Article ID OXYGEN-EVOLVING COMPLEX; PHOTOSYNTHETIC WATER OXIDATION; COHERENT-LIGHT SOURCE; O BOND FORMATION; AMMONIA BINDS; S-2 STATE; O-2-EVOLVING COMPLEX; DIFFRACTION; MANGANESE; SPECTROSCOPY AB Light-induced oxidation of water by photosystem II (PS II) in plants, algae and cyanobacteria has generated most of the dioxygen in the atmosphere. PS II, a membrane-bound multi-subunit pigment protein complex, couples the one-electron photochemistry at the reaction centre with the four-electron redox chemistry of water oxidation at the Mn4CaO5 cluster in the oxygen-evolving complex (OEC). Under illumination, the OEC cycles through five intermediate S-states (S-0 to S-4)(1), in which S-1 is the dark-stable state and S-3 is the last semi-stable state before O-O bond formation and O-2 evolution(2,3). A detailed understanding of the O-O bond formation mechanism remains a challenge, and will require elucidation of both the structures of the OEC in the different S-states and the binding of the two substrate waters to the catalytic site(4-6). Here we report the use of femtosecond pulses from an X-ray free electron laser (XFEL) to obtain damage-free, room temperature structures of dark-adapted (S-1), two-flash illuminated (2F; S-3-enriched), and ammonia-bound two-flash illuminated (2F-NH3; S-3-enriched) PS II. Although the recent 1.95 angstrom resolution structure of PS II at cryogenic temperature using an XFEL7 provided a damage-free view of the S-1 state, measurements at room temperature are required to study the structural landscape of proteins under functional conditions(8,9), and also for in situ advancement of the S-states. To investigate the water-binding site(s), ammonia, a water analogue, has been used as a marker, as it binds to the Mn4CaO5 cluster in the S-2 and S-3 states(10). Since the ammonia-bound OEC is active, the ammonia-binding Mn site is not a substrate water site(10-13). This approach, together with a comparison of the native dark and 2F states, is used to discriminate between proposed O-O bond formation mechanisms. C1 [Young, Iris D.; Chatterjee, Ruchira; Gul, Sheraz; Fuller, Franklin D.; Brewster, Aaron S.; Tran, Rosalie; Michels-Clark, Tara; Douthit, Lacey; Saracini, Claudio; Bean, Mackenzie A.; Pastor, Ernest; Lassalle, Louise; Moriarty, Nigel W.; Liebschner, Dorothee; Afonine, Pavel V.; Zwart, Petrus H.; Sauter, Nicholas K.; Yachandra, Vittal K.; Yano, Junko] Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Bioimaging Div, Berkeley, CA 94720 USA. [Ibrahim, Mohamed; Hussein, Rana; Zhang, Miao; Seuffert, Ina; Dobbek, Holger; Zouni, Athina] Humboldt Univ, Inst Biol, D-10099 Berlin, Germany. [Koroidov, Sergey; de Lichtenberg, Casper; Long Vo Pham; Nilsson, Hakan; Cheah, Mun Hon; Shevela, Dmitriy; Messinger, Johannes] Umea Univ, Inst Kemi, Kemiskt Biol Ctr, S-90187 Umea, Sweden. [Alonso-Mori, Roberto; Sierra, Raymond G.; Glownia, James M.; Nelson, Silke; Sikorski, Marcin; Zhu, Diling; Hunter, Mark S.; Lane, Thomas J.; Aquila, Andy; Koglin, Jason E.; Robinson, Joseph; Liang, Mengning; Boutet, Sebastien; Kern, Jan] SLAC Natl Accelerator Lab, LCLS, Menlo Pk, CA 94025 USA. [Kroll, Thomas; Laksmono, Hartawan; Sierra, Raymond G.; Stan, Claudiu A.; Weninger, Clemens; Fransson, Thomas; Bergmann, Uwe] SLAC Natl Accelerator Lab, Stanford PULSE Inst, Menlo Pk, CA 94025 USA. [Kroll, Thomas; Sokaras, Dimosthenis; Weng, Tsu-Chien] SLAC Natl Accelerator Lab, SSRL, Menlo Pk, CA 94025 USA. [Kubin, Markus; Wernet, Philippe] Helmholtz Zentrum, Inst Methods & Instrumentat Synchrotron Radiat Re, D-14109 Berlin, Germany. [Braeuer, Philipp] Univ Oxford, Dept Biochem, S Parks Rd, Oxford OX1 3QU, England. [Braeuer, Philipp; Aller, Pierre; Docker, Peter T.; Orville, Allen M.; Evans, Gwyndaf] Diamond Light Source Ltd, Harwell Sci & Innovat Campus, Didcot OX11 0DE, Oxon, England. [Andi, Babak] Brookhaven Natl Lab, Natl Synchrotron Light Source 2, Upton, NY 11973 USA. [Lyubimov, Artem Y.; Uervirojnangkoorn, Monarin; Weis, William I.; Brunger, Axel T.] Stanford Univ, Dept Mol & Cellular Physiol, Stanford, CA 94305 USA. [Lyubimov, Artem Y.; Uervirojnangkoorn, Monarin; Brunger, Axel T.] Stanford Univ, Howard Hughes Med Inst, Stanford, CA 94305 USA. [Waterman, David G.] STFC Rutherford Appleton Lab, Didcot OX11 0QX, Oxon, England. [Waterman, David G.] Rutherford Appleton Lab, CCP4,Res Complex Harwell, Didcot OX11 0FA, Oxon, England. [Weis, William I.; Brunger, Axel T.] Stanford Univ, Dept Photon Sci, Stanford, CA 94305 USA. [Weis, William I.; Brunger, Axel T.] Stanford Univ, Dept Struct Biol, Stanford, CA 94305 USA. [Adams, Paul D.] Univ Calif Berkeley, Dept Bioengn, Berkeley, CA 94720 USA. [Messinger, Johannes] Uppsala Univ, Mol Biomimet, Dept Chem, Angstrom, SE-75237 Uppsala, Sweden. [Weng, Tsu-Chien] Ctr High Pressure Sci & Technol Adv Res, Shanghai 201203, Peoples R China. RP Yachandra, VK; Yano, J (reprint author), Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Bioimaging Div, Berkeley, CA 94720 USA.; Zouni, A (reprint author), Humboldt Univ, Inst Biol, D-10099 Berlin, Germany.; Messinger, J (reprint author), Umea Univ, Inst Kemi, Kemiskt Biol Ctr, S-90187 Umea, Sweden.; Messinger, J (reprint author), Uppsala Univ, Mol Biomimet, Dept Chem, Angstrom, SE-75237 Uppsala, Sweden. EM athina.zouni@hu-berlin.de; johannes.messinger@umu.se; johannes.messinger@umu.se; vkyachandra@lbl.gov; jyano@lbl.gov RI Kroll, Thomas/D-3636-2009; OI Evans, Gwyndaf/0000-0002-6079-2201 FU National Institutes of Health (NIH) [GM055302, GM110501, GM102520, GM117126]; Ruth L. Kirschstein National Research Service Award [GM116423-02]; Human Frontiers Science Project [RGP0063/2013 310]; DFG-Cluster of Excellence "UniCat"; Humboldt Universitat Berlin [Sfb1078]; Solar Fuels Strong Research Environment (Umea University); Artificial Leaf Project (K&A Wallenberg Foundation) [2011.0055]; Energimyndigheten [36648-1]; US DOE, OBES, CSGB Division; HHMI; Office of Science, DOE [DE-AC02-5CH11231]; BNL/US DOE, LDRD [11-008]; NIH/NCRR [2-P41-RR012408]; NIH/NIGMS [8P41GM103473-16, P41GM111244]; US DOE, OBER [FWP BO-70]; Diamond Light Source; Wellcome Trust; Biotechnology and Biological Sciences Research Council [102593]; DOE OBES [DE-AC02-05CH11231, DE-AC02-76SF00515]; DOE OBER; NIH [P41GM103393]; US DOE, Office of Science, OBES [DE-AC02-76SF00515]; [TP A5] FX This work was supported by the Director, Office of Science, Office of Basic Energy Sciences (OBES), Division of Chemical Sciences, Geosciences, and Biosciences (CSGB) of the Department of Energy (DOE) (J.Y., V.K.Y.) for X-ray methodology and instrumentation; National Institutes of Health (NIH) grants GM055302 (V.K.Y.) for PS II biochemistry, structure and mechanism, GM110501 (J.Y.) for instrumentation development for XFEL experiments, GM102520 and GM117126 (N.K.S.) for development of computational protocols for XFEL data; the Ruth L. Kirschstein National Research Service Award (GM116423-02, F.D.F.); and the Human Frontiers Science Project Award No. RGP0063/2013 310 (J.Y., U.B., P.W., A.Z.). The DFG-Cluster of Excellence "UniCat" coordinated by T.U. Berlin and Sfb1078 (Humboldt Universitat Berlin), TP A5 (A.Z., H.D.), the Solar Fuels Strong Research Environment (Umea University), the Artificial Leaf Project (K&A Wallenberg Foundation 2011.0055) and Energimyndigheten (36648-1) (J.M.) are acknowledged for support. H.L. and C.A.S. acknowledge support from the US DOE, OBES, CSGB Division. W.I.W. and A.T.B. acknowledge support from an HHMI Collaborative Innovation Award. D.G.W. is funded by industrial income received by CCP4. This research used resources of NERSC, a User Facility supported by the Office of Science, DOE, under Contract No. DE-AC02-5CH11231. Portions of this work were supported by a BNL/US DOE, LDRD grant (11-008; A.M.O.); and NIH/NCRR grant 2-P41-RR012408, NIH/NIGMS grants 8P41GM103473-16 and P41GM111244 and the US DOE, OBER grant FWP BO-70 (A.M.O., B.A.). A.M.O and P.T.D were supported in part by the Diamond Light Source, and A.M.O acknowledges support from a Strategic Award from the Wellcome Trust and the Biotechnology and Biological Sciences Research Council (grant 102593). P.B. was supported by a Wellcome Trust DPhil studentship. Testing of crystals and various parts of the setup were carried out at synchrotron facilities that were provided by the Advanced Light Source (ALS) in Berkeley and Stanford Synchrotron Radiation Lightsource (SSRL) in Stanford, funded by DOE OBES under contract DE-AC02-05CH11231 (ALS) and DE-AC02-76SF00515 (SSRL). The SSRL Structural Molecular Biology Program is supported by the DOE OBER and by the NIH (P41GM103393). Use of the LCLS and SSRL, SLAC National Accelerator Laboratory, is supported by the US DOE, Office of Science, OBES under Contract No. DE-AC02-76SF00515. We thank M. Bommer for discussions and help regarding structure refinement, crystallographic model building and validation, J. Hattne for his contributions to the development of XFEL diffraction data processing, A. Boussac for discussions on ammonia binding and his contributions to the substrate water exchange measurements of the S3 state in the presence of ammonia, and the previous CXI beamline scientist, G. Williams, for his support during the initial stages of this project. We thank the support staff at LCLS/SLAC and at SSRL (BL 6-2, 7-3) and ALS (BL 5.01, 5.0.2, 8.2.1). NR 68 TC 5 Z9 5 U1 52 U2 52 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 0028-0836 EI 1476-4687 J9 NATURE JI Nature PD DEC 15 PY 2016 VL 540 IS 7633 BP 453 EP + DI 10.1038/nature20161 PG 22 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6JR UT WOS:000389716800046 PM 27871088 ER PT J AU Kendrick, BK Hazra, J Balakrishnan, N AF Kendrick, B. K. Hazra, Jisha Balakrishnan, N. TI Geometric phase effects in the ultracold D plus HD -> D plus HD and D plus HD <-> H+D-2 reactions SO NEW JOURNAL OF PHYSICS LA English DT Article DE geometric phase; ultracold molecules; ultracold chemistry; quantum interference; atomic and molecular collisions ID STATE TRANSITION-PROBABILITIES; HYDROGEN-EXCHANGE REACTION; POTENTIAL-ENERGY SURFACES; CONICAL INTERSECTION; CHEMICAL-REACTIONS; SCATTERING CALCULATIONS; MOLECULAR-SYSTEMS; H+H-2 REACTION; BOUND-STATES; NONADIABATIC COUPLINGS AB The results of accurate quantum reactive scattering calculations for the D + HD(v = 4, j = 0) -> D + HD (v', j'), D +HD (v = 4, j=0) -> H + D-2 (v', j') and H + D-2 (v = 4, j = 0) -> D + HD (v', j') reactions are presented for collision energies between 1 mu K and 100 K. The ab initio BKMP2 PES for the ground electronic state of H-3 is used and all values of total angular momentum between J = 0 - 4 are included. The general vector potential approach is used to include the geometric phase. The rotationally resolved, vibrationally resolved, and total reaction rate coefficients are reported as a function of collision energy. Rotationally resolved differential cross sections are also reported as a function of collision energy and scattering angle. Large geometric phase effects appear in the ultracold reaction rate coefficients which result in a significant enhancement or suppression of the rate coefficient (up to 3 orders of magnitude) relative to calculations which ignore the geometric phase. The results are interpreted using a new quantum interference mechanism which is unique to ultracold collisions. Significant effects of the geometric phase also appear in the rotationally resolved differential cross sections which lead to a very different oscillatory structure in both energy and scattering angle. Several shape resonances occur in the 1-10 K energy range and the geometric phase is shown to significantly alter the predicted resonance spectrum. The geometric phase effects and ultracold rate coefficients depend sensitively on the nuclear spin. Thus, experimentalists may be able to control the reaction by the selection of a particular nuclear spin state. C1 [Kendrick, B. K.] Los Alamos Natl Lab, Div Theoret, T-1,MS B221, Los Alamos, NM 87545 USA. [Hazra, Jisha; Balakrishnan, N.] Univ Nevada, Dept Chem, Las Vegas, NV 89154 USA. RP Kendrick, BK (reprint author), Los Alamos Natl Lab, Div Theoret, T-1,MS B221, Los Alamos, NM 87545 USA. EM bkendric@lanl.gov FU US Department of Energy under Laboratory Directed Research and Development Program at Los Alamos National Laboratory [20140309ER]; National Security Administration of the US Department of Energy [DE-AC52-06NA25396]; Army Research Office, MURI [W911NF-12-1-0476]; National Science Foundation [PHY-1505557] FX BKK acknowledges that part of this work was done under the auspices of the US Department of Energy under Project No. 20140309ER of the Laboratory Directed Research and Development Program at Los Alamos National Laboratory. Los Alamos National Laboratory is operated by Los Alamos National Security, LLC, for the National Security Administration of the US Department of Energy under contract DE-AC52-06NA25396. The UNLV team acknowledges support from the Army Research Office, MURI grant No. W911NF-12-1-0476 and the National Science Foundation, grant No. PHY-1505557. NR 132 TC 0 Z9 0 U1 2 U2 2 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1367-2630 J9 NEW J PHYS JI New J. Phys. PD DEC 15 PY 2016 VL 18 AR 123020 DI 10.1088/1367-2630/aa4fd2 PG 23 WC Physics, Multidisciplinary SC Physics GA EH1NP UT WOS:000391533900003 ER PT J AU Larsen, PH LaCommare, KH Eto, JH Sweeney, JL AF Larsen, Peter H. LaCommare, Kristina H. Eto, Joseph H. Sweeney, James L. TI Recent trends in power system reliability and implications for evaluating future investments in resiliency SO ENERGY LA English DT Article DE Electricity reliability; Power interruptions; Severe weather; Major event; Reliability metrics AB This study examines the relationship between annual changes in electricity reliability reported by a large cross-section of U.S. electricity distribution utilities over a period of 13 years and a broad set of potential explanatory variables, including weather and utility characteristics. We find statistically significant correlations between the average number of power interruptions experienced annually and above average wind speeds, precipitation, lightning strikes, and a measure of population density: customers per line mile. We also find significant relationships between the average number of minutes of power interruptions experienced and above average wind speeds, precipitation, cooling degree-days, and one strategy used to mitigate the impacts of severe weather: the amount of underground transmission and distribution line miles. Perhaps most importantly, we find a significant time trend of increasing annual average number of minutes of power interruptions over time-especially when interruptions associated with extreme weather are included. The research method described in this analysis can provide a basis for future efforts to project long-term trends in reliability and the associated benefits of strategies to improve grid resiliency to severe weather-both in the U.S. and abroad. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Larsen, Peter H.; LaCommare, Kristina H.; Eto, Joseph H.] Lawrence Berkeley Natl Lab, Berkeley, CA USA. [Larsen, Peter H.; Sweeney, James L.] Stanford Univ, Stanford, CA 94305 USA. RP Larsen, PH (reprint author), Ernest Orlando Lawrence Berkeley Natl Lab, 1 Cyclotron Rd,MS 90R4000, Berkeley, CA 94720 USA. EM PHLarsen@lbl.gov FU Office of Electricity Delivery and Energy Reliability, National Electricity Delivery Division of the U.S. Department of Energy (DOE) [DEAC02-05CH11231] FX The work described in this report was funded by the Office of Electricity Delivery and Energy Reliability, National Electricity Delivery Division of the U.S. Department of Energy (DOE) under Contract No. DEAC02-05CH11231. NR 44 TC 0 Z9 0 U1 7 U2 7 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0360-5442 EI 1873-6785 J9 ENERGY JI Energy PD DEC 15 PY 2016 VL 117 BP 29 EP 46 DI 10.1016/j.energy.2016.10.063 PN 1 PG 18 WC Thermodynamics; Energy & Fuels SC Thermodynamics; Energy & Fuels GA EG0JP UT WOS:000390719000004 ER PT J AU Di Renzo, V Wohletz, K Civetta, L Moretti, R Orsi, G Gasparini, P AF Di Renzo, Valeria Wohletz, Kenneth Civetta, Lucia Moretti, Roberto Orsi, Giovanni Gasparini, Paolo TI The thermal regime of the Campi Flegrei magmatic system reconstructed through 3D numerical simulations SO JOURNAL OF VOLCANOLOGY AND GEOTHERMAL RESEARCH LA English DT Article DE 3D conductive/convective model; Campi Flegrei caldera; Magmatic system; Eruptive history; Hydrothermal convection ID NEAPOLITAN-YELLOW-TUFF; CAMPANIAN IGNIMBRITE; DEPOSITIONAL PROCESSES; DEFORMATION SOURCES; ERUPTIVE DYNAMICS; VOLCANIC DISTRICT; BLOCK-RESURGENCE; UNREST EPISODES; CALDERA; EVOLUTION AB We illustrate a quantitative conductive/convective thermal model incorporating a wide range of geophysical, petrological, geological, geochemical and isotopical observations that constrain the thermal evolution and present state of the Campi Flegrei caldera (CFc) magmatic system. The proposed model has been computed on the basis of the current knowledge of: (1) the volcanic and magmatic history of the volcano over the last 441 a, (2) its underlying crustal structure, and (3) the physical properties of the erupted magmas. 3D numerical simulations of heat conduction and convection within heterogeneous rock/magma materials with evolving heat sources and boundary conditions that simulate magma rise from a deep (>= 8 km depth) to shallow (2-6 km) reservoirs, magma chamber formation, magma extrusion, caldera collapse, and intra-caldera hydrothermal convection, have been carried out. The evolution of the CFc magmatic system through time has been simulated through different steps related to its changes in terms of depth, location and size of magma reservoirs and their replenishment. The thermal modeling results show that both heat conduction and convection have played an important role in the CFc thermal evolution, although with different timing. The simulated present heat distribution is in agreement with the measured geothermal profiles (Agip, 1987), reproduces the thermal gradient peaks at the CFc margins in correspondence to the anomalies in surface gradients (Corrado et al., 1998), and suggests temperatures of 700 degrees C at depth of 4 km in the central portion of the caldera, in agreement with the estimated temperature for the brittle-ductile transition (Hill, 1992). (C) 2016 Elsevier B.V. All rights reserved. C1 [Di Renzo, Valeria; Moretti, Roberto] Seconda Univ Napoli, Dipartimento Ingn Civile Design Edilizia & Ambien, Via Roma 29, I-81031 Aversa, CE, Italy. [Wohletz, Kenneth] Los Alamos Natl Lab, Earth & Environm Sci, Los Alamos, NM USA. [Civetta, Lucia; Orsi, Giovanni] Univ Napoli Federico II, Dipartimento Sci Terra Ambiente & Risorse, Largo San Marcellino 10, I-80138 Naples, Italy. [Gasparini, Paolo] Anal & Monitoraggio Rischio Ambientale AMRA Ctr S, Via Nuova Agnano,11, I-80125 Naples, Italy. RP Moretti, R (reprint author), Seconda Univ Napoli, Dipartimento Ingn Civile Design Edilizia & Ambien, Via Roma 29, I-81031 Aversa, CE, Italy. EM roberto.moretti@unina2.it OI Moretti, Roberto/0000-0003-2031-5192 FU "Project V1 - Unrest, INGV-DPC''; "PRIN-MIUR'' [2009MCN52R_002] FX This work was funded by "Project V1 - Unrest, INGV-DPC 2007-2009 agreement" awarded to Lucia Civetta and by "PRIN-MIUR 2009, cod. 2009MCN52R_002" awarded to Roberto Moretti. NR 96 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0377-0273 EI 1872-6097 J9 J VOLCANOL GEOTH RES JI J. Volcanol. Geotherm. Res. PD DEC 15 PY 2016 VL 328 BP 210 EP 221 DI 10.1016/j.jvolgeores.2016.11.004 PG 12 WC Geosciences, Multidisciplinary SC Geology GA EG3UH UT WOS:000390969700017 ER PT J AU Ranjan, R Biswal, JK Subramaniam, S Singh, KP Stenfeldt, C Rodriguez, LL Pattnaik, B Arzt, J AF Ranjan, Rajeev Biswal, Jitendra K. Subramaniam, Saravanan Singh, Karam Pal Stenfeldt, Carolina Rodriguez, Luis L. Pattnaik, Bramhadev Arzt, Jonathan TI Foot-and-Mouth Disease Virus-Associated Abortion and Vertical Transmission following Acute Infection in Cattle under Natural Conditions SO PLOS ONE LA English DT Article ID IMMUNODEFICIENCY VIRUS; VIRAL PATHWAYS; TISSUE TROPISM; BOVINE-TISSUES; CARRIER STATE; PATHOGENESIS; LAMBS; HYBRIDIZATION; LOCALIZATION; MYOCARDITIS AB Foot-and-mouth disease (FMD) is a highly contagious and economically important viral disease of cloven-hoofed animals, including domestic and wild host species. During recent FMD outbreaks in India, spontaneous abortions were reported amongst FMD-affected and asymptomatic cows. The current study was an opportunistic investigation of these naturally occurring bovine abortions to assess causality of abortion and vertical transmission of FMDV from infected cows to fetuses. For this purpose, fetal tissue samples of eight abortuses (heart, liver, kidney, spleen, palatine tonsil, umbilical cord, soft palate, tongue, lungs, and submandibular lymph node) were collected and screened by various detection methods, including viral genome detection, virus isolation, and immunomicroscopy. Amongst these cases, gross pathological changes were observed in 3 abortuses. Gross pathological findings included blood-tinged peritoneal and pleural effusions and myocarditis. Hearts of infected calves had mild to moderate degeneration and necrosis of the myocardium with moderate infiltration by mixed inflammatory cells. Localization of FMDV antigen was demonstrated in lungs and soft palate by immunomicroscopy. FMDV serotype O viral genome was recovered from 7 of 8 cases. Infectious FMDV serotype O was rescued by chemical transfection of the total RNA extracted from three soft palate samples and was sequenced to confirm 100% identity of the VP1 (capsid) coding region with isolates collected from infected cattle during the acute phase of infection. Based upon these findings, it may be concluded that FMDV-associated abortion occurred among the infected pregnant cows included within this study and FMDV was subsequently transmitted vertically to fetuses. This is the first documentation of FMDV-associated abortions in cattle. C1 [Ranjan, Rajeev; Biswal, Jitendra K.; Subramaniam, Saravanan; Pattnaik, Bramhadev] ICAR Res Complex, Directorate Foot & Mouth Dis, Naini Tal, Uttarakhand, India. [Singh, Karam Pal] IVRI Izatnagar, CADRAD, Bareilly, Uttar Pradesh, India. [Stenfeldt, Carolina; Rodriguez, Luis L.; Arzt, Jonathan] ARS, Foreign Anim Dis Res Unit, USDA, Plum Isl Anim Dis Ctr, Greenport, NY 11944 USA. [Stenfeldt, Carolina] Oak Ridge Inst Sci & Educ, PIADC Res Participat Program, Oak Ridge, TN USA. RP Ranjan, R (reprint author), ICAR Res Complex, Directorate Foot & Mouth Dis, Naini Tal, Uttarakhand, India.; Arzt, J (reprint author), ARS, Foreign Anim Dis Res Unit, USDA, Plum Isl Anim Dis Ctr, Greenport, NY 11944 USA. EM drrajraj@gmail.com; jonathan.arzt@ars.usda.gov OI Arzt, Jonathan/0000-0002-7517-7893 FU Indian Council of Agricultural Research, New Delhi; Agricultural Research Service-Current Research information System Project [1940-32000-057-00D]; United States Department of State, Biosecurity Engagement Program through the United States Department of Agriculture, Agricultural Research Service Office of International Research Programs; Plum Island Animal Disease Center Research Participation Program fellowship; PIADC Research Participation Program fellowships; Biological Engagement Program, Department of State FX This work was funded by the Indian Council of Agricultural Research, New Delhi. Additional funding was provided by Agricultural Research Service-Current Research information System Project 1940-32000-057-00D and the United States Department of State, Biosecurity Engagement Program through the United States Department of Agriculture, Agricultural Research Service Office of International Research Programs. The funding sources had no role in study design, data collection and analysis or the decision to publish the work. CS is a recipient of a Plum Island Animal Disease Center Research Participation Program fellowship, administered by the Oak Ridge Institute for Science and Education (ORISE, www.orau.org) through an interagency agreement with the US Department of Energy.; We are thankful to staff of experimental dairy farm for their invaluable cooperation during this study. Technical assistance of Mr. Basant, Uttam Nath Goswami, Shyam Lal Tamta, and Mr. B. D as are highly acknowledged. Steven Pauszek and Michael Eschbaumer areacknowledged for review of the manuscript. CS was a recipient of PIADC Research Participation Program fellowships, administered by the Oak Ridge Institute for Science and Education (ORISE) through an interagency agreement with the U.S. Department of Energy. The Office of International Research Programs, Agricultural Research Service USDA facilitated funding from the Biological Engagement Program, Department of State. NR 61 TC 0 Z9 0 U1 8 U2 8 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 15 PY 2016 VL 11 IS 12 AR e0167163 DI 10.1371/journal.pone.0167163 PG 15 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EG7HN UT WOS:000391217400013 PM 27977708 ER PT J AU Jiang, H Wang, JAJ AF Jiang, Hao Wang, Jy-An John TI Spent nuclear fuel system dynamic stability under normal conditions of transportation SO NUCLEAR ENGINEERING AND DESIGN LA English DT Article AB In a horizontal layout of a spent nuclear fuel (SNF) assembly under normal conditions of transportation (NCT), the fuel assembly's skeleton formed by guide tubes and spacer grids is the primary load bearing structure for carrying and transferring the vibration loads within an SNF assembly. Therefore, the integrity of guide tubes and spacer grids will dictate the vibration amplitude/intensity of the fuel assembly during transport, and must be considered when designing multipurpose purpose canister (MPC) for safe SNF transport. This paper investigates the SNF assembly deformation dynamics during normal vibration mode, as well as the transient shock mode inside the cask during NO'. Dynamic analyses were performed in the frequency domain to study frequency characteristic of the fuel assembly system and in the time domain to simulate the transient dynamic response of the fuel assembly. To further evaluate the intensity of contact interaction induced by the local contacts' impact loading at the spacer grid, detailed models of the actual spring and dimples of the spacer grids were created. The impacts between the fuel rod and springs and dimples were simulated with a 20 g transient shock load. The associated contact interaction intensities, in terms of reaction forces, were estimated from the finite element analyses (FEA) results. The bending moment estimated from the resultant stress on the clad under 20 g transient shock can be used to define the loading in cyclic integrated reversible-bending fatigue tester (CIRFT) vibration testing for the equivalent condition. To estimate the damage potential of the transient shock to the SNF vibration lifetime, drop tests were performed on the CIRFT specimens. FEA was used to investigate the contact reaction at CIRFT test samples during impact loading induced by drop tests, and the result was compared with that from a 20 g acceleration transient shock load. (C) 2016 Elsevier B.V. All rights reserved. C1 [Jiang, Hao; Wang, Jy-An John] Oak Ridge Natl Lab, Div Mat Sci & Technol, One Bethel Valley Rd, Oak Ridge, TN 37831 USA. RP Wang, JAJ (reprint author), Oak Ridge Natl Lab, Div Mat Sci & Technol, One Bethel Valley Rd, Oak Ridge, TN 37831 USA. EM wangja@ornl.gov FU DOE Used Fuel Disposition Campaign (UFDC) under DOE [DE-AC05-00OR22725]; UT-Battelle, LLC FX This research was sponsored by the DOE Used Fuel Disposition Campaign (UFDC) under DOE contract DE-AC05-00OR22725 with UT-Battelle, LLC. Authors thank Hong Wang for CIRFT testing data, Nicholas Klymyshyn for valuable discussion, and program managers Bruce Bevard and John Scaglione for their support and guidance during the program development. NR 20 TC 0 Z9 0 U1 5 U2 5 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0029-5493 EI 1872-759X J9 NUCL ENG DES JI Nucl. Eng. Des. PD DEC 15 PY 2016 VL 310 BP 1 EP 14 DI 10.1016/j.nucengdes.2016.09.033 PG 14 WC Nuclear Science & Technology SC Nuclear Science & Technology GA EG0QD UT WOS:000390736400001 ER PT J AU Burkes, DE Senor, DJ Casella, AM AF Burkes, Douglas E. Senor, David J. Casella, Andrew M. TI A model to predict failure of irradiated U-Mo dispersion fuel SO NUCLEAR ENGINEERING AND DESIGN LA English DT Article ID MATRIX INTERACTION; NUCLEAR-FUEL; AL; PRODUCTS; RELEASE AB Numerous global programs are focused on the continued development of existing and new research and test reactor fuels to achieve maximum attainable uranium loadings to support the conversion of a number of the world's remaining high-enriched uranium fueled reactors to low-enriched uranium fuel. Some of these programs are focused on development and qualification of a fuel design that consists of a uranium molybdenum (U-Mo) alloy dispersed in an aluminum matrix as one option for reactor conversion. The current paper extends a failure model originally developed for UO2-stainless steel dispersion fuels and uses currently available thermal mechanical property information for the materials of interest in the currently proposed design. A number of fabrication and irradiation parameters were investigated to understand the conditions at which failure of the matrix, classified as onset of pore formation in the matrix, might occur. The results compared well with experimental observations published as part of the Reduced Enrichment for Research and Test Reactors (RERTR)-6 and -7 mini-plate experiments. Fission rate, a function of the U-235 enrichment, appeared to be the most influential parameter in premature failure, mainly as a result of increased interaction layer formation and operational temperature, which coincidentally decreased the strength of the matrix and caused more rapid fission gas production and recoil into the surrounding matrix material. Addition of silicon to the matrix appeared effective at reducing the rate of interaction layer formation and can extend the performance of a fuel plate under a certain set of irradiation conditions, primarily moderate heat flux and burnup. Increasing the dispersed fuel particle diameter may also be effective, but only when combined with other parameters, e.g., lower enrichment and increased Si concentration. The model may serve as a valuable tool in initial experimental design. (C) 2016 Elsevier B.V. All rights reserved. C1 [Burkes, Douglas E.; Senor, David J.; Casella, Andrew M.] Pacific Northwest Natl Lab, Nucl Engn & Anal Grp, POB 999 MSIN K8-34, Richland, WA 99352 USA. RP Burkes, DE (reprint author), Pacific Northwest Natl Lab, Nucl Engn & Anal Grp, POB 999 MSIN K8-34, Richland, WA 99352 USA. EM Douglas.Burkes@pnnl.gov FU United States Department of Energy [DE-AC05-76RL01830]; National Nuclear Security Administration Office of Material Management and Minimization Reactor Conversion Program FX This work was conducted at Pacific Northwest National Laboratory operated by Battelle for the United States Department of Energy under Contract DE-AC05-76RL01830. The work is in support of the National Nuclear Security Administration Office of Material Management and Minimization Reactor Conversion Program. NR 32 TC 0 Z9 0 U1 3 U2 3 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0029-5493 EI 1872-759X J9 NUCL ENG DES JI Nucl. Eng. Des. PD DEC 15 PY 2016 VL 310 BP 48 EP 56 DI 10.1016/j.nucengdes.2016.09.032 PG 9 WC Nuclear Science & Technology SC Nuclear Science & Technology GA EG0QD UT WOS:000390736400005 ER PT J AU Mohanty, S Soppet, WK Majumdar, S Natesan, I AF Mohanty, Subhasish Soppet, William K. Majumdar, Saurin Natesan, Irishnamurti TI Thermal-mechanical stress analysis of pressurized water reactor pressure vessel with/without a preexisting crack under grid load following conditions SO NUCLEAR ENGINEERING AND DESIGN LA English DT Article AB In this paper, we present thermal-mechanical stress analysis of a pressurized water reactor pressure vessel and its hot-leg and cold-leg nozzles. Results are presented from thermal and thermal-mechanical stress analysis under reactor heat-up, cool-down, and grid load-following conditions. Analysis results are given with and without the presence of preexisting crack in the reactor nozzle (axial crack in hot leg nozzle). From the model results it is found that the stress-strain states are significantly higher in case of presence of crack than without crack. The stress-strain state under grid load following condition are more realistic compared to the stress-strain state estimated assuming simplified transients. (C) 2016 Elsevier B.V. All rights reserved. C1 [Mohanty, Subhasish; Soppet, William K.; Majumdar, Saurin; Natesan, Irishnamurti] Argonne Natl Lab, Nucl Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Mohanty, S (reprint author), Argonne Natl Lab, Nucl Engn Div, 9700 S Cass Ave, Argonne, IL 60439 USA. EM smohanty@anl.gov FU U.S. Department of Energy's Light Water Reactor Sustainability Program FX This research was funded by the U.S. Department of Energy's Light Water Reactor Sustainability Program under the work package of environmental fatigue study, program manager Dr. Keith Leonard. NR 35 TC 0 Z9 0 U1 1 U2 1 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0029-5493 EI 1872-759X J9 NUCL ENG DES JI Nucl. Eng. Des. PD DEC 15 PY 2016 VL 310 BP 112 EP 124 DI 10.1016/j.nucengdes.2016.09.020 PG 13 WC Nuclear Science & Technology SC Nuclear Science & Technology GA EG0QD UT WOS:000390736400010 ER PT J AU Stempien, JD Ballinger, RG Forsberg, CW AF Stempien, John D. Ballinger, Ronald G. Forsberg, Charles W. TI An integrated model of tritium transport and corrosion in Fluoride Salt-Cooled High-Temperature Reactors (FHRs) - Part I: Theory and benchmarking SO NUCLEAR ENGINEERING AND DESIGN LA English DT Article DE Tritium; Tritium transport; Corrosion; FHR; Flibe; Molten salt; Fluoride salt; MSR; MSRE ID LI2BEF4 MOLTEN-SALT; STAINLESS-STEEL; ELEVATED-TEMPERATURES; STRUCTURAL-MATERIALS; HYDROGEN; FLIBE; DEUTERIUM; DIFFUSION; PERMEATION; BEHAVIOR AB The Fluoride Salt-Cooled High-Temperature Reactor (FHR) is a pebble bed nuclear reactor concept cooled by a liquid fluoride salt known as "flibe" ((LiF)-Li-7-BeF2). A model of TRITium Diffusion EvolutioN and Transport (TRIDENT) was developed for use with FHRs and benchmarked with experimental data, TRIDENT is the first model to integrate the effects of tritium production in the salt via neutron transmutation, with the effects of the chemical redox potential, tritium mass transfer, tritium diffusion through pipe walls, tritium uptake by graphite, selective chromium attack by tritium fluoride, and corrosion product mass transfer. While data from a forced-convection polythermal loop of molten salt containing tritium did not exist for comparison, TRIDENT calculations were compared to data from static salt diffusion tests in flibe and flinak (0.465LiF-0.115NaF-0.42KF) salts. In each case, TRIDENT matched the transient and steady-state behavior of these tritium diffusion experiments. The corrosion model in TRIDENT was compared against the natural convection flow-loop experiments at the Oak Ridge National Laboratory (ORNL) from the 1960s and early 19705 which used Molten Salt Reactor Experiment (MSRE) fuel-salt containing UF4. Despite the lack of data required by TRIDENT for modeling the loops, some reasonable results were obtained. The TRIDENT corrosion rates follow the experimentally observed dependence on the square root of the product of the chromium solid-state diffusion coefficient with time. Additionally the TRIDENT model predicts mass transfer of corrosion products from the hot to the cold leg (as was observed in the experiments with salts containing UF4). In a separate paper the results of TRIDENT simulations in a prototypical FHR are presented. (C) 2016 Elsevier B.V. All rights reserved. C1 [Stempien, John D.; Ballinger, Ronald G.; Forsberg, Charles W.] MIT, Dept Nucl Sci & Engn, 77 Massachusetts Ave, Cambridge, MA 02139 USA. RP Stempien, JD (reprint author), Idaho Natl Lab, POB 1625, Idaho Falls, ID 83415 USA. EM john.stempien@inl.gov; hvymet@mit.edu; cforsber@mit.edu FU Department of Energy (DOE) Nuclear Energy University Program (NEUP) [NEUP14-7476] FX This work was made possible by the Department of Energy (DOE) Nuclear Energy University Program (NEUP), which awarded a 3-year Integrated Research Project (IRP): (under grant number NEUP14-7476) to MIT and its partners at the University of California-Berkeley and the University of Wisconsin-Madison for research and development of the Fluoride-Salt-Cooled High-Temperature Reactor (FHR). NR 66 TC 2 Z9 2 U1 3 U2 3 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0029-5493 EI 1872-759X J9 NUCL ENG DES JI Nucl. Eng. Des. PD DEC 15 PY 2016 VL 310 BP 258 EP 272 DI 10.1016/j.nucengdes.2016.10.051 PG 15 WC Nuclear Science & Technology SC Nuclear Science & Technology GA EG0QD UT WOS:000390736400022 ER PT J AU Saouma, VE Hariri-Ardebili, MA Le Pape, Y Balaji, R AF Saouma, Victor E. Hariri-Ardebili, Mohammad Amin Le Pape, Yann Balaji, Rajagopalan TI Effect of alkali-silica reaction on the shear strength of reinforced concrete structural members. A numerical and statistical study SO NUCLEAR ENGINEERING AND DESIGN LA English DT Article ID FRACTURE; MODEL; ASR; CAPACITY; BRIDGE AB The residual structural shear resistance of concrete members without shear reinforcement and subject to alkali-aggregate reaction (ASR) is investigated by finite element analysis. A parametric numerical study of 648 analyses considering various structural members' geometries, boundary conditions, ASR-induced losses of materials properties, ASR expansions and reinforcement ratios is conducted. As a result of competitive mechanisms (e.g., ASR-induced prestressing caused by the longitudinal reinforcement) and loss of concrete materials properties, important scatter in terms of gain or loss of shear strength is observed: about 50% of the studied configurations lead to a degradation of structural performance. The range of variation in terms of post-ASR shear resistance is extremely scattered, in particular, when ASR results in out of -plane expansion only. Influencing factors are derived by two methods: (i) visual inspection of boxplots and probability distributions, and (ii) information criteria within multiple-linear regression analysis. (C) 2016 Elsevier B.V. All rights reserved. C1 [Saouma, Victor E.; Hariri-Ardebili, Mohammad Amin; Balaji, Rajagopalan] Univ Colorado, Dept Civil Engn, Boulder, CO 80305 USA. [Le Pape, Yann] Oak Ridge Natl Lab, One Bethel Valley Rd, Oak Ridge, TN 37831 USA. RP Le Pape, Y (reprint author), Oak Ridge Natl Lab, One Bethel Valley Rd, Oak Ridge, TN 37831 USA. EM lepapeym@ornl.gov FU U.S. Department of Energy (DOE) Light Water Reactor Sustainability Program; UT-Battelle, LLC [DE-AC05-00OR22725]; U.S. Department of Energy; Department of Energy; DOE Public Access Plan FX This research is sponsored by the U.S. Department of Energy (DOE) Light Water Reactor Sustainability Program. This manuscript has been authored by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a non-exclusive, paid-up, irrevocable, world-wide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan (http://energy.gov/downloads/doe-public-access-plan). NR 29 TC 0 Z9 0 U1 10 U2 10 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0029-5493 EI 1872-759X J9 NUCL ENG DES JI Nucl. Eng. Des. PD DEC 15 PY 2016 VL 310 BP 295 EP 310 DI 10.1016/j.nucengdes.2016.10.012 PG 16 WC Nuclear Science & Technology SC Nuclear Science & Technology GA EG0QD UT WOS:000390736400025 ER PT J AU Solom, M Kirkland, KV AF Solom, Matthew Kirkland, Karen Vierow TI Experimental investigation of BWR Suppression Pool stratification during RCIC system operation SO NUCLEAR ENGINEERING AND DESIGN LA English DT Article; Proceedings Paper CT Japan-US Seminar on Two-Phase Flow Dynamics CY MAY 10-15, 2015 CL Purdue Univ, West Lafayette, IN HO Purdue Univ DE Boiling Water Reactor (BWR); Reactor Core Isolation Cooling (RCIC) System; Suppression Pool; Thermal stratification; Chugging oscillation ID DIRECT-CONTACT CONDENSATION AB In Boiling Water Reactor (BWR) nuclear power plants with the Mark I containment, the condition of the Suppression Pool can be a large influence on overall plant safety. When the Reactor Core Isolation Cooling (RCIC) System is operating, steam from the reactor drives the RCIC turbine and is then exhausted to the Suppression Pool. When subcooled, the pool can readily condense the steam, warming it up in the process. However, if hot spots or thermal stratification appear, this can limit the Suppression Pool's ability to perform its safety functions, and can be a limiting factor for RCIC System operation. In order to better understand the RCIC system and its true limits of long-term operation, an experimental model of the system was constructed at the Laboratory for Nuclear Heat Transfer Systems at Texas ARIBA University (TAMU). These tests provide confirmation of thermal stratification in the Suppression Pool from RCIC System operations, and show a significant degree of dependence on pressure in the airspace above the pool. In the TAMU facility, vertical thermal stratification was limited to 21 degrees C when fully vented to atmospheric pressure, while pre-pressurization led to stratification well in excess of 60 degrees C. (C) 2016 Elsevier B.V. All rights reserved. C1 [Solom, Matthew] Sandia Natl Labs, MS-0748,POB 5800, Albuquerque, NM 87185 USA. [Kirkland, Karen Vierow] Texas A&M Univ, Dept Nucl Engn, MS 3133, College Stn, TX 77843 USA. RP Solom, M (reprint author), Sandia Natl Labs, MS-0748,POB 5800, Albuquerque, NM 87185 USA. EM msolom@sandia.gov NR 11 TC 0 Z9 0 U1 0 U2 0 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0029-5493 EI 1872-759X J9 NUCL ENG DES JI Nucl. Eng. Des. PD DEC 15 PY 2016 VL 310 BP 564 EP 569 DI 10.1016/j.nucengdes.2016.10.045 PG 6 WC Nuclear Science & Technology SC Nuclear Science & Technology GA EG0QD UT WOS:000390736400047 ER PT J AU Zang, H Jiang, WL Liu, WB Devaraj, A Edwards, DJ Henager, CH Kurtz, RJ Li, T He, CH Yun, D Wang, ZG AF Zang, Hang Jiang, Weilin Liu, Wenbo Devaraj, Arun Edwards, Danny J. Henager, Charles H., Jr. Kurtz, Richard J. Li, Tao He, Chaohui Yun, Di Wang, Zhiguang TI Vacancy effects on the formation of He and Kr cavities in 3C-SiC irradiated and annealed at elevated temperatures SO NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS LA English DT Article DE He and Kr cavities; Vacancy effect; High-temperature annealing; Ion irradiation; 3C-SiC ID CUBIC SILICON-CARBIDE; HELIUM IMPLANTATION; AG DIFFUSION; DEGREES-C; ION; EVOLUTION; BEHAVIOR; DEFECTS; ENERGY AB Polycrystalline 3C-SiC was sequentially irradiated at 400 and 750 degrees C with 120 keV He2+ and 4 MeV Kr15+ ions to 10(17) and 4 x 10(16) cm(-2), respectively. The Kr15+ ions penetrated the entire depth region of the He2+ ion implantation. Three areas of He2+, Kr15+ and He2+ + Kr15+ ion implanted SiC were created through masked overlapping irradiation. The sample was subsequently annealed at 1600 degrees C in vacuum and characterized using cross-sectional transmission electron microscopy and energy-dispersive X-ray spectroscopy. Compared to the He2+ ion only implanted SiC, He cavities show a smaller size and higher density in the co-implanted SiC. At 25 dpa, presence of He in the co-implanted 3C-SiC significantly promotes cavity growth; much smaller voids are formed in the Kr15+ ion only irradiated SiC at the same dose. In addition, local Kr migration and trapping at cavities occurs, but long-range Kr diffusion in SiC is not observed up to 1600 degrees C. (C) 2016 Elsevier B.V. All rights reserved. C1 [Zang, Hang; Liu, Wenbo; Li, Tao; He, Chaohui; Yun, Di] Xi An Jiao Tong Univ, Dept Nucl Sci & Technol, Xian 710049, Peoples R China. [Jiang, Weilin; Devaraj, Arun; Edwards, Danny J.; Henager, Charles H., Jr.; Kurtz, Richard J.] Pacific Northwest Natl Lab, Richland, WA 99352 USA. [Wang, Zhiguang] Chinese Acad Sci, Inst Modern Phys, Lanzhou 730000, Peoples R China. RP Zang, H; Jiang, WL (reprint author), Xi An Jiao Tong Univ, Dept Nucl Sci & Technol, Xian 710049, Peoples R China.; Jiang, WL (reprint author), Pacific Northwest Natl Lab, Richland, WA 99352 USA. EM zanghang@xjtu.edu.cn; weilin.jiang@pnnl.gov OI Jiang, Weilin/0000-0001-8302-8313 FU China Scholarship Council; National Natural Science Foundation of China [11405124]; U.S. DOE Office of Fusion Energy Sciences [DE-AC05-76RL01830] FX We are grateful to Todd Allen (INL) for providing the CVD SiC samples in this study, Guiqiu Zheng (MIT) for sample polishing, Jinyu Li and Huiping Liu (IMPCAS) for ion implantation, Jiandong Zhang and Zihua Zhu (PNNL) for SIMS measurement, and to Xuemei Wang and Lin Shao (Texas A&M University) for RBS analysis. Zang was financially supported by China Scholarship Council during his visit to PNNL. This study was supported by the National Natural Science Foundation of China (No. 11405124) and the U.S. DOE Office of Fusion Energy Sciences under Contract DE-AC05-76RL01830. NR 41 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0168-583X EI 1872-9584 J9 NUCL INSTRUM METH B JI Nucl. Instrum. Methods Phys. Res. Sect. B-Beam Interact. Mater. Atoms PD DEC 15 PY 2016 VL 389 BP 40 EP 47 DI 10.1016/j.nimb.2016.11.017 PG 8 WC Instruments & Instrumentation; Nuclear Science & Technology; Physics, Atomic, Molecular & Chemical; Physics, Nuclear SC Instruments & Instrumentation; Nuclear Science & Technology; Physics GA EG0TS UT WOS:000390745700008 ER PT J AU Adamczyk, L Adkins, JK Agakishiev, G Aggarwal, MM Ahammed, Z Alekseev, I Anderson, DM Aoyama, R Aparin, A Arkhipkin, D Aschenauer, EC Ashraf, MU Attri, A Averichev, GS Bai, X Bairathi, V Bellwied, R Bhasin, A Bhati, AK Bhattarai, P Bielcik, J Bielcikova, J Bland, LC Bordyuzhin, IG Bouchet, J Brandenburg, JD Brandin, AV Bunzarov, I Butterworth, J Caines, H Sanchez, MCD Campbell, JM Cebra, D Chakaberia, I Chaloupka, P Chang, Z Chatterjee, A Chattopadhyay, S Chen, JH Chen, X Cheng, J Cherney, M Christie, W Contin, G Crawford, HJ Das, S De Silva, LC Debbe, RR Dedovich, TG Deng, J Derevschikov, AA Didenko, L Dilks, C Dong, X Drachenberg, JL Draper, JE Du, CM Dunkelberger, LE Dunlop, JC Efimov, LG Engelage, J Eppley, G Esha, R Esumi, S Evdokimov, O Eyser, O Fatemi, R Fazio, S Federic, P Fedorisin, J Feng, Z Filip, P Finch, E Fisyak, Y Flores, CE Fulek, L Gagliardi, CA Garand, D Geurts, F Gibson, A Girard, M Greiner, L Grosnick, D Gunarathne, DS Guo, Y Gupta, A Gupta, S Guryn, W Hamad, AI Hamed, A Haque, R Harris, JW He, L Heppelmann, S Heppelmann, S Hirsch, A Hoffmann, GW Horvat, S Huang, HZ Huang, B Huang, T Huang, X Huck, P Humanic, TJ Igo, G Jacobs, WW Jentsch, A Jia, J Jiang, K Jowzaee, S Judd, EG Kabana, S Kalinkin, D Kang, K Kauder, K Ke, HW Keane, D Kechechyan, A Khan, Z Kikola, DP Kisel, I Kisiel, A Kochenda, L Koetke, DD Kosarzewski, LK Kraishan, AF Kravtsov, P Krueger, K Kumar, L Lamont, MAC Landgraf, JM Landry, D Lauret, J Lebedev, A Lednicky, R Lee, JH Li, Y Li, C Li, X Li, W Li, X Lin, T Lisa, MA Liu, F Liu, Y Ljubicic, T Llope, WJ Lomnitz, M Longacre, RS Luo, X Luo, S Ma, GL Ma, R Ma, L Ma, YG Magdy, N Majka, R Manion, A Margetis, S Markert, C Matis, HS McDonald, D McKinzie, S Meehan, K Mei, C Miller, ZW Minaev, NG Mioduszewski, S Mishra, D Mohanty, B Mondal, MM Morozov, DA Mustafa, MK Nandi, BK Nasim, M Nayak, TK Nigmatkulov, G Niida, T Nogach, LV Nonaka, T Novak, J Nurushev, SB Odyniec, G Ogawa, A Oh, K Okorokov, VA Olvitt, D Page, BS Pak, R Pan, YX Pandit, Y Panebratsev, Y Pawlik, B Pei, H Perkins, C Pile, P Pluta, J Poniatowska, K Porter, J Posik, M Poskanzer, AM Pruthi, NK Przybycien, M Putschke, J Qiu, H Quintero, A Ramachandran, S Ray, RL Reed, R Rehbein, MJ Ritter, HG Roberts, JB Rogachevskiy, OV Romero, JL Roth, JD Ruan, L Rusnak, J Rusnakova, O Sahoo, NR Sahu, PK Sakrejda, I Salur, S Sandweiss, J Sarkar, A Schambach, J Scharenberg, RP Schmah, AM Schmidke, WB Schmitz, N Seger, J Seyboth, P Shah, N Shahaliev, E Shanmuganathan, PV Shao, M Sharma, MK Sharma, A Sharma, B Shen, WQ Shi, Z Shi, SS Shou, QY Sichtermann, EP Sikora, R Simko, M Singha, S Skoby, MJ Smirnov, D Smirnov, N Solyst, W Song, L Sorensen, P Spinka, HM Srivastava, B Stanislaus, TDS Stepanov, M Stock, R Strikhanov, M Stringfellow, B Sugiura, T Sumbera, M Summa, B Sun, Y Sun, Z Sun, XM Surrow, B Svirida, DN Tang, Z Tang, AH Tarnowsky, T Tawfik, A Thader, J Thomas, JH Timmins, AR Tlusty, D Todoroki, T Tokarev, M Trentalange, S Tribble, RE Tribedy, P Tripathy, SK Tsai, OD Ullrich, T Underwood, DG Upsal, I Van Buren, G van Nieuwenhuizen, G Varma, R Vasiliev, AN Vertesi, R Videbaek, F Vokal, S Voloshin, SA Vossen, A Wang, G Wang, JS Wang, F Wang, Y Wang, Y Webb, JC Webb, G Wen, L Westfall, GD Wieman, H Wissink, SW Witt, R Wu, Y Xiao, ZG Xie, G Xie, W Xin, K Xu, Z Xu, H Xu, N Xu, J Xu, YF Xu, QH Yang, Y Yang, Y Yang, S Yang, Q Yang, Y Yang, C Ye, Z Ye, Z Yi, L Yip, K Yoo, IK Yu, N Zbroszczyk, H Zha, W Zhang, J Zhang, Z Zhang, J Zhang, S Zhang, XP Zhang, JB Zhang, Y Zhang, S Zhao, J Zhong, C Zhou, L Zhu, X Zoulkarneeva, Y Zyzak, M AF Adamczyk, L. Adkins, J. K. Agakishiev, G. Aggarwal, M. M. Ahammed, Z. Alekseev, I. Anderson, D. M. Aoyama, R. Aparin, A. Arkhipkin, D. Aschenauer, E. C. Ashraf, M. U. Attri, A. Averichev, G. S. Bai, X. Bairathi, V. Bellwied, R. Bhasin, A. Bhati, A. K. Bhattarai, P. Bielcik, J. Bielcikova, J. Bland, L. C. Bordyuzhin, I. G. Bouchet, J. Brandenburg, J. D. Brandin, A. V. Bunzarov, I. Butterworth, J. Caines, H. Sanchez, M. Calderon de la Barca Campbell, J. M. Cebra, D. Chakaberia, I. Chaloupka, P. Chang, Z. Chatterjee, A. Chattopadhyay, S. Chen, J. H. Chen, X. Cheng, J. Cherney, M. Christie, W. Contin, G. Crawford, H. J. Das, S. De Silva, L. C. Debbe, R. R. Dedovich, T. G. Deng, J. Derevschikov, A. A. Didenko, L. Dilks, C. Dong, X. Drachenberg, J. L. Draper, J. E. Du, C. M. Dunkelberger, L. E. Dunlop, J. C. Efimov, L. G. Engelage, J. Eppley, G. Esha, R. Esumi, S. Evdokimov, O. Eyser, O. Fatemi, R. Fazio, S. Federic, P. Fedorisin, J. Feng, Z. Filip, P. Finch, E. Fisyak, Y. Flores, C. E. Fulek, L. Gagliardi, C. A. Garand, D. Geurts, F. Gibson, A. Girard, M. Greiner, L. Grosnick, D. Gunarathne, D. S. Guo, Y. Gupta, A. Gupta, S. Guryn, W. Hamad, A. I. Hamed, A. Haque, R. Harris, J. W. He, L. Heppelmann, S. Heppelmann, S. Hirsch, A. Hoffmann, G. W. Horvat, S. Huang, H. Z. Huang, B. Huang, T. Huang, X. Huck, P. Humanic, T. J. Igo, G. Jacobs, W. W. Jentsch, A. Jia, J. Jiang, K. Jowzaee, S. Judd, E. G. Kabana, S. Kalinkin, D. Kang, K. Kauder, K. Ke, H. W. Keane, D. Kechechyan, A. Khan, Z. Kikola, D. P. Kisel, I. Kisiel, A. Kochenda, L. Koetke, D. D. Kosarzewski, L. K. Kraishan, A. F. Kravtsov, P. Krueger, K. Kumar, L. Lamont, M. A. C. Landgraf, J. M. Landry, D. Lauret, J. Lebedev, A. Lednicky, R. Lee, J. H. Li, Y. Li, C. Li, X. Li, W. Li, X. Lin, T. Lisa, M. A. Liu, F. Liu, Y. Ljubicic, T. Llope, W. J. Lomnitz, M. Longacre, R. S. Luo, X. Luo, S. Ma, G. L. Ma, R. Ma, L. Ma, Y. G. Magdy, N. Majka, R. Manion, A. Margetis, S. Markert, C. Matis, H. S. McDonald, D. McKinzie, S. Meehan, K. Mei, C. Miller, Z. W. Minaev, N. G. Mioduszewski, S. Mishra, D. Mohanty, B. Mondal, M. M. Morozov, D. A. Mustafa, M. K. Nandi, B. K. Nasim, Md. Nayak, T. K. Nigmatkulov, G. Niida, T. Nogach, L. V. Nonaka, T. Novak, J. Nurushev, S. B. Odyniec, G. Ogawa, A. Oh, K. Okorokov, V. A. Olvitt, D., Jr. Page, B. S. Pak, R. Pan, Y. X. Pandit, Y. Panebratsev, Y. Pawlik, B. Pei, H. Perkins, C. Pile, P. Pluta, J. Poniatowska, K. Porter, J. Posik, M. Poskanzer, A. M. Pruthi, N. K. Przybycien, M. Putschke, J. Qiu, H. Quintero, A. Ramachandran, S. Ray, R. L. Reed, R. Rehbein, M. J. Ritter, H. G. Roberts, J. B. Rogachevskiy, O. V. Romero, J. L. Roth, J. D. Ruan, L. Rusnak, J. Rusnakova, O. Sahoo, N. R. Sahu, P. K. Sakrejda, I. Salur, S. Sandweiss, J. Sarkar, A. Schambach, J. Scharenberg, R. P. Schmah, A. M. Schmidke, W. B. Schmitz, N. Seger, J. Seyboth, P. Shah, N. Shahaliev, E. Shanmuganathan, P. V. Shao, M. Sharma, M. K. Sharma, A. Sharma, B. Shen, W. Q. Shi, Z. Shi, S. S. Shou, Q. Y. Sichtermann, E. P. Sikora, R. Simko, M. Singha, S. Skoby, M. J. Smirnov, D. Smirnov, N. Solyst, W. Song, L. Sorensen, P. Spinka, H. M. Srivastava, B. Stanislaus, T. D. S. Stepanov, M. Stock, R. Strikhanov, M. Stringfellow, B. Sugiura, T. Sumbera, M. Summa, B. Sun, Y. Sun, Z. Sun, X. M. Surrow, B. Svirida, D. N. Tang, Z. Tang, A. H. Tarnowsky, T. Tawfik, A. Thader, J. Thomas, J. H. Timmins, A. R. Tlusty, D. Todoroki, T. Tokarev, M. Trentalange, S. Tribble, R. E. Tribedy, P. Tripathy, S. K. Tsai, O. D. Ullrich, T. Underwood, D. G. Upsal, I. Van Buren, G. van Nieuwenhuizen, G. Varma, R. Vasiliev, A. N. Vertesi, R. Videbaek, F. Vokal, S. Voloshin, S. A. Vossen, A. Wang, G. Wang, J. S. Wang, F. Wang, Y. Wang, Y. Webb, J. C. Webb, G. Wen, L. Westfall, G. D. Wieman, H. Wissink, S. W. Witt, R. Wu, Y. Xiao, Z. G. Xie, G. Xie, W. Xin, K. Xu, Z. Xu, H. Xu, N. Xu, J. Xu, Y. F. Xu, Q. H. Yang, Y. Yang, Y. Yang, S. Yang, Q. Yang, Y. Yang, C. Ye, Z. Ye, Z. Yi, L. Yip, K. Yoo, I-K. Yu, N. Zbroszczyk, H. Zha, W. Zhang, J. Zhang, Z. Zhang, J. Zhang, S. Zhang, X. P. Zhang, J. B. Zhang, Y. Zhang, S. Zhao, J. Zhong, C. Zhou, L. Zhu, X. Zoulkarneeva, Y. Zyzak, M. CA STAR Collaboration TI Upsilon production in U plus U collisions at root s(NN)=193 GeV measured with the STAR experiment SO PHYSICAL REVIEW C LA English DT Article ID ENERGY NUCLEAR COLLISIONS; AU COLLISIONS; DISSOCIATION; SUPPRESSION; CHARMONIUM; PLASMA AB We present a measurement of the inclusive production of. mesons in U + U collisions at root s(NN) = 193 GeV at midrapidity (vertical bar y vertical bar < 1). Previous studies in central Au+Au collisions at root s(NN) = 200 GeV show a suppression of Upsilon (1S+2S+3S) production relative to expectations from the Upsilon yield in p+p collisions scaled by the number of binary nucleon-nucleon collisions (N-coll), with an indication that the.(1S) state is also suppressed. The present measurement extends the number of participant nucleons in the collision (N-part) by 20% compared to Au+Au collisions, and allows us to study a system with higher energy density. We observe a suppression in both the Upsilon (1S+2S+3S) and Upsilon (1S) yields in central U+U data, which consolidates and extends the previously observed suppression trend in Au+Au collisions. C1 [Adamczyk, L.; Fulek, L.; Przybycien, M.; Sikora, R.] AGH Univ Sci & Technol, FPACS, PL-30059 Krakow, Poland. [Adkins, J. K.; Fatemi, R.; Ramachandran, S.] Univ Kentucky, Lexington, KY 40506 USA. [Agakishiev, G.; Aparin, A.; Averichev, G. S.; Bunzarov, I.; Dedovich, T. G.; Efimov, L. G.; Fedorisin, J.; Filip, P.; Kechechyan, A.; Lednicky, R.; Panebratsev, Y.; Rogachevskiy, O. V.; Shahaliev, E.; Tokarev, M.; Vokal, S.; Zoulkarneeva, Y.] Joint Inst Nucl Res, Dubna 141980, Russia. [Aggarwal, M. M.; Attri, A.; Bhati, A. K.; Kumar, L.; Pruthi, N. K.; Sharma, B.] Panjab Univ, Chandigarh 160014, India. [Ahammed, Z.; Chatterjee, A.; Chattopadhyay, S.; Nayak, T. K.] Ctr Variable Energy Cyclotron, Kolkata 700064, India. [Alekseev, I.; Bordyuzhin, I. G.; Svirida, D. N.] Alikhanov Inst Theoret & Expt Phys, Moscow 117218, Russia. [Alekseev, I.; Brandin, A. V.; Kochenda, L.; Kravtsov, P.; Nigmatkulov, G.; Okorokov, V. A.; Strikhanov, M.] Natl Res Nucl Univ MEPhI, Moscow 115409, Russia. [Anderson, D. M.; Chang, Z.; Gagliardi, C. A.; Hamed, A.; Liu, Y.; Mioduszewski, S.; Mondal, M. M.; Sahoo, N. R.; Tribble, R. E.] Texas A&M Univ, College Stn, TX 77843 USA. [Aoyama, R.; Arkhipkin, D.; Aschenauer, E. C.; Bland, L. C.; Chakaberia, I.; Christie, W.; Debbe, R. R.; Didenko, L.; Dunlop, J. C.; Esumi, S.; Eyser, O.; Fazio, S.; Fisyak, Y.; Guryn, W.; Jia, J.; Ke, H. W.; Lamont, M. A. C.; Landgraf, J. M.; Lauret, J.; Lebedev, A.; Lee, J. H.; Ljubicic, T.; Longacre, R. S.; Ma, R.; Nonaka, T.; Ogawa, A.; Page, B. S.; Pak, R.; Pile, P.; Ruan, L.; Schmidke, W. B.; Smirnov, D.; Sorensen, P.; Sugiura, T.; Tang, A. H.; Todoroki, T.; Tribedy, P.; Ullrich, T.; Van Buren, G.; van Nieuwenhuizen, G.; Videbaek, F.; Webb, J. C.; Webb, G.; Xu, Z.; Yip, K.] Brookhaven Natl Lab, Upton, NY 11973 USA. [Ashraf, M. U.; Cheng, J.; Huang, X.; Kang, K.; Li, Y.; Wang, Y.; Xiao, Z. G.; Zhang, X. P.; Zhu, X.] Tsinghua Univ, Beijing 100084, Peoples R China. [Bai, X.; Feng, Z.; Huck, P.; Liu, F.; Luo, X.; Pei, H.; Shi, S. S.; Sun, X. M.; Wang, Y.; Xu, J.; Yang, Y.; Yu, N.; Zhang, J. B.] Cent China Normal Univ, Wuhan 430079, Hubei, Peoples R China. [Bairathi, V.; Haque, R.; Mishra, D.; Mohanty, B.] Natl Inst Sci Educ & Res, Bhubaneswar 751005, Orissa, India. [Bellwied, R.; McDonald, D.; Song, L.; Timmins, A. R.] Univ Houston, Houston, TX 77204 USA. [Bhasin, A.; Gupta, A.; Gupta, S.; Sharma, M. K.; Sharma, A.] Univ Jammu, Jammu 180001, India. [Bhattarai, P.; Hoffmann, G. W.; Jentsch, A.; Markert, C.; Ray, R. L.; Schambach, J.] Univ Texas Austin, Austin, TX 78712 USA. 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F.; Zhang, Z.; Zhang, S.; Zhong, C.] Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China. [Chen, X.; Du, C. M.; Sun, Z.; Wang, J. S.; Xu, H.; Yang, Y.; Zhang, J.] Chinese Acad Sci, Inst Modern Phys, Lanzhou 730000, Gansu, Peoples R China. [Cherney, M.; De Silva, L. C.; Rehbein, M. J.; Roth, J. D.; Seger, J.] Creighton Univ, Omaha, NE 68178 USA. [Contin, G.; Dong, X.; Greiner, L.; Manion, A.; Matis, H. S.; McKinzie, S.; Mustafa, M. K.; Odyniec, G.; Porter, J.; Poskanzer, A. M.; Ritter, H. G.; Sakrejda, I.; Salur, S.; Schmah, A. M.; Shi, Z.; Sichtermann, E. P.; Thader, J.; Thomas, J. H.; Wieman, H.; Xu, N.] Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA. [Crawford, H. J.; Engelage, J.; Judd, E. G.; Perkins, C.] Univ Calif Berkeley, Berkeley, CA 94720 USA. [Das, S.; Sahu, P. K.; Tripathy, S. K.] Inst Phys, Bhubaneswar 751005, Orissa, India. [Deng, J.; Mei, C.; Xu, Q. H.; Zhang, J.] Shandong Univ, Jinan 250100, Shandong, Peoples R China. [Derevschikov, A. A.; Minaev, N. G.; Morozov, D. A.; Nogach, L. V.; Nurushev, S. B.; Vasiliev, A. N.] Inst High Energy Phys, Protvino 142281, Russia. [Dilks, C.; Heppelmann, S.; Summa, B.] Penn State Univ, University Pk, PA 16802 USA. [Drachenberg, J. L.] Lamar Univ, Dept Phys, Beaumont, TX 77710 USA. [Dunkelberger, L. E.; Esha, R.; Huang, H. Z.; Igo, G.; Landry, D.; Nasim, Md.; Pan, Y. X.; Trentalange, S.; Tsai, O. D.; Wang, G.; Wen, L.] Univ Calif Los Angeles, Los Angeles, CA 90095 USA. [Evdokimov, O.; Huang, B.; Khan, Z.; Luo, S.; Miller, Z. W.; Pandit, Y.; Ye, Z.; Ye, Z.] Univ Illinois, Chicago, IL 60607 USA. [Finch, E.] Southern Connecticut State Univ, New Haven, CT 06515 USA. [Garand, D.; He, L.; Hirsch, A.; Qiu, H.; Scharenberg, R. P.; Srivastava, B.; Stepanov, M.; Stringfellow, B.; Wang, F.; Xie, W.; Zhao, J.] Purdue Univ, W Lafayette, IN 47907 USA. [Gibson, A.; Grosnick, D.; Koetke, D. D.; Stanislaus, T. D. S.] Valparaiso Univ, Valparaiso, IN 46383 USA. [Girard, M.; Kikola, D. P.; Kisiel, A.; Kosarzewski, L. K.; Pluta, J.; Poniatowska, K.; Zbroszczyk, H.] Warsaw Univ Technol, PL-00661 Warsaw, Poland. [Gunarathne, D. S.; Kraishan, A. F.; Li, X.; Olvitt, D., Jr.; Posik, M.; Quintero, A.; Surrow, B.] Temple Univ, Philadelphia, PA 19122 USA. [Guo, Y.; Jiang, K.; Li, C.; Li, X.; Shao, M.; Sun, Y.; Tang, Z.; Xie, G.; Yang, S.; Yang, Q.; Yang, C.; Zha, W.; Zhang, Y.; Zhang, S.; Zhou, L.] Univ Sci & Technol China, Hefei 230026, Anhui, Peoples R China. [Huang, T.; Yang, Y.] Natl Cheng Kung Univ, Tainan 70101, Taiwan. [Jacobs, W. W.; Kalinkin, D.; Lin, T.; Skoby, M. J.; Solyst, W.; Vossen, A.; Wissink, S. W.] Indiana Univ, Bloomington, IN 47408 USA. [Jia, J.; Magdy, N.] SUNY Stony Brook, Stony Brook, NY 11794 USA. [Jowzaee, S.; Kauder, K.; Llope, W. J.; Niida, T.; Putschke, J.; Voloshin, S. A.] Wayne State Univ, Detroit, MI 48201 USA. [Kisel, I.; Stock, R.; Zyzak, M.] FIAS, D-60438 Frankfurt, Germany. [Krueger, K.; Spinka, H. M.; Underwood, D. G.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Nandi, B. K.; Sarkar, A.; Varma, R.] Indian Inst Technol, Mumbai 400076, Maharashtra, India. [Novak, J.; Tarnowsky, T.; Westfall, G. D.] Michigan State Univ, E Lansing, MI 48824 USA. [Oh, K.; Yoo, I-K.] Pusan Natl Univ, Pusan 46241, South Korea. [Pawlik, B.] Inst Nucl Phys PAN, PL-31342 Krakow, Poland. [Reed, R.] Lehigh Univ, Bethlehem, PA 18015 USA. [Schmitz, N.; Seyboth, P.] Max Planck Inst Phys & Astrophys, D-80805 Munich, Germany. [Tawfik, A.] WLCAPP, Cairo 11571, Egypt. [Witt, R.] US Naval Acad, Annapolis, MD 21402 USA. RP Adamczyk, L (reprint author), AGH Univ Sci & Technol, FPACS, PL-30059 Krakow, Poland. RI Ma, Yu-Gang/M-8122-2013; Gunarathne, Devika/C-4903-2017 OI Ma, Yu-Gang/0000-0002-0233-9900; Gunarathne, Devika/0000-0002-7155-7418 FU RHIC Operations Group and RCF at BNL; NERSC Center at LBNL; Open Science Grid consortium; Office of Nuclear Physics within the U.S. DOE Office of Science of China; U.S. NSF of China; Ministry of Education and Science of the Russian Federation of China; NSFC of China; CAS of China; MoST of China; MoE of China; National Research Foundation of Korea, (Taiwan); GA of the Czech Republic; FIAS of Germany; DAE of India; DST of India; UGC of India; National Science Centre of Poland; National Research Foundation of the Republic of Croatia; Ministry of Science, Education and Sports of the Republic of Croatia; Rosatom of Russia; MSMT of the Czech Republic; NCKU (Taiwan) FX We thank the RHIC Operations Group and RCF at BNL, the NERSC Center at LBNL, and the Open Science Grid consortium for providing resources and support. This work was supported in part by the Office of Nuclear Physics within the U.S. DOE Office of Science, the U.S. NSF, the Ministry of Education and Science of the Russian Federation, NSFC, CAS, MoST and MoE of China, the National Research Foundation of Korea, NCKU (Taiwan), GA and MSMT of the Czech Republic, FIAS of Germany, DAE, DST, and UGC of India, the National Science Centre of Poland, National Research Foundation, the Ministry of Science, Education and Sports of the Republic of Croatia, and Rosatom of Russia. NR 44 TC 0 Z9 0 U1 10 U2 10 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 15 PY 2016 VL 94 IS 6 AR 064904 DI 10.1103/PhysRevC.94.064904 PG 9 WC Physics, Nuclear SC Physics GA EF4BQ UT WOS:000390269900001 ER PT J AU Akers, C Laird, AM Fulton, BR Ruiz, C Bardayan, DW Buchmann, L Christian, G Davids, B Erikson, L Fallis, J Hager, U Hutcheon, D Martin, L Murphy, AS Nelson, K Ottewell, D Rojas, A Spyrou, A AF Akers, C. Laird, A. M. Fulton, B. R. Ruiz, C. Bardayan, D. W. Buchmann, L. Christian, G. Davids, B. Erikson, L. Fallis, J. Hager, U. Hutcheon, D. Martin, L. Murphy, A. St J. Nelson, K. Ottewell, D. Rojas, A. Spyrou, A. TI Measurement of radiative proton capture on F-18 and implications for oxygen-neon novae reexamined SO PHYSICAL REVIEW C LA English DT Article ID NUCLEOSYNTHESIS; STARS; ISAC; GAS AB Background: The rate of the F-18(p,gamma)Ne-19 reaction affects the final abundance of the radioisotope F-18 ejected from novae. This nucleus is important as its abundance is thought to significantly influence the first-stage 511-keV and continuum gamma-ray emission in the aftermath of novae. No successful measurement of this reaction existed prior to this work, and the rate used in stellar models had been calculated based on incomplete information from contributing resonances. Purpose: Of the two resonances thought to provide a significant contribution to the astrophysical reaction rate, located at E-c.m. = 330 and 665 keV, the former has a radiative width estimated from the assumed analog state in the mirror nucleus, F-19, while the latter resonance does not have an analog state assignment, resulting in an arbitrary radiative width being assumed. As such, a direct measurement was needed to establish what role this resonance plays in the destruction of F-18 at nova temperatures. This paper extends and takes the place of a previous Letter which reported the strength of the E-c.m. = 665 keV resonance. Method: The DRAGON recoil separator was used to directly measure the strength of the important 665-keV resonance in this reaction, in inverse kinematics, by observing Ne-19 reaction products. A radioactive F-18 beam was provided by the ISAC facility at TRIUMF. R-matrix calculations were subsequently used to evaluate the significance of the results at astrophysical energies. Results: We report the direct measurement of the F-18(p, gamma)Ne-19 reaction with the reevaluation of several detector efficiencies and the use of an updated Ne-19 level scheme in the reaction rate analysis. The strength of the 665-keV resonance (Ex = 7.076 MeV) is found to be an order of magnitude weaker than currently assumed in nova models. An improved analysis of the previously reported data is presented here, resulting in a slightly different value for the resonance strength. These small changes, however, do not alter the primary conclusions. Conclusions: Reaction rate calculations definitively show that the 665-keV resonance plays no significant role in the destruction of F-18 at nova temperatures. C1 [Akers, C.; Ruiz, C.; Buchmann, L.; Christian, G.; Davids, B.; Fallis, J.; Hutcheon, D.; Martin, L.; Ottewell, D.; Rojas, A.] TRIUMF, Vancouver, BC V6T 2A3, Canada. [Akers, C.; Laird, A. M.; Fulton, B. R.] Univ York, Dept Phys, York YO10 5DD, N Yorkshire, England. [Bardayan, D. W.] Oak Ridge Natl Lab, Div Phys, Oak Ridge, TN 37831 USA. [Erikson, L.] Pacific Northwest Natl Lab, Richland, WA 99354 USA. [Hager, U.] Colorado Sch Mines, Golden, CO 80401 USA. [Murphy, A. St J.] Univ Edinburgh, SUPA, Sch Phys & Astron, Edinburgh EH9 3JZ, Midlothian, Scotland. [Nelson, K.] McMaster Univ, Hamilton, ON L8S 4L8, Canada. [Spyrou, A.] Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA. [Spyrou, A.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Spyrou, A.] Michigan State Univ, Joint Inst Nucl Astrophys, E Lansing, MI 48824 USA. [Akers, C.] Inst for Basic Sci Korea, Rare Isotope Sci Project, 701,Yuseong Daero 1689 Gil, Daejeon 34047, South Korea. [Bardayan, D. W.] Univ Notre Dame, Dept Phys, Notre Dame, IN 46556 USA. [Christian, G.] Texas A&M Univ, Inst Cyclotron, College Stn, TX 77843 USA. [Christian, G.] Texas A&M Univ, Dept Phys & Astron, College Stn, TX 77843 USA. [Hager, U.] Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA. RP Akers, C (reprint author), TRIUMF, Vancouver, BC V6T 2A3, Canada.; Akers, C (reprint author), Univ York, Dept Phys, York YO10 5DD, N Yorkshire, England.; Akers, C (reprint author), Inst for Basic Sci Korea, Rare Isotope Sci Project, 701,Yuseong Daero 1689 Gil, Daejeon 34047, South Korea. EM cakers@ibs.re.kr FU TRIUMF through the National Research Council of Canada; Natural Sciences & Engineering Research Council of Canada; Science and Technology Facilities Council; National Science Foundation [PHY 11-02511, PHY 08-22648, PHY 14-19765]; DOE Office of Nuclear Physics FX The authors would like to thank the beam delivery and ISAC operations groups at TRIUMF. We are also extremely grateful for the invaluable assistance in beam production from Marik Dombsky and Pierre Bricault. Anuj Parikh and Jordi Jose also provided the authors with valuable correspondence. TRIUMF is funded through the National Research Council of Canada, and the DRAGON Program acknowledges the support of the Natural Sciences & Engineering Research Council of Canada. The U.K. authors would like to acknowledge the support of the Science and Technology Facilities Council. A.S. was supported by the National Science Foundation under Grant Nos. PHY 11-02511 and PHY 08-22648 ( Joint Institute for Nuclear Astrophysics). D.W.B. was supported by the DOE Office of Nuclear Physics and by National Science Foundation Grant No PHY 14-19765. The University of Edinburgh is a charitable body, registered in Scotland, with the registration number SC005336. NR 35 TC 0 Z9 0 U1 4 U2 4 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 15 PY 2016 VL 94 IS 6 AR 065803 DI 10.1103/PhysRevC.94.065803 PG 12 WC Physics, Nuclear SC Physics GA EF4BQ UT WOS:000390269900002 ER PT J AU Burr, T Croft, S Jarman, K Nicholson, A Norman, C Walsh, S AF Burr, Tom Croft, Stephen Jarman, Ken Nicholson, Andrew Norman, Claude Walsh, Stephen TI Improved uncertainty quantification in nondestructive assay for nonproliferation SO CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS LA English DT Article DE Approximate Bayesian computation; Calibration; Item-specific bias; Non-destructive assay; Uncertainty-quantification; Random error variance; Systematic error variance ID APPROXIMATE BAYESIAN COMPUTATION; INVERSE REGRESSION METHODS; MEASUREMENT ERROR; CALIBRATION; SPECTROSCOPY; IMPACT AB This paper illustrates methods to improve uncertainty quantification (UQ) for non-destructive assay (NDA) measurements used in nuclear nonproliferation. First, it is shown that current bottom-up UQ applied to calibration data is not always adequate, for three main reasons: (1) Because there are errors in both the predictors and the response, calibration involves a ratio of random quantities, and calibration data sets in NDA usually consist of only a modest number of samples (3-10); therefore, asymptotic approximations involving quantities needed for UQ such as means and variances are often not sufficiently accurate; (2) Common practice overlooks that calibration implies a partitioning of total error into random and systematic error, and (3) In many NDA applications, test items exhibit non-negligible departures in physical properties from calibration items, so model-based adjustments are used, but item-specific bias remains in some data. Therefore, improved bottom-up UQ using calibration data should predict the typical magnitude of item-specific bias, and the suggestion is to do so by including sources of item-specific bias in synthetic calibration data that is generated using a combination of modeling and real calibration data. Second, for measurements of the same nuclear material item by both the facility operator and international inspectors, current empirical (top-down) UQ is described for estimating operator and inspector systematic and random error variance components. A Bayesian alternative is introduced that easily accommodates constraints on variance components, and is more robust than current top-down methods to the underlying measurement error distributions. C1 [Burr, Tom; Norman, Claude] IAEA, Informat Management Safeguards Dept, Vienna, Austria. [Croft, Stephen; Nicholson, Andrew] Oak Ridge Natl Lab, Nucl Secur & Isotope Technol, Oak Ridge, TN USA. [Jarman, Ken] Pacific Northwest Natl Lab, Appl Stat & Computat Modeling, Richland, WA USA. [Walsh, Stephen] IAEA, Dept Safeguards, Qual Management, Vienna, Austria. RP Burr, T (reprint author), IAEA, Informat Management Safeguards Dept, Vienna, Austria. EM t.burr@iaea.org OI Walsh, Stephen/0000-0002-0505-648X NR 38 TC 0 Z9 0 U1 3 U2 3 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0169-7439 EI 1873-3239 J9 CHEMOMETR INTELL LAB JI Chemometrics Intell. Lab. Syst. PD DEC 15 PY 2016 VL 159 BP 164 EP 173 DI 10.1016/j.chemolab.2016.10.007 PG 10 WC Automation & Control Systems; Chemistry, Analytical; Computer Science, Artificial Intelligence; Instruments & Instrumentation; Mathematics, Interdisciplinary Applications; Statistics & Probability SC Automation & Control Systems; Chemistry; Computer Science; Instruments & Instrumentation; Mathematics GA EF1HA UT WOS:000390074700016 ER PT J AU Stevens, MJ Rempe, SLB AF Stevens, Mark J. Rempe, Susan L. B. TI Ion-Specific Effects in Carboxylate Binding Sites SO JOURNAL OF PHYSICAL CHEMISTRY B LA English DT Article ID DENSITY-FUNCTIONAL THEORY; INITIO MOLECULAR-DYNAMICS; QUASI-CHEMICAL THEORY; ALKALI-METAL IONS; GIBBS FREE-ENERGY; X-RAY-ABSORPTION; HOFMEISTER SERIES; AQUEOUS-SOLUTIONS; POLYMER ELECTROLYTES; HYDRATION STRUCTURE AB Specific ion binding by carboxylates (-COO-) is a broadly important topic because -COO- is one of the most common functional groups coordinated to metal ions in metalloproteins and synthetic polymers. We apply quantum chemical methods and the quasi-chemical free-energy theory to investigate how variations in the number of -COO- ligands in a binding site determine ion-binding preferences. We study a series of monovalent (Li+, Na+, K+, Cs+) and divalent (Zn2+, Ca2+) ions relevant to experimental work on ion channels and ionomers. Of two competing hypotheses, our results support the ligand field strength hypothesis and follow the reverse Hofmeister series for ion solvation and ion transfer from aqueous solution to binding sites with the preferred number of ligands. New insight arises from the finding that ion-binding sequences can be manipulated and even reversed just by constraining the number of carboxylate ligands in the binding sites. Our results help clarify the discrepancy in ion association between molecular ligands in aqueous solutions and ionomers, and their chemical analogues in ion-channel binding sites. C1 [Stevens, Mark J.] Sandia Natl Labs, Ctr Integrated Nanotechnol, POB 5800, Albuquerque, NM 87185 USA. [Rempe, Susan L. B.] Sandia Natl Labs, Biol & Engn Sci, POB 5800, Albuquerque, NM 87185 USA. RP Stevens, MJ (reprint author), Sandia Natl Labs, Ctr Integrated Nanotechnol, POB 5800, Albuquerque, NM 87185 USA.; Rempe, SLB (reprint author), Sandia Natl Labs, Biol & Engn Sci, POB 5800, Albuquerque, NM 87185 USA. EM msteve@sandia.gov; slrempe@sandia.gov FU Sandia's LDRD program; DTRA-Joint Science and Technology Office for Chemical & Biological Defense [DTRA10027IA-3167]; U.S. DOE's NNSA [DE-AC04-94AL85000]; U.S. DOE Office of BES user facility at Los Alamos National Lab [DE-AC52-06NA25396] FX This work was performed, in part, at the Center for Integrated Nanotechnologies, a U.S. DOE Office of BES user facility at Los Alamos National Lab (contract DE-AC52-06NA25396) and Sandia National Labs (contract DE-AC04-94AL85000). Funding was provided by Sandia's LDRD program and the DTRA-Joint Science and Technology Office for Chemical & Biological Defense (IAA number DTRA10027IA-3167) (S.L.B.R.). Sandia National Labs is a multimission laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. DOE's NNSA under contract DE-AC04-94AL85000. NR 99 TC 0 Z9 0 U1 14 U2 14 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1520-6106 J9 J PHYS CHEM B JI J. Phys. Chem. B PD DEC 15 PY 2016 VL 120 IS 49 BP 12519 EP 12530 DI 10.1021/acs.jpcb.6b10641 PG 12 WC Chemistry, Physical SC Chemistry GA EF1GB UT WOS:000390072200011 PM 27973817 ER PT J AU Horne, GP Grimes, TS Mincher, BJ Mezyk, SP AF Horne, G. P. Grimes, T. S. Mincher, B. J. Mezyk, S. P. TI Reevaluation of Neptunium-Nitric Acid Radiation Chemistry by Multiscale Modeling SO JOURNAL OF PHYSICAL CHEMISTRY B LA English DT Article ID TBP EXTRACTION SYSTEM; CATALYZED OXIDATION; AQUEOUS-SOLUTION; PULSE-RADIOLYSIS; GAMMA-RADIOLYSIS; KINETICS; EQUILIBRIUM; SIMULATION; ELECTRONS; MECHANISM AB Multiscale modeling has been used to quantitatively reevaluate the radiation chemistry of neptunium in a range of aerated nitric acid solutions (0.1-6.0 mol dm(-3)). Exact calculation of initial radiolytic yields accounting for changes in radiation track chemistry was found to be crucial for reproducing experimental data. The gamma irradiation induces changes in the Np(VI)/Np(V) oxidation-state distribution, predominantly driven by reactions involving HNO2, H2O2, NO2 center dot, and NO3 center dot from the radiolysis of aqueous nitric acid. Oxidation of Np(V) by NO3 center dot (k = 8.1 x 10(8) dm(3) mol(-1) s(-1)) provides the initial increase in Np(VI) concentration, while also delaying net reduction of Np(VI) by consuming HNO2. Reduction of Np(VI) is dominated by thermal reactions with HNO2 (k = 0.7-73 dm(3) mol(-1) s(-1)) and H2O2 (k = 1.9 dm(3) mol(-1) s(-1)). A steady state is eventually established once the concentration of Np(V) is sufficiently high to be oxidized by NO2 center dot (k= 2.4 x 10(2)-3.1 x 10(4) dm(3) mol(-1) s(-1)). An additional thermal oxidation reaction between Np(V) and HNO3 (k = 2.0 x 10(3) dm(3) mol(-1) s(-1)) is required for nitric acid concentrations >4.0 mol dm(-3). For 0.1 mol dm(-3) HNO3, the rate of Np(VI) reduction is in excess of that which can be accounted for by radiolytic product mass balance, suggesting the existence of a catalytic-acid-dependent reduction process. C1 [Horne, G. P.; Mezyk, S. P.] Calif State Univ Long Beach, Long Beach, CA 90804 USA. [Horne, G. P.] Univ Notre Dame, Radiat Res Lab, Notre Dame, IN 46556 USA. [Grimes, T. S.; Mincher, B. J.] Idaho Natl Lab, POB 1625, Idaho Falls, ID 83415 USA. RP Horne, GP (reprint author), Calif State Univ Long Beach, Long Beach, CA 90804 USA.; Horne, GP (reprint author), Univ Notre Dame, Radiat Res Lab, Notre Dame, IN 46556 USA. EM gregory.p.home@gmail.com RI Mincher, Bruce/C-7758-2017; OI Horne, Gregory/0000-0003-0596-0660 FU US-DOE; DOE-Idaho Operations Office [DE-AC07-05ID14517, DE-NE0008406] FX This research has been funded by the US-DOE Assistant Secretary for NE, under the FCR&D Radiation Chemistry program; DOE-Idaho Operations Office Contract DE-AC07-05ID14517 and DE-NE0008406 grant. NR 26 TC 1 Z9 1 U1 1 U2 1 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1520-6106 J9 J PHYS CHEM B JI J. Phys. Chem. B PD DEC 15 PY 2016 VL 120 IS 49 BP 12643 EP 12649 DI 10.1021/acs.jpcb.6b09683 PG 7 WC Chemistry, Physical SC Chemistry GA EF1GB UT WOS:000390072200022 PM 27973843 ER PT J AU Han, KS Rajput, NN Vijayakumar, M Wei, XL Wang, W Hu, JZ Persson, KA Mueller, KT AF Han, Kee Sung Rajput, Nav Nidhi Vijayakumar, M. Wei, Xiaoliang Wang, Wei Hu, Jianzhi Persson, Kristin A. Mueller, Karl T. TI Preferential Solvation of an Asymmetric Redox Molecule SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID ION-PAIR FORMATION; DYNAMICS; NUCLEATION; RELAXATION; SIMULATION; CARBONATE; SOLVENTS; LIQUIDS AB The fundamental correlations between solubility and solvation structure for the electrolyte system comprising N-(ferrocenylmethyl)-N,N-dimethyl-N-ethylammonium bistri-fluoromethylsulfonimide (Fc1N112-TFSI) dissolved in a ternary carbonate solvent mixture is analyzed using combined NMR relaxation and computational methods. Probing the evolution of the solvent solvent, ion solvent and ion ion interactions with an increase in solute concentration provides a molecular level understanding of the solubility limit of the Fc1N112-TFSI system. An increase in solute concentration leads to pronounced Fc1N112-TFSI contact-ion pair formation by diminishing solvent solvent and ion solvent type interactions. At the solubility limit, the precipitation of solute is initiated through agglomeration of contact ion pairs due to overlapping solvation shells. C1 [Han, Kee Sung; Vijayakumar, M.; Wei, Xiaoliang; Wang, Wei; Hu, Jianzhi; Mueller, Karl T.] Pacific Northwest Natl Lab, Richland, WA 99352 USA. [Rajput, Nav Nidhi; Persson, Kristin A.] Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA. [Han, Kee Sung; Rajput, Nav Nidhi; Vijayakumar, M.; Wei, Xiaoliang; Hu, Jianzhi; Persson, Kristin A.; Mueller, Karl T.] Joint Ctr Energy Storage Res, Lemont, IL 60439 USA. [Persson, Kristin A.] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. RP Vijayakumar, M; Mueller, KT (reprint author), Pacific Northwest Natl Lab, Richland, WA 99352 USA.; Vijayakumar, M; Mueller, KT (reprint author), Joint Ctr Energy Storage Res, Lemont, IL 60439 USA. EM vijay@pnnl.gov; karl.mueller@pnnl.gov RI Murugesan, Vijayakumar/C-6643-2011; Hu, Jian Zhi/F-7126-2012 OI Murugesan, Vijayakumar/0000-0001-6149-1702; FU U.S. Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES); DOE's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory (PNNL); Department of Energy [DE-AC02-06CH11357]; U.S. DOE's Office of Electricity Delivery and Energy Reliability [57558]; Battelle Memorial Institute [DE-AC05-76RL01830] FX This research was led intellectually by researchers within the Joint Center for Energy Storage Research (JCESR), an Energy Innovation Hub funded by the U.S. Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES). The NMR measurements were performed at the Environmental Molecular Sciences Laboratory (EMSL), a national scientific user facility sponsored by the DOE's Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory (PNNL). Work at LBNL was supported by the Department of Energy under Contract No. DE-AC02-06CH11357. We also thank the National Energy Research Scientific Computing Center (NERSC) for providing computing resources. The synthesis of Fc1N112-TFSI and the preparation of the electrolytes were supported by the U.S. DOE's Office of Electricity Delivery and Energy Reliability under Contract No. 57558. PNNL is operated for the U.S. DOE by Battelle Memorial Institute under contract number DE-AC05-76RL01830. NR 22 TC 0 Z9 0 U1 5 U2 5 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 27834 EP 27839 DI 10.1021/acs.jpcc.6b09114 PG 6 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100011 ER PT J AU D'Angelo, AM Wu, ZL Overbury, SH Chaffee, AL AF D'Angelo, Anita M. Wu, Zili Overbury, Steven H. Chaffee, Alan L. TI Cu-Enhanced Surface Defects and Lattice Mobility of Pr-CeO2 Mixed Oxides SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID PRASEODYMIA SOLID-SOLUTIONS; OXYGEN STORAGE CAPACITY; CERIUM OXIDE; CO OXIDATION; DOPED CERIA; THIN-FILMS; METHANOL OXIDATION; CATALYTIC-ACTIVITY; CEO2 NANOCRYSTALS; ISOTOPIC EXCHANGE AB The surface properties of CeO2, Pr-CeO2, and 5% and 15% Cu-doped Pr-CeO2 were investigated using methanol as a probe molecule through adsorption and desorption studies carried out using in situ DRIFTS. It was revealed that the surfaces of the 5% and 15% Cu materials were dominated by reduced cations/vacancies and that the 15% Cu material contained the highest concentration of these active species. The high oxygen storage capacity (OSC) of the 15% Cu material, as determined using TGA, reflects the available vacant sites for oxygen adsorption. Formates were formed on all materials, with those formed on the Cu-doped materials present at temperatures as low as 25 degrees C, hence showing their superior reactivity toward methoxy oxidation. During formate dehydrogenation, H-2, CO, CO2, and H2O evolved as the surface cations were simultaneously reduced. It was also observed that, for the Cu-containing materials, H-2 was not formed and the high surface mobility determined through isotopic exchange simultaneously generated CO and CO2. The exhibited high surface mobility, surface vacancies, and OSC of the 15% Cu material can be attributed to the formation of a secondary copper oxide phase observed using SEM-EDX spectroscopy. These results highlight the importance of surface defects in contrast to bulk defects. C1 [D'Angelo, Anita M.; Chaffee, Alan L.] Monash Univ, Sch Chem, Cooperat Res Ctr Greenhouse Gas Technol CO2CRC, Clayton, Vic 3800, Australia. [Wu, Zili; Overbury, Steven H.] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. [Wu, Zili; Overbury, Steven H.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. RP Chaffee, AL (reprint author), Monash Univ, Sch Chem, Cooperat Res Ctr Greenhouse Gas Technol CO2CRC, Clayton, Vic 3800, Australia. EM alan.chaffee@monash.edu OI Chaffee, Alan/0000-0001-5100-6910; D'Angelo, Anita/0000-0002-3068-5288; Wu, Zili/0000-0002-4468-3240 FU Australian Government through its Cooperative Research Centre program; Australian Coal Association Low Emission Technology Limited; Australian Government through the Clean Energy Initiative; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division; Australian Government through Australian National Low Emissions Coal Research & Development (ANLEC RD) scheme FX A.M.D. and A.L.C. gratefully acknowledge the financial support provided by the Australian Government through its Cooperative Research Centre program and through the Australian National Low Emissions Coal Research & Development (ANLEC R&D) scheme. ANLEC R&D is supported by Australian Coal Association Low Emission Technology Limited and the Australian Government through the Clean Energy Initiative. Z.W. and S.H.O. were supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division. Parts of the work including the DRIFTS and isotope exchange studies were conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility. The authors gratefully acknowledge the facilities within the Monash Centre for Electron Microscopy. NR 61 TC 0 Z9 0 U1 16 U2 16 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 27996 EP 28008 DI 10.1021/acs.jpcc.6b08947 PG 13 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100028 ER PT J AU Chlistunoff, J Sansinena, JM AF Chlistunoff, Jerzy Sansinena, Jose-Maria TI Nafion Induced Surface Confinement of Oxygen in Carbon-Supported Oxygen Reduction Catalysts SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID COBALT PHTHALOCYANINE; GAS-DIFFUSION; ACTIVE-SITES; FUEL-CELLS; THIN-FILM; MEMBRANES; METAL; ELECTROCATALYSTS; ELECTRODES; NITROGEN AB Surface confinement of oxygen inside layers of Nafion self-assembled on carbon-supported oxygen reduction reaction (ORR) catalysts was studied. It is demonstrated that oxygen accumulates in the hydrophobic component of the polymer remaining in contact with the carbon surface. The amount of surface confined oxygen increases with the degree of carbon surface graphitization, which promotes the self-assembly of the polymer. Planar macrocyclic ORR catalysts possessing a delocalized system of pi electrons such as Co and Fe porphyrins and phthalocyanines have virtually no effect on the surface confinement of oxygen, in accordance with their structural similarity to graphitic carbon surfaces where they adsorb. Platinum particles in carbon-supported ORR catalysts with high metal contents (20%) disrupt the self-assembly of Nafion and virtually eliminate the oxygen confinement, but the phenomenon is still observed for low Pt loading (4.8%) catalysts. C1 [Chlistunoff, Jerzy; Sansinena, Jose-Maria] Los Alamos Natl Lab, POB 1663, Los Alamos, NM 87545 USA. RP Chlistunoff, J (reprint author), Los Alamos Natl Lab, POB 1663, Los Alamos, NM 87545 USA. EM jerzy@lanl.gov FU UC Office of the President (Lab Fees Research Program) [12-LR-237440] FX The financial support from the UC Office of the President (Lab Fees Research Program, Grant ID No. 12-LR-237440) is gratefully acknowledged. NR 57 TC 0 Z9 0 U1 25 U2 25 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 28038 EP 28048 DI 10.1021/acs.jpcc.6b09523 PG 11 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100032 ER PT J AU Nelson, NC Manzano, JS Slowing, II AF Nelson, Nicholas C. Manzano, J. Sebastian Slowing, Igor I. TI Deactivation of Ceria Supported Palladium through C-C Scission during Transfer Hydrogenation of Phenol with Alcohols SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID TEMPERATURE-PROGRAMMED DESORPTION; NOBLE-METAL CATALYSTS; ACID-BASE PROPERTIES; X-RAY PHOTOELECTRON; SITU FT-IR; PARTIAL OXIDATION; REACTION-MECHANISM; SURFACE-REACTIONS; POLYCRYSTALLINE CERIA; STRUCTURE SENSITIVITY AB The stability of palladium supported on ceria (Pd/CeO2) was studied during liquid flow transfer hydrogenation using primary and secondary alcohols as hydrogen donors. For primary alcohols, the ceria support was reduced to cerium hydroxy carbonate within 14 h and was a contributing factor toward catalyst deactivation. For secondary alcohols, cerium hydroxy carbonate was not observed during the same time period and the catalyst was stable upon prolonged reaction. Regeneration through oxidation/reduction does not restore initial activity likely due to irreversible catalyst restructuring. A deactivation mechanism involving C-C scission of acyl and carboxylate intermediates is proposed. C1 [Nelson, Nicholas C.; Manzano, J. Sebastian; Slowing, Igor I.] US DOE, Ames Lab, Ames, IA 50011 USA. [Nelson, Nicholas C.; Manzano, J. Sebastian; Slowing, Igor I.] Iowa State Univ, Dept Chem, Ames, IA 50011 USA. RP Slowing, II (reprint author), US DOE, Ames Lab, Ames, IA 50011 USA.; Slowing, II (reprint author), Iowa State Univ, Dept Chem, Ames, IA 50011 USA. EM islowing@iastate.edu FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences, through the Ames Laboratory Catalysis Science program; U.S. Department of Energy by Iowa State University [DE-AC02-07CH11358] FX This research is supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences, through the Ames Laboratory Catalysis Science program. The Ames Laboratory is operated for the U.S. Department of Energy by Iowa State University under Contract No. DE-AC02-07CH11358. NR 81 TC 0 Z9 0 U1 16 U2 16 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 28067 EP 28073 DI 10.1021/acs.jpcc.6b09828 PG 7 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100035 ER PT J AU O'Brien, CJ Greathouse, JA Tenney, CM AF O'Brien, Christopher J. Greathouse, Jeffery A. Tenney, Craig M. TI Dissociation of Sarin on a Cement Analogue Surface: Effects of Humidity and Confined Geometry SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID MOLECULAR-DYNAMICS SIMULATIONS; CHEMICAL WARFARE AGENTS; SULFUR MUSTARD; S(N)2 REACTION; FORCE-FIELD; ADSORPTION; DENSITY; DECOMPOSITION; DEGRADATION; CONCRETE AB First-principles molecular dynamics simulations were used to investigate the dissociation of sarin (GB) on the calcium silicate hydrate (CSH) mineral tobermorite (TBM), a surrogate for cement. CSH minerals (including TBM) and amorphous materials of similar composition are the major components of Portland cement, the binding agent of concrete. Metadynamics simulations were used to investigate the effect of the TBM surface and confinement in a microscale pore on the mechanism and free energy of dissociation of GB. Our results indicate that both the adsorption site and the humidity of the local environment significantly affect the sarin dissociation energy. In particular, sarin dissociation in a low-water environment occurs via a dealkylation mechanism, which is consistent with previous experimental studies. C1 [O'Brien, Christopher J.] Sandia Natl Labs, Dept Computat Mat & Data Sci, Albuquerque, NM 87185 USA. [Greathouse, Jeffery A.; Tenney, Craig M.] Sandia Natl Labs, Dept Geochem, Albuquerque, NM 87185 USA. RP O'Brien, CJ (reprint author), Sandia Natl Labs, Dept Computat Mat & Data Sci, Albuquerque, NM 87185 USA. EM cjobrie@sandia.gov OI O'Brien, Christopher/0000-0001-7210-9257 FU U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX Sandia National Laboratories is a multimission laboratory managed and operated by Sandia Corp., a wholly owned subsidiary of Lockheed Martin Corp., for the U.S. Department of Energy's National Nuclear Security Administration under Contract DE-AC04-94AL85000. The authors thank Todd Alam for reviewing a draft of the manuscript and suggesting clarifications. NR 49 TC 0 Z9 0 U1 3 U2 3 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 28100 EP 28109 DI 10.1021/acs.jpcc.6b10046 PG 10 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100039 ER PT J AU Sharma, G Naguib, M Feng, D Gogotsi, Y Navrotsky, A AF Sharma, Geetu Naguib, Michael Feng, Dawei Gogotsi, Yury Navrotsky, Alexandra TI Calorimetric Determination of Thermodynamic Stability of MAX and MXene Phases SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID TRANSITION-METAL CARBIDES; 2-DIMENSIONAL TITANIUM CARBIDE; HIGH-TEMPERATURE CALORIMETRY; HIGH VOLUMETRIC CAPACITANCE; FAMILY; THERMOCHEMISTRY; INTERCALATION; EXFOLIATION; DIRECTIONS; NANOSHEETS AB MXenes are layered two-dimensional materials with exciting properties useful to a wide range of energy applications. They are derived from ceramics (MAX phases) by leaching, and their properties reflect their resulting complex compositions which include intercalating cations and anions and water. Their thermodynamic stability is likely linked to these functional groups but has not yet been addressed by quantitative experimental measurements. We report enthalpies of formation from the elements at 25 degrees C measured using high temperature oxide melt solution calorimetry for a layered TiAlC MAX phase, and the corresponding TiC based MXene. The thermodynamic stability of the Ti3C2Tx MXene (T-x stands for anionic surface moieties, and intercalated cations) was assessed by calculating the enthalpy of reaction of the MAX phase (ideal composition Ti3AlC2) to form MXene. The very exothermic enthalpy of reaction confirms the stability of MXene in an aqueous environment. The surface terminations (O, OH, and F) and cations (Li) chemisorbed on the surface and intercalated in the interlayers play a major role in the thermodynamic stabilization of MXene. These findings help in understanding and potentially improving properties and performance by characterizing the energetics of species binding to MXene surfaces during synthesis and in energy storage, water desalination, and other applications. C1 [Sharma, Geetu; Feng, Dawei; Navrotsky, Alexandra] Univ Calif Davis, NEAT ORU, Peter A Rock Thermochem Lab, Davis, CA 95616 USA. [Naguib, Michael] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37381 USA. [Gogotsi, Yury] Drexel Univ, Dept Mat Sci & Engn, Philadelphia, PA 19104 USA. [Gogotsi, Yury] Drexel Univ, AJ Drexel Nanomat Inst, Philadelphia, PA 19104 USA. RP Navrotsky, A (reprint author), Univ Calif Davis, NEAT ORU, Peter A Rock Thermochem Lab, Davis, CA 95616 USA. EM anavrotsky@ucdavis.edu OI Naguib, Michael/0000-0002-4952-9023; Gogotsi, Yury/0000-0001-9423-4032 FU Fluid Interface Reactions, Structures & Transport, an Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [4000134953] FX This work was supported by the Fluid Interface Reactions, Structures & Transport, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Award 4000134953. NR 36 TC 1 Z9 1 U1 45 U2 45 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 28131 EP 28137 DI 10.1021/acs.jpcc.6b10241 PG 7 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100042 ER PT J AU Kulasinski, K Guyer, RA AF Kulasinski, Karol Guyer, Robert A. TI Quantification of Nanopore Networks: Application to Amorphous Polymers SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID CANONICAL MONTE-CARLO; CAPILLARY CONDENSATION; NITROGEN ADSORPTION; NEUTRON-SCATTERING; POROUS-MEDIA; TORTUOSITY; POROSITY; DIFFUSION; CRYSTALLINE; TOMOGRAPHY AB We present numerical recipes to quantify the properties of pore networks in nanoporous materials, to be used as a postprocessing tool for Molecular Dynamics. The method we demonstrate allows determination of the total porosity, the porosity accessible to the solvent, the pore size distribution, and both pore network conductivity and tortuosity, by using atom type and coordinates. The pore diameter distribution is obtained from the chord distribution and demonstrated to be more accurate. The tortuosity of pore system is estimated based on NernstEinstein equation and does not require diffusion calculation. In the case study we investigate the impact of water adsorption on pore structure of two different amorphous polymers. We find out, quantitatively, that as the polymer absorb water, its porosity and average pore size increase, followed by an increase in conductivity and a decrease in tortuosity, which finds validation in experimental studies. C1 [Kulasinski, Karol] Lawrence Berkeley Natl Lab, Dept Geochem, Berkeley, CA 94720 USA. [Guyer, Robert A.] Los Alamos Natl Lab, Solid Earth Geophys Grp, Los Alamos, NM 87545 USA. [Guyer, Robert A.] Univ Nevada, Dept Phys, Reno, NV 89557 USA. RP Kulasinski, K (reprint author), Lawrence Berkeley Natl Lab, Dept Geochem, Berkeley, CA 94720 USA. EM kulasinski@gmail.com OI Kulasinski, Karol/0000-0002-7704-7048 NR 31 TC 0 Z9 0 U1 4 U2 4 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 28144 EP 28151 DI 10.1021/acs.jpcc.6b10777 PG 8 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100044 ER PT J AU Dreier, TA Compel, WS Wong, OA Ackerson, CJ AF Dreier, Timothy A. Compel, W. Scott Wong, O. Andrea Ackerson, Christopher J. TI Oxygen's Role in Aqueous Gold Cluster Synthesis SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID BRUST-SCHIFFRIN SYNTHESIS; LIGAND-EXCHANGE; AU-25 NANOCLUSTERS; OPTICAL-PROPERTIES; CRYSTAL-STRUCTURE; AU-144(SR)(60) NANOCLUSTERS; AU-25(SR)(18) NANOCLUSTERS; METAL NANOCLUSTERS; THERMAL-STABILITY; MASS-SPECTROMETRY AB The presence of oxygen in thiolate-protected gold nanoparticle synthesis influences product distribution. Oxygen's diradical nature underlies this effect, and oxygen can be replaced with radical initiators in the synthesis of organosoluble gold nanoclusters. The role of O-2 in the synthesis of water-soluble clusters such as Au-102(p-MBA)(44), Au-25(SR)(18), as well as the thiol etching of water-soluble colloidal gold particles is not yet established. Herein it is shown that radicals, either from O-2 or from radical initiators such as 4-hydroxy-TEMPO, are necessary components for synthesis of water-soluble thiolate-protected gold nanoclusters, as well as the etching of aqueous colloidal gold by thiols. Furthermore, air-free synthetic routes to watersoluble gold nanoclusters Au-102(SR)(44) and Au-25(SR)(18) are described. Overall, the understanding of the role of radicals in the synthesis of water-soluble gold clusters will allow standardization of often difficult to reproduce syntheses that attract increasing attention for biological applications. C1 [Dreier, Timothy A.; Compel, W. Scott; Wong, O. Andrea; Ackerson, Christopher J.] Colorado State Univ, Dept Chem, Ft Collins, CO 80523 USA. [Compel, W. Scott] Lawrence Livermore Natl Lab, Livermore, CA USA. [Wong, O. Andrea] SAFC, Sigma Aldrich, Madison, WI USA. RP Ackerson, CJ (reprint author), Colorado State Univ, Dept Chem, Ft Collins, CO 80523 USA. EM ackerson@colostate.edu FU [NSF CHE 1507646] FX The authors acknowledge Grant NSF CHE 1507646 for funding. We also acknowledge the Colorado State University Central Instruments Facility for helpful discussions regarding mass spectrometry techniques. NR 95 TC 0 Z9 0 U1 17 U2 17 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 15 PY 2016 VL 120 IS 49 BP 28288 EP 28294 DI 10.1021/acs.jpcc.6b09110 PG 7 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EF1GA UT WOS:000390072100059 ER PT J AU Li, ZJ Zhan, F Xiao, HY Zhang, XY Kong, QY Fan, XB Liu, WQ Huang, MY Huang, C Gao, YJ Li, XB Meng, QY Feng, K Chen, B Tung, CH Zhao, HF Tao, Y Wu, LZ AF Li, Zhi-Jun Zhan, Fei Xiao, Hongyan Zhang, Xiaoyi Kong, Qing-Yu Fan, Xiang-Bing Liu, Wen-Qiang Huang, Mao-Yong Huang, Cheng Gao, Yu-Ji Li, Xu-Bing Meng, Qing-Yuan Feng, Ke Chen, Bin Tung, Chen-Ho Zhao, Hai-Feng Tao, Ye Wu, Li-Zhu TI Tracking Co(I) Intermediate in Operando in Photocatalytic Hydrogen Evolution by X-ray Transient Absorption Spectroscopy and DFT Calculation SO JOURNAL OF PHYSICAL CHEMISTRY LETTERS LA English DT Article ID AQUEOUS-SOLUTION; COBALT COMPLEX; POLYPYRIDYL CATALYSTS; WATER; REDUCTION; PATHWAYS; COBALOXIME; MECHANISM; DYNAMICS; SYSTEM AB X-ray transient absorption spectroscopy (XTA) and optical transient spectroscopy (OTA) were used to probe the Co(I) intermediate generated in situ from an aqueous photocatalytic hydrogen evolution system, with [Ru-II(bpy)(3)]Cl-2 center dot 6H(2)O as the photosensitizer, ascorbic acid/ascorbate as the electron donor, and the Co-polypyridyl complex ([Co-II(DPA-Bpy)Cl]Cl) as the precatalyst. Upon exposure to light, the XTA measured at Co K-edge visualizes the grow and decay of the Co(I) intermediate, and reveals its Co-N bond contraction of 0.09 +/- 0.03 angstrom. Density functional theory (DFT) calculations support the bond contraction and illustrate that the metal-to-ligand pi back bonding greatly stabilizes the penta-coordinated Co(I) intermediate, which provides easy photon access. To the best of our knowledge, this is the first example of capturing the penta-coordinated Co(I) intermediate in operando with bond contraction by XTA, thereby providing new insights for fundamental understanding of structure-function relationship of cobalt-based molecular catalysts. C1 [Li, Zhi-Jun; Xiao, Hongyan; Fan, Xiang-Bing; Liu, Wen-Qiang; Huang, Mao-Yong; Huang, Cheng; Gao, Yu-Ji; Li, Xu-Bing; Meng, Qing-Yuan; Feng, Ke; Chen, Bin; Tung, Chen-Ho; Wu, Li-Zhu] Chinese Acad Sci, Key Lab Photochem Convers & Optoelect Mat, Tech Inst Phys & Chem, Beijing 100190, Peoples R China. [Zhan, Fei; Zhao, Hai-Feng; Tao, Ye] Chinese Acad Sci, Beijing Synchrotron Radiat Facil, Inst High Energy Phys, Beijing 100049, Peoples R China. [Zhang, Xiaoyi] Argonne Natl Lab, Xray Sci Div, Adv Photon Source, Argonne, IL 60430 USA. [Kong, Qing-Yu] Synchrotron SOLEIL, LOrme Merisiers, F-91192 Gif Sur Yvette, France. RP Wu, LZ (reprint author), Chinese Acad Sci, Key Lab Photochem Convers & Optoelect Mat, Tech Inst Phys & Chem, Beijing 100190, Peoples R China.; Tao, Y (reprint author), Chinese Acad Sci, Beijing Synchrotron Radiat Facil, Inst High Energy Phys, Beijing 100049, Peoples R China. EM taoy@ihep.ac.cn; lzwu@mail.ipc.ac.cn FU Ministry of Science and Technology of China [2014CB239402, 2013CB834505, 2013CB834804]; National Science Foundation of China [91427303, 21390404, 21403260, U1332205, 51373193]; Strategic Priority Research Program of the Chinese Academy of Science [XDB17030200]; Youth Innovation Promotion Association of Chinese Academy of Sciences [2016022]; Knowledge Innovation Program of the Chinese Academy of Sciences [KJCX2-YW-N42]; U.S. Department of Energy Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory [DE-AC02-06CH11357] FX This work is financially supported by the Ministry of Science and Technology of China (2014CB239402, 2013CB834505, and 2013CB834804), the National Science Foundation of China (91427303, 21390404, 21403260, U1332205, and 51373193), the Strategic Priority Research Program of the Chinese Academy of Science (XDB17030200), the Youth Innovation Promotion Association of Chinese Academy of Sciences (2016022), and the Knowledge Innovation Program of the Chinese Academy of Sciences (KJCX2-YW-N42). We thank Beijing Synchrotron Radiation Facility (BSRF, Beamline IW2B) for providing the beam time of X-ray absorption measurements. X.Z. acknowledges use of the Advanced Photon Source and the U.S. Department of Energy Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. NR 42 TC 0 Z9 0 U1 18 U2 18 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1948-7185 J9 J PHYS CHEM LETT JI J. Phys. Chem. Lett. PD DEC 15 PY 2016 VL 7 IS 24 BP 5253 EP 5258 DI 10.1021/acsjpclett.6b02479 PG 6 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Atomic, Molecular & Chemical SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EF1LT UT WOS:000390087000046 PM 27973864 ER PT J AU Lu, CY Niu, LL Chen, NJ Jin, K Yang, TN Xiu, PY Zhang, YW Gao, F Bei, HB Shi, S He, MR Robertson, IM Weber, WJ Wang, LM AF Lu, Chenyang Niu, Liangliang Chen, Nanjun Jin, Ke Yang, Taini Xiu, Pengyuan Zhang, Yanwen Gao, Fei Bei, Hongbin Shi, Shi He, Mo-Rigen Robertson, Ian M. Weber, William J. Wang, Lumin TI Enhancing radiation tolerance by controlling defect mobility and migration pathways in multicomponent single-phase alloys SO NATURE COMMUNICATIONS LA English DT Article ID ION-IRRADIATION; NI-ALLOYS; DAMAGE; EVOLUTION; ENERGY; COPPER; STEEL; DIFFUSION; ENTROPY; HELIUM AB A grand challenge in material science is to understand the correlation between intrinsic properties and defect dynamics. Radiation tolerant materials are in great demand for safe operation and advancement of nuclear and aerospace systems. Unlike traditional approaches that rely on microstructural and nanoscale features to mitigate radiation damage, this study demonstrates enhancement of radiation tolerance with the suppression of void formation by two orders magnitude at elevated temperatures in equiatomic single-phase concentrated solid solution alloys, and more importantly, reveals its controlling mechanism through a detailed analysis of the depth distribution of defect clusters and an atomistic computer simulation. The enhanced swelling resistance is attributed to the tailored interstitial defect cluster motion in the alloys from a long-range one-dimensional mode to a short-range three-dimensional mode, which leads to enhanced point defect recombination. The results suggest design criteria for next generation radiation tolerant structural alloys. C1 [Lu, Chenyang; Niu, Liangliang; Chen, Nanjun; Yang, Taini; Xiu, Pengyuan; Gao, Fei; Wang, Lumin] Univ Michigan, Dept Nucl Engn & Radiol Sci, Ann Arbor, MI 48109 USA. [Jin, Ke; Zhang, Yanwen; Bei, Hongbin; Weber, William J.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Zhang, Yanwen; Weber, William J.] Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USA. [Shi, Shi; He, Mo-Rigen; Robertson, Ian M.] Univ Wisconsin, Dept Engn Phys, Madison, WI 53706 USA. [Wang, Lumin] Univ Michigan, Dept Mat Sci & Engn, Ann Arbor, MI 48109 USA. RP Wang, LM (reprint author), Univ Michigan, Dept Nucl Engn & Radiol Sci, Ann Arbor, MI 48109 USA.; Wang, LM (reprint author), Univ Michigan, Dept Mat Sci & Engn, Ann Arbor, MI 48109 USA. EM lmwang@umich.edu RI Weber, William/A-4177-2008; OI Weber, William/0000-0002-9017-7365; Jin, Ke/0000-0001-7697-0466; Bei, Hongbin/0000-0003-0283-7990 FU Energy Dissipation to Defect Evolution (EDDE) Center, an Energy Frontier Research Center - US Department of Energy, Office of Science, Basic Energy Sciences FX This work was supported as part of the Energy Dissipation to Defect Evolution (EDDE) Center, an Energy Frontier Research Center funded by the US Department of Energy, Office of Science, Basic Energy Sciences. Ion beam work was performed at the UT-ORNL Ion Beam Materials Laboratory located on the campus of the University of Tennessee-Knoxville. MD simulation was performed using the supercomputer of Flux at University of Michigan. Cross-sectional TEM was conducted in the Michigan Center for Material Characterization of the University of Michigan. In situ TEM during ion irradiation was carried out using the IVEM-Tandem Facility at Argonne National Laboratory. NR 39 TC 0 Z9 0 U1 35 U2 35 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 15 PY 2016 VL 7 AR 13564 DI 10.1038/ncomms13564 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF4GC UT WOS:000390282200001 PM 27976669 ER PT J AU Moon, CY Park, H Haule, K Shim, JH AF Moon, Chang-Youn Park, Hyowon Haule, Kristjan Shim, Ji Hoon TI Origin of doping-induced suppression and reemergence of magnetism in LaFeAsO1-xHx SO PHYSICAL REVIEW B LA English DT Article ID IRON-BASED SUPERCONDUCTORS; LAYERED SUPERCONDUCTOR; ELECTRONIC-STRUCTURE; PNICTIDES; DYNAMICS; LAOFEP AB We investigate the evolution of magnetic properties as a function of hydrogen doping in the iron-based superconductor LaFeAsO1-xHx using dynamical mean-field theory combined with density-functional theory. We find that two independent consequences of doping, namely the increase of the electron occupation and the structural modification, have the opposite effects on the strength of electron correlation and magnetism, resulting in the minimum of the calculated magnetic moment around the intermediate doping level as a function of x. Our result provides a natural explanation for the recent, puzzling experimental discovery of two separated antiferromagnetic phases at low and high doping limits. Furthermore, the increase of the orbital occupation and correlation strength with doping results in reduced orbital polarization of d(xz/yz) orbitals and an enhanced role of the d(xy) orbital in the magnetism at high doping levels, and their possible implications on the superconductivity are discussed in line with the essential role of the magnetism. C1 [Moon, Chang-Youn] Korea Res Inst Stand & Sci, Mat Genome Ctr, Yuseong 305340, Daejeon, South Korea. [Park, Hyowon] Univ Illinois, Dept Phys, Chicago, IL 60607 USA. [Park, Hyowon] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. [Haule, Kristjan] Rutgers State Univ, Dept Phys, Piscataway, NJ 08854 USA. [Shim, Ji Hoon] Pohang Univ Sci & Technol, Dept Chem, Pohang 790784, South Korea. RP Moon, CY (reprint author), Korea Res Inst Stand & Sci, Mat Genome Ctr, Yuseong 305340, Daejeon, South Korea. EM cymoon@kriss.re.kr; jhshim@postech.ac.kr FU Basic Science Research Program through National Research Foundation of Korea (NRF) - Ministry of Science, ICT & Future Planning [2016R1C1B1014715, 2015R1D1A1A01059621] FX This research was supported by the Basic Science Research Program through the National Research Foundation of Korea (NRF) funded by the Ministry of Science, ICT & Future Planning (2016R1C1B1014715 and 2015R1D1A1A01059621). NR 81 TC 0 Z9 0 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 15 PY 2016 VL 94 IS 22 AR 224511 DI 10.1103/PhysRevB.94.224511 PG 8 WC Physics, Condensed Matter SC Physics GA EF3UV UT WOS:000390251100003 ER PT J AU Dawson, S Jaiswal, P Li, Y Ramani, H Zeng, M AF Dawson, S. Jaiswal, P. Li, Ye Ramani, Harikrishnan Zeng, Mao TI Resummation of jet veto logarithms at (NLLa)-L-3 + NNLO for W+W- production at the LHC SO PHYSICAL REVIEW D LA English DT Article ID COLLINEAR EFFECTIVE THEORY; QCD CORRECTIONS; CROSS-SECTIONS; GLUON FUSION; W+W AB We compute the resummed on-shell W+W- production cross section under a jet veto at the LHC to partial (NLL)-L-3 order matched to the fixed-order NNLO result. Differential NNLO cross sections are obtained from an implementation of q(T) subtraction in Sherpa. The two-loop virtual corrections to the q (q) over bar -> W+W- amplitude, used in both fixed-order and resummation predictions, arc extracted from the public code qqvvamp. We perform resummation using soft collinear effective theory, with approximate beam functions where only the logarithmic terms are included at two-loop. In addition to scale uncertainties from the hard matching scale and the factorization scale, rapidity scale variations are obtained within the analytic regulator approach. Our resummation results show a decrease in the jet veto cross section compared to NNLO fixed-order predictions, with reduced scale uncertainties compared to NNLL + NLO resummed predictions. We include the loop-induced gg contribution with jet veto resurnmation to NLL + LO. The prediction shows good agreement with recent LHC measurements. C1 [Dawson, S.] Brookhaven Natl Lab, Dept Phys, Upton, NY 11973 USA. [Jaiswal, P.] Brown Univ, Dept Phys, Providence, RI 02912 USA. [Li, Ye] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Ramani, Harikrishnan] SUNY Stony Brook, CN Yang Inst Theoret Phys, Stony Brook, NY 11794 USA. [Zeng, Mao] Univ Calif Los Angeles, Dept Phys & Astron, Los Angeles, CA 90095 USA. RP Dawson, S (reprint author), Brookhaven Natl Lab, Dept Phys, Upton, NY 11973 USA. FU U.S. Department of Energy [DE-AC02-76SF00515, DE-AC02-07CH11359]; NSF CAREER [NSF-PHY-1056833]; Department of Energy [DE-SC0009937] FX We would like to thank Stefan Hoeche for help with implementing NNLO qT subtraction in Sherpa and for many useful discussions about the Sherpa framework. We also thank Stefano Pozzorini and Philipp Maierhofer for providing a customized OpenLoops library with nf = 4 for the real-virtual part of NNLO WW production. The work of S. D. is supported by the U.S. Department of Energy under Contract No. DE-AC02-76SF00515. The work of H. R. is supported in part by NSF CAREER Grant No. NSF-PHY-1056833. The work of M. Z. is supported by the Department of Energy under Award No. DE-SC0009937. Fermilab is operated by Fermi Research Alliance, LLC under Contract No. DE-AC02-07CH11359 with the U.S. Department of Energy. NR 77 TC 1 Z9 1 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 15 PY 2016 VL 94 IS 11 AR 114014 DI 10.1103/PhysRevD.94.114014 PG 9 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF4DO UT WOS:000390275100004 ER PT J AU Fukuto, M Ocko, BM Bonthuis, DJ Netz, RR Steinruck, HG Pontoni, D Kuzmenko, I Haddad, J Deutsch, M AF Fukuto, M. Ocko, B. M. Bonthuis, D. J. Netz, R. R. Steinruck, H. -G. Pontoni, D. Kuzmenko, I. Haddad, J. Deutsch, M. TI Nanoscale Structure of the Oil-Water Interface SO PHYSICAL REVIEW LETTERS LA English DT Article ID X-RAY REFLECTIVITY; LIQUID SURFACES; LENGTH SCALES; HYDROPHOBICITY; POTENTIALS; RESOLUTION; FORCE AB X-ray reflectivity (XR) and atomistic molecular dynamics (MD) simulations, carried out to determine the structure of the oil-water interface, provide new insight into the simplest liquid-liquid interface. For several oils (hexane, dodecane, and hexadecane) the XR shows very good agreement with a monotonic interface-normal electron density profile (EDP) broadened only by capillary waves. Similar agreement is also found for an EDP including a sub-angstrom thick electron depletion layer separating the oil and the water. The XR and MD derived depletions are much smaller than reported for the interface between solid-supported hydrophobic monolayers and water. C1 [Fukuto, M.; Ocko, B. M.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Fukuto, M.; Ocko, B. M.] Brookhaven Natl Lab, NSLS II, Upton, NY 11973 USA. [Bonthuis, D. J.] Univ Oxford, Rudolf Peierls Ctr Theoret Phys, 1 Keble Rd, Oxford OX1 3NP, England. [Netz, R. R.] Free Univ Berlin, Dept Phys, D-14195 Berlin, Germany. [Steinruck, H. -G.] SLAC Natl Accelerator Lab, Stanford Synchrotron Radiat Lightsource, Menlo Pk, CA 94025 USA. [Pontoni, D.] ESRF European Synchrotron, 71 Ave Martyrs, F-38000 Grenoble, France. [Kuzmenko, I.] Argonne Natl Lab, Adv Photon Source, Lemont, IL 60439 USA. [Haddad, J.; Deutsch, M.] Bar Ilan Univ, Dept Phys, IL-52900 Ramat Gan, Israel. [Haddad, J.; Deutsch, M.] Bar Ilan Univ, Inst Nanotechnol, IL-52900 Ramat Gan, Israel. RP Fukuto, M (reprint author), Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA.; Fukuto, M (reprint author), Brookhaven Natl Lab, NSLS II, Upton, NY 11973 USA. EM fukuto@bnl.gov; ocko@bnl.gov RI Steinruck, Hans-Georg/A-6382-2015 FU U.S. Department of Energy, Office of Basic Energy Sciences, in the CMPMS [DE-SC0012704]; NSLS II Departments at BNL; U.S.-Israel Binational Science Foundation, Jerusalem; [DE-AC02-06CH11357] FX We thank V. Honkimaki and H. Reichert for discussions and advice, and gratefully acknowledge support by the U.S. Department of Energy, Office of Basic Energy Sciences, under Contracts No. DE-SC0012704 (M.F., B. M. O) in the CMPMS and NSLS II Departments at BNL and DE-AC02-06CH11357 for beamtime and support at 9ID at the APS at ANL, the U.S.-Israel Binational Science Foundation, Jerusalem (M. D.) and the ESRF for beamtime at ID15A and for PSCM support. NR 33 TC 0 Z9 0 U1 20 U2 20 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 15 PY 2016 VL 117 IS 25 AR 256102 DI 10.1103/PhysRevLett.117.256102 PG 5 WC Physics, Multidisciplinary SC Physics GA EF3ME UT WOS:000390227700007 PM 28036213 ER PT J AU Maiti, S Maier, TA Bohm, T Hackl, R Hirschfeld, PJ AF Maiti, S. Maier, T. A. Boehm, T. Hackl, R. Hirschfeld, P. J. TI Probing the Pairing Interaction and Multiple Bardasis-Schrieffer Modes Using Raman Spectroscopy SO PHYSICAL REVIEW LETTERS LA English DT Article ID IRON-BASED SUPERCONDUCTORS; FE-BASED SUPERCONDUCTORS; SCATTERING; MECHANISM; SYMMETRY AB In unconventional superconductors, understanding the form of the pairing interaction is the primary goal. In this regard, Raman spectroscopy is a very useful tool, as it identifies the ground state and also the subleading pairing channels by probing collective modes. Here, we propose a general theory for a multiband Raman response and identify new features in the spectrum that can provide a robust test for a pairing theory. We identify multiple Bardasis-Schrieffer type collective modes and connect the weights of these modes to the subleading gap structures within a microscopic pairing theory. While our conclusions are completely general, we apply our approach to interpret the specific case of B-1g Raman scattering in hole-doped BaFe2As2. C1 [Maiti, S.; Hirschfeld, P. J.] Univ Florida, Dept Phys, Gainesville, FL 32611 USA. [Maier, T. A.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci & Comp Sci, Oak Ridge, TN 37831 USA. [Maier, T. A.] Oak Ridge Natl Lab, Div Math, Oak Ridge, TN 37831 USA. [Boehm, T.; Hackl, R.] Bayer Akad Wissensch, Walther Meissner Inst, D-85748 Garching, Germany. [Boehm, T.] Tech Univ Munich, Fak Phys E23, D-85748 Garching, Germany. RP Maiti, S (reprint author), Univ Florida, Dept Phys, Gainesville, FL 32611 USA. FU U.S. Department of Energy [DE-FG02-05ER46236]; National Science Foundation [PHY-1066293]; DFG via the Priority Program [SPP 1458, HA 2071/7]; Transregional Collaborative Research Center [TRR 80] FX The authors are grateful for useful discussions with L. Benfatto, A. Chubukov, D. Einzel, and D. Scalapino. P. J. H. was supported by U.S. Department of Energy Grant No. DE-FG02-05ER46236. The RPA calculations were conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility. P. J. H.'s work was performed in part at the Aspen Center for Physics, which is supported by National Science Foundation Grant No. PHY-1066293. Financial support from the DFG via the Priority Program SPP 1458 (Project No. HA 2071/7) and the Transregional Collaborative Research Center TRR 80 is gratefully acknowledged. NR 27 TC 1 Z9 1 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 15 PY 2016 VL 117 IS 25 AR 257001 DI 10.1103/PhysRevLett.117.257001 PG 5 WC Physics, Multidisciplinary SC Physics GA EF3ME UT WOS:000390227700008 PM 28036201 ER PT J AU Minamisono, K Rossi, DM Beerwerth, R Fritzsche, S Garand, D Klose, A Liu, Y Maass, B Mantica, PF Miller, AJ Muller, P Nazarewicz, W Nortershauser, W Olsen, E Pearson, MR Reinhard, PG Saperstein, EE Sumithrarachchi, C Tolokonnikov, SV AF Minamisono, K. Rossi, D. M. Beerwerth, R. Fritzsche, S. Garand, D. Klose, A. Liu, Y. Maass, B. Mantica, P. F. Miller, A. J. Muller, P. Nazarewicz, W. Noertershaeuser, W. Olsen, E. Pearson, M. R. Reinhard, P. -G. Saperstein, E. E. Sumithrarachchi, C. Tolokonnikov, S. V. TI Charge Radii of Neutron Deficient Fe-52;53 Produced by Projectile Fragmentation SO PHYSICAL REVIEW LETTERS LA English DT Article ID COLLINEAR LASER SPECTROSCOPY; GROUND-STATE PROPERTIES; NUCLEAR-STRUCTURE; ISOTOPE SHIFTS; PARTICLES; EXCHANGE; PROGRAM; PHYSICS; ALPHA; N=28 AB Bunched-beam collinear laser spectroscopy is performed on neutron deficient Fe-52,Fe-53 prepared through in-flight separation followed by a gas stopping. This novel scheme is a major step to reach nuclides far from the stability line in laser spectroscopy. Differential mean-square charge radiI delta < r(2)> of Fe-52,Fe-53 are determined relative to stable Fe-56 as delta < r(2)>(56,52) = -0.034(13) fm(2) and delta < r(2)>(56,53) = -0.218(13) fm(2), respectively, from the isotope shift of atomic hyperfine structures. The multiconfiguration Dirac-Fock method is used to calculate atomic factors to deduce delta < r(2)>. The values of delta < r(2)> exhibit a minimum at the N = 28 neutron shell closure. The nuclear density functional theory with Fayans and Skyrme energy density functionals is used to interpret the data. The trend of delta < r(2)> along the Fe isotopic chain results from an interplay between single-particle shell structure, pairing, and polarization effects and provides important data for understanding the intricate trend in the delta < r(2)> of closed-shell Ca isotopes. C1 [Minamisono, K.; Garand, D.; Miller, A. J.; Olsen, E.; Sumithrarachchi, C.] Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA. [Minamisono, K.; Miller, A. J.; Nazarewicz, W.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Rossi, D. M.; Maass, B.; Noertershaeuser, W.] Tech Univ Darmstadt, Inst Kernphys, D-64289 Darmstadt, Germany. [Beerwerth, R.; Fritzsche, S.] Helmholtz Inst Jena, D-07743 Jena, Germany. [Beerwerth, R.; Fritzsche, S.] Friedrich Schiller Univ Jena, Inst Theoret Phys, D-07743 Jena, Germany. [Klose, A.] Augustana Univ, Dept Chem, Sioux Falls, SD 57197 USA. [Liu, Y.] Oak Ridge Natl Lab, Div Phys, Oak Ridge, TN 37831 USA. [Mantica, P. F.] Michigan State Univ, Facil Rare Isotope Beams, E Lansing, MI 48824 USA. [Mantica, P. F.] Michigan State Univ, Dept Chem, E Lansing, MI 48824 USA. [Muller, P.] Argonne Natl Lab, Div Phys, Lemont, IL 60439 USA. [Nazarewicz, W.] Univ Warsaw, Inst Theoret Phys, Fac Phys, PL-02093 Warsaw, Poland. [Pearson, M. R.] TRIUMF, Vancouver, BC V6T 2A3, Canada. [Reinhard, P. -G.] Univ Erlangen Nurnberg, Inst Theoret Phys, D-91054 Erlangen, Germany. [Tolokonnikov, S. V.] Natl Res Ctr Kurchatov Inst, Moscow 123182, Russia. [Saperstein, E. E.] Natl Res Nucl Univ MEPhI, Moscow 115409, Russia. [Tolokonnikov, S. V.] Moscow Inst Phys & Technol, Moscow 141700, Russia. RP Minamisono, K (reprint author), Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA.; Minamisono, K (reprint author), Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. RI Nortershauser, Wilfried/A-6671-2013; Mueller, Peter/E-4408-2011; Rossi, Dominic/B-4728-2011 OI Nortershauser, Wilfried/0000-0001-7432-3687; Mueller, Peter/0000-0002-8544-8191; Rossi, Dominic/0000-0002-2461-0618 FU National Science Foundation [PHY-11-02511]; U.S. Department of Energy, National Nuclear Security Administration [DE-NA0002924, DE-NA0002847]; U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-SC0013365, DE-AC02-06CH11357, DE-AC05-00OR22725]; UT-Battelle, LLC; German Research Foundation [SFB 1245]; German Ministry of Science and Technology [05P12RFFTG, 015P15SJCIA]; Russian Science Foundation [16-12-10155, 16-12-10161]; RFBR Grants [14-02-00107-a, 14-22-03040-ofi_m, 16-02-00228-a] FX This work was supported in part by the National Science Foundation, Grant No. PHY-11-02511; the U.S. Department of Energy, National Nuclear Security Administration, Grants No. DE-NA0002924 and No. DE-NA0002847; the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, Grants No. DE-SC0013365, No. DE-AC02-06CH11357, and No. DE-AC05-00OR22725 with UT-Battelle, LLC; the German Research Foundation Contract No. SFB 1245; the German Ministry of Science and Technology, Grants No. 05P12RFFTG and No. 015P15SJCIA; the Russian Science Foundation, Grants No. 16-12-10155 and No. 16-12-10161 and the RFBR Grants No. 14-02-00107-a, No. 14-22-03040-ofi_m, and No. 16-02-00228-a. Calculations were partially carried out at the Computer Center of Kurchatov Institute. NR 56 TC 0 Z9 0 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 15 PY 2016 VL 117 IS 25 AR 252501 DI 10.1103/PhysRevLett.117.252501 PG 6 WC Physics, Multidisciplinary SC Physics GA EF3ME UT WOS:000390227700004 PM 28036225 ER PT J AU Wang, M Xu, BQ Wang, NL Cao, JJ Tie, XX Wang, HL Zhu, CS Yang, W AF Wang, Mo Xu, Baiqing Wang, Ninglian Cao, Junji Tie, Xuexi Wang, Hailong Zhu, Chongshu Yang, Wei TI Two distinct patterns of seasonal variation of airborne black carbon over Tibetan Plateau SO SCIENCE OF THE TOTAL ENVIRONMENT LA English DT Article DE Black carbon; Aerosol; Tilietan Plateau; Seasonal variation; Transport ID AEROSOL; SNOW; HIMALAYAS; CLIMATE; PARTICLES; ALBEDO; CHINA; MODEL; ASIA; PRECIPITATION AB Airborne black carbon (BC) mass concentrations were measured from November 2012 to June 2013 at Ranwu and Beiluhe, located in the southeastern and central Tibetan Plateau, respectively. Monthly mean BC concentrations show a winter (November-February) high (413.2 ng m(-3)) and spring (March-June) low (139.1 ng m(-3)) at Ranwu, but,in contrast a winter low and spring high at Beiluhe (204.8 and 621.6 ng m(-3), respectively). By examining the meteorological conditions at various scales, we found that the monthly variation of airborne BC over the southeastern Tibetan Plateau (TP) was highly influenced by regional precipitation and over the hinterland by winds. Local precipitation at both sites showed little impact on the seasonal variation of airborne BC concentrations. Potential BC source regions are identified using air mass backward trajectory analysis. At Ranwu, BC was dominated by the air masses from the northeastern India and Bangladesh in both winter and spring, whereas at Beiluhe it was largely contributed by air masses from the south slope of Himalayas in winter, and from the arid region in the north of the TP in spring. The winter and spring seasonal peak of BC in the southern TP is largely contributed by emissions from South Asia, and this seasonal variation is heavily influenced by the regional monsoon. In the northern TP, BC had high concentrations during spring and summer seasons, which is very likely associated with more efficient transport of BC over the arid regions on the north of Tibetan Plateau and in Central Asia. Airborne BC concentrations at the Ranwu sampling site showed a significant diurnal cycle with a peak shortly after sunrise followed by a decrease before noon in both winter and spring, likely shaped by local human activities and the diurnal variation of wind speed. At the Beiluhe sampling site, the diurnal variation of BC is different and less distinct. (C) 2016 Elsevier B.V. All rights reserved. C1 [Wang, Mo; Xu, Baiqing; Yang, Wei] Chinese Acad Sci, Inst Tibetan Plateau Res, Key Lab Tibetan Environm Changes & Land Surface P, Beijing 100101, Peoples R China. [Xu, Baiqing; Wang, Ninglian; Yang, Wei] CAS Ctr Excellence Tibetan Plateau Earth Sci, Beijing, Peoples R China. [Wang, Ninglian] Chinese Acad Sci, Cold & Arid Reg Environm & Engn Res Inst, State Key Lab Cryospher Sci, Lanzhou, Peoples R China. [Cao, Junji; Zhu, Chongshu] Chinese Acad Sci, Inst Earth Environm, Key Lab Aerosol Chem & Phys, Xian, Peoples R China. [Cao, Junji; Tie, Xuexi; Zhu, Chongshu] Chinese Acad Sci, Inst Earth Environm, SKLLQG, Xian, Peoples R China. [Tie, Xuexi] Chinese Acad Sci, Inst Urban Environm, Ctr Excellence Urban Atmospher Environm, Xiamen 361021, Peoples R China. [Wang, Hailong] Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. RP Wang, M (reprint author), Chinese Acad Sci, Inst Tibetan Plateau Res, Bldg 3,Courtyard 16,Lin Cui Rd, Beijing 100101, Peoples R China. EM wangmo@itpcas.ac.cn RI Cao, Junji/D-3259-2014; zhu, chongshu/I-8593-2014 OI Cao, Junji/0000-0003-1000-7241; FU National Natural Science Foundation of China [41430424, 41275186, 41101063]; China National Funds for Distinguished Young Scientists [41125003]; U.S. Department of Energy (DOE), Office of Science, Biological and Environmental Research; DOE by Battelle Memorial Institute [DE-AC05-76RLO1830] FX This research was funded by the National Natural Science Foundation of China (41430424, 41275186 and 41101063) and the China National Funds for Distinguished Young Scientists (41125003). H. Wang acknowledges support from the U.S. Department of Energy (DOE), Office of Science, Biological and Environmental Research. The Pacific Northwest National Laboratory (PNNL) is operated for DOE by Battelle Memorial Institute under contract DE-AC05-76RLO1830. We thank A. D. A. Hansen for his help in the analysis of Aethalometer data. The GIOVANNI, CALIPSO of NASA and HYSPLIT (ARL) of NOAA are also acknowledged for the data used in this research effort. NR 55 TC 1 Z9 1 U1 11 U2 11 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0048-9697 EI 1879-1026 J9 SCI TOTAL ENVIRON JI Sci. Total Environ. PD DEC 15 PY 2016 VL 573 BP 1041 EP 1052 DI 10.1016/j.scitotenv.2016.08.184 PG 12 WC Environmental Sciences SC Environmental Sciences & Ecology GA EF1FP UT WOS:000390071000101 PM 27607907 ER PT J AU Gokey, T Hang, B Guliaev, AB AF Gokey, Trevor Hang, Bo Guliaev, Anton B. TI Cadmium(II) inhibition of human uracil-DNA glycosylase by catalytic water supplantation SO SCIENTIFIC REPORTS LA English DT Article ID MOLECULAR-DYNAMICS SIMULATIONS; TRANSITION-METAL-COMPLEXES; DENSITY-FUNCTIONAL THEORY; BASE EXCISION-REPAIR; PARTICLE MESH EWALD; ZINC-FINGER; MISMATCH REPAIR; PROTEIN; GEOMETRIES; MECHANISM AB Toxic metals are known to inhibit DNA repair but the underlying mechanisms of inhibition are still not fully understood. DNA repair enzymes such as human uracil-DNA glycosylase (hUNG) perform the initial step in the base excision repair (BER) pathway. In this work, we showed that cadmium [Cd(II)], a known human carcinogen, inhibited all activity of hUNG at 100 mu M. Computational analyses based on 2 mu s equilibrium, 1.6 mu s steered molecular dynamics (SMD), and QM/MM MD determined that Cd(II) ions entered the enzyme active site and formed close contacts with both D145 and H148, effectively replacing the catalytic water normally found in this position. Geometry refinement by density functional theory (DFT) calculations showed that Cd(II) formed a tetrahedral structure with D145, P146, H148, and one water molecule. This work for the first time reports Cd(II) inhibition of hUNG which was due to replacement of the catalytic water by binding the active site D145 and H148 residues. Comparison of the proposed metal binding site to existing structural data showed that D145: H148 followed a general metal binding motif favored by Cd(II). The identified motif offered structural insights into metal inhibition of other DNA repair enzymes and glycosylases. C1 [Gokey, Trevor; Guliaev, Anton B.] San Francisco State Univ, Dept Chem & Biochem, 1600 Holloway Ave, San Francisco, CA 94132 USA. [Hang, Bo] Lawrence Berkeley Natl Lab, Biol Syst & Engn, 1 Cyclotron Rd, Berkeley, CA 94720 USA. RP Guliaev, AB (reprint author), San Francisco State Univ, Dept Chem & Biochem, 1600 Holloway Ave, San Francisco, CA 94132 USA. EM guliaev@sfsu.edu FU NIH [1SC2GM095448]; Center for Computing for Life Sciences, mini-grant, SFSU; UC Tobacco-Related Disease Research Program (TRDRP) grant [24RT-0038] FX This work was supported by NIH 1SC2GM095448 (to A.B.G.) and Center for Computing for Life Sciences (http://cs.sfsu.edu/ccls/) mini-grant, SFSU (to A.B.G.). B.H. was funded by the UC Tobacco-Related Disease Research Program (TRDRP) grant 24RT-0038. NR 65 TC 0 Z9 0 U1 5 U2 5 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 15 PY 2016 VL 6 AR 39137 DI 10.1038/srep39137 PG 11 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EF4ES UT WOS:000390278200001 PM 27974818 ER PT J AU Flicker, J Johnson, J AF Flicker, Jack Johnson, Jay TI Photovoltaic ground fault detection recommendations for array safety and operation SO SOLAR ENERGY LA English DT Article DE Photovoltaics; Ground fault; SPICE; Balance of systems; RCD; Isolation resistance measurement; Differential current measurement; Photovoltaic leakage current AB PV faults have caused rooftop fires in the United States, Europe, and elsewhere in the world. One prominent cause of past electrical fires was the ground fault detection "blind spot" in fuse-based protection systems discovered by the Solar America Board for Codes and Standards (Solar ABCs) steering committee in 2011. Unfortunately, while a number of alternatives to ground fault fuses have been identified, there has been limited adoption or historical use of these technologies in the U.S. Analytical and numerical SPICE simulations were conducted for a wide variety of ground faults and array configurations to understand the limitations of fuse-based ground fault protection in PV systems and determine proper trip settings for alternative GFPDs. Simulation results were compared with experimental measurements on arrays to validate the SPICE model as well as provide direction on proper thresholding of residual current detector (RCD), current sense monitor (CSM) and isolation monitor (R-iso) devices based on historical fault current data. We argue the combination of simulation results with historical data indicates robust settings are possible for each of these technologies to minimize unwanted tripping events while maximizing PV fault detection. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Flicker, Jack; Johnson, Jay] Sandia Natl Labs, Albuquerque, NM 87123 USA. RP Flicker, J (reprint author), Sandia Natl Labs, Albuquerque, NM 87123 USA. EM jdflick@sandia.gov FU U.S. Department of Energy [DE-FC36-07GO17034]; DOE Office of Energy Efficiency and Renewable Energy; U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX This material is based upon work supported by the U.S. Department of Energy under Award Number DE-FC36-07GO17034. This work was funded by the DOE Office of Energy Efficiency and Renewable Energy. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. NR 34 TC 0 Z9 0 U1 3 U2 3 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0038-092X J9 SOL ENERGY JI Sol. Energy PD DEC 15 PY 2016 VL 140 BP 34 EP 50 DI 10.1016/j.solener.2016.10.017 PG 17 WC Energy & Fuels SC Energy & Fuels GA EF2UW UT WOS:000390182100005 ER PT J AU Boero, R Backhaus, SN Edwards, BK AF Boero, Riccardo Backhaus, Scott N. Edwards, Brian K. TI The microeconomics of residential photovoltaics: Tariffs, network operation and maintenance, and ancillary services in distribution-level electricity markets SO SOLAR ENERGY LA English DT Article DE Residential photovoltaics; Ancillary services; Feed-in tariffs; Net metering ID FEED-IN TARIFFS; RENEWABLE ENERGY TECHNOLOGIES; POWER-GENERATION; DIFFUSION; GERMANY; POLICY; MODEL AB We develop a microeconomic model of a distribution-level electricity market that takes explicit account of residential photovoltaics (PV) adoption. The model allows us to study the consequences of most tariffs on PV adoption and the consequences of increased residential PV adoption under the assumption of economic sustainability for electric utilities. We validate the model using U.S. data and extend it to consider different pricing schemes for operation and maintenance costs of the distribution network and for ancillary services. Results show that net metering promotes more environmental benefits and social welfare than other tariffs. However, if costs to operate the distribution network increase, net metering will amplify the unequal distribution of surplus among households. In conclusion, maintaining the economic sustainability of electric utilities under net metering may become extremely difficult unless the uneven distribution of surplus is legitimated by environmental benefits. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Boero, Riccardo; Backhaus, Scott N.; Edwards, Brian K.] Los Alamos Natl Lab, POB 1663, Los Alamos, NM 87545 USA. RP Boero, R (reprint author), Los Alamos Natl Lab, POB 1663, Los Alamos, NM 87545 USA. EM riccardo@lanl.gov; backhaus@lanl.gov; bke@lanl.gov NR 27 TC 0 Z9 0 U1 9 U2 9 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0038-092X J9 SOL ENERGY JI Sol. Energy PD DEC 15 PY 2016 VL 140 BP 188 EP 198 DI 10.1016/j.solener.2016.11.010 PG 11 WC Energy & Fuels SC Energy & Fuels GA EF2UW UT WOS:000390182100020 ER PT J AU Wang, Q Wu, HY Florita, AR Martinez-Anido, CB Hodge, BM AF Wang, Qin Wu, Hongyu Florita, Anthony R. Martinez-Anido, Carlo Brancucci Hodge, Bri-Mathias TI The value of improved wind power forecasting: Grid flexibility quantification, ramp capability analysis, and impacts of electricity market operation timescales SO APPLIED ENERGY LA English DT Article DE Wind power integration; Wind power forecasting; Grid flexibility; Ramp capability; Operation timescales; Storage ID NUMERICAL WEATHER PREDICTION; SPEED; PERFORMANCE; MANAGEMENT; SYSTEMS; MODEL AB The value of improving wind power fOrecasting accuracy at different electricity market operation time scales was analyzed by simulating the IEEE 118-bus test system as modified to emulate the generation mixes of the Midcontinent, California, and New England independent system operator balancing authority areas. The wind power forecasting improvement methodology and error analysis for the data set were elaborated. Production cost simulation was conducted on the three emulated systems with a total of 480 scenarios considering the impacts of different generation technologies, wind penetration levels, and wind power forecasting improvement timescales. The static operational flexibility of the three systems was compared through the diversity of generation mix, the percentage of must-run base-load generators, as well as the available ramp rate and the minimum generation levels. The dynamic operational flexibility was evaluated by the real-time upward and downward ramp capacity. Simulation results show that the generation resource mix plays a crucial role in evaluating the value of improved wind power forecasting at different timescales. In addition, the changes in annual operational electricity generation costs were mostly influenced by the dominant resource in the system. Finally, the impacts of pumped-storage resources, generation ramp rates, and system minimum generation level requirements on the value of improved wind power forecasting were also analyzed. Published by Elsevier Ltd. C1 [Wang, Qin; Wu, Hongyu; Florita, Anthony R.; Martinez-Anido, Carlo Brancucci; Hodge, Bri-Mathias] Natl Renewable Energy Lab, Golden, CO 80401 USA. RP Hodge, BM (reprint author), Natl Renewable Energy Lab, Golden, CO 80401 USA. EM bri.mathias.hodge@nrel.gov OI Wu, Hongyu/0000-0002-5223-6635 FU U.S. Department of Energy (DOE) [DE-AC36-08-GO28308]; National Renewable Energy Laboratory FX This work was supported by the U.S. Department of Energy (DOE) under Contract No. DE-AC36-08-GO28308 with the National Renewable Energy Laboratory. The authors would also like to thank Mark Ahlstrom of WindLogics, James Wilczak of the National Oceanic and Atmospheric Administration, and Joel Cline and Charlton Clark of DOE for their helpful guidance. NR 48 TC 1 Z9 1 U1 11 U2 11 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0306-2619 EI 1872-9118 J9 APPL ENERG JI Appl. Energy PD DEC 15 PY 2016 VL 184 BP 696 EP 713 DI 10.1016/j.apenergy.2016.11.016 PG 18 WC Energy & Fuels; Engineering, Chemical SC Energy & Fuels; Engineering GA EE7GZ UT WOS:000389785200056 ER PT J AU Vuilleumier, D Taritas, I Wolk, B Kozarac, D Saxena, S Dibble, RW AF Vuilleumier, David Taritas, Ivan Wolk, Benjamin Kozarac, Darko Saxena, Samveg Dibble, Robert W. TI Multi-level computational exploration of advanced combustion engine operating strategies SO APPLIED ENERGY LA English DT Article DE Homogeneous charge compression ignition; Partial fuel stratification; Gasoline compression ignition; Low temperature combustion; Computational fluid dynamics; Cycle-simulation ID PARTIAL FUEL STRATIFICATION; HCCI ENGINES; RCCI ENGINE; IGNITION; GASOLINE; CFD AB Advanced combustion engine (ACE) research is typically carried out on single-cylinder research engines. These engines are designed to tightly control fueling and conditions at intake valve closure (IVC) and to precisely measure in-cylinder conditions and emissions. However, to be able to measure and control engine operation so precisely, these research engines typically do not feature intake and exhaust tracts that resemble those in production engines, specifically in regards to turbomachinery, heat exchangers, and exhaust gas recirculation (EGR) systems. For this reason, these research engines are effective for understanding in-cylinder combustion parameters such as heat release rate, burn duration, combustion efficiency, pollutant formation, and exhaust valve opening (EVO) conditions. This paper applies high fidelity simulations to determine the feasibility of achieving a chosen single cylinder engine operating point on a production type homogeneous charge compression ignition (HCCI) engine, using a partial fuel stratification (PFS) strategy. To accomplish this, a Converge 3 dimensional (3D) - computational fluid dynamics (CFD) model of the experimental combustion chamber and intake and exhaust runners was created to simulate the experimental engine. This model was used to simulate an operating point achieved experimentally, as well as to determine the sensitivity of the operating point to variations in intake pressure, intake temperature, injection timing, injected mass, and EGR fraction. The results from these simulations were fed into a 1-dimensional engine simulation created in AVL Boost, featuring production-type intake and exhaust systems, including turbomachinery and heat exchangers necessary to create the required IVC conditions. This full engine simulation was used to assess the cycle efficiency of the engine at the experimental operating condition, and to assess whether changes to this operating point in intake temperature, intake pressure, direct injection timing, or fueling are beneficial to the cycle efficiency and engine-out emissions. In addition, the sensitivity of promising engine operating points to injection timing and injection mass are determined to evaluate the potential stability of these operating points. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Vuilleumier, David; Wolk, Benjamin; Dibble, Robert W.] Univ Calif Berkeley, Dept Mech Engn, 6141 Etcheverry Hall, Berkeley, CA 94720 USA. [Taritas, Ivan; Kozarac, Darko] Univ Zagreb, Fac Mech Engn & Naval Architecture, Ivana Lucica 5, Zagreb 10000, Croatia. [Saxena, Samveg] Lawrence Berkeley Natl Lab, Energy Technol Area, 1 Cyclotron Rd,MS 90R1121, Berkeley, CA 94720 USA. RP Vuilleumier, D (reprint author), Univ Calif Berkeley, Dept Mech Engn, 6141 Etcheverry Hall, Berkeley, CA 94720 USA. EM david.vuilleumier@berkeley.edu OI Wolk, Benjamin/0000-0002-9690-9459 FU NSF/DOE Award [CBET-1258653]; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work at the University of California Berkeley was partially supported by NSF/DOE Award No. CBET-1258653 entitled "Advancing Low Temperature Combustion and Lean Burning Engines for Light- and Heavy-Duty Vehicles with Microwave Assisted Spark Plugs and Fuel Stratification".; This research used resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. NR 26 TC 1 Z9 1 U1 3 U2 3 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0306-2619 EI 1872-9118 J9 APPL ENERG JI Appl. Energy PD DEC 15 PY 2016 VL 184 BP 1273 EP 1283 DI 10.1016/j.apenergy.2016.05.043 PG 11 WC Energy & Fuels; Engineering, Chemical SC Energy & Fuels; Engineering GA EE7GZ UT WOS:000389785200111 ER PT J AU Storm, DF Hardy, MT Katzer, DS Nepal, N Downey, BP Meyer, DJ McConkie, TO Zhou, L Smith, DJ AF Storm, D. F. Hardy, M. T. Katzer, D. S. Nepal, N. Downey, B. P. Meyer, D. J. McConkie, Thomas O. Zhou, Lin Smith, David J. TI Critical issues for homoepitaxial GaN growth by molecular beam epitaxy on hydride vapor-phase epitaxy-grown GaN substrates SO JOURNAL OF CRYSTAL GROWTH LA English DT Article DE Substrates; Interfaces; Line Defects; Molecular beam epitaxy; Nitrides ID HIGH-TEMPERATURE LIMITATIONS; VOID-ASSISTED SEPARATION; BULK AMMONOTHERMAL GAN; LIGHT-EMITTING-DIODES; INGAN LASER-DIODES; ALGAN/GAN HETEROSTRUCTURES; DISLOCATION-DENSITY; GALLIUM NITRIDE; THERMAL-STABILITY; SURFACE POLARITY AB While the heteroepitaxial growth of gallium nitride-based materials and devices on substrates such as SiC, sapphire, and Si has been well-documented, the lack of a cost-effective source of bulk GaN crystals has hindered similar progress on homoepitaxy. Nevertheless, freestanding GaN wafers are becoming more widely available, and there is great interest in growing GaN films and devices on bulk GaN substrates, in order to take advantage of the greatly reduced density of threading dislocations, particularly for vertical devices. However, homoepitaxial GaN growth is far from a trivial task due to the reactivity and different chemical sensitivities of N-polar (000 (1) under bar) and Ga-polar (0001) GaN surfaces, which can affect the microstructure and concentrations of impurities in homoepitaxial GaN layers. In order to achieve high quality, high purity homoepitaxial GaN, it is necessary to investigate the effect of the ex situ wet chemical clean, the use of in situ cleaning procedures, the sensitivity of the GaN surface to thermal decomposition, and the effect of growth temperature. We review the current understanding of these issues with a focus on homoepitaxial growth of GaN by molecular beam epitaxy (MBE) on c-plane surfaces of freestanding GaN substrates grown by hydride vapor phase epitaxy (HVPE), as HVPE-grown substrates are most widely available. We demonstrate methods for obtaining homoepitaxial GaN layers by plasma-assisted MBE in which no additional threading dislocations are generated from the regrowth interface and impurity concentrations are greatly reduced. Published by Elsevier B.V. C1 [Storm, D. F.; Hardy, M. T.; Katzer, D. S.; Nepal, N.; Downey, B. P.; Meyer, D. J.] Naval Res Lab, Div Elect Sci & Technol, 4555 Overlook Ave SW, Washington, DC 20375 USA. [McConkie, Thomas O.; Zhou, Lin; Smith, David J.] Arizona State Univ, Dept Phys, Tempe, AZ 85287 USA. [Zhou, Lin] Ames Lab, Ames, IA 50011 USA. RP Storm, DF (reprint author), Naval Res Lab, Div Elect Sci & Technol, 4555 Overlook Ave SW, Washington, DC 20375 USA. FU Office of Naval Research FX The work at NRL was supported by the Office of Naval Research. The authors also acknowledge the use of the facilities in the John M. Cowley Center for High Resolution Electron Microscopy at Arizona State University. NR 100 TC 3 Z9 3 U1 36 U2 36 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-0248 EI 1873-5002 J9 J CRYST GROWTH JI J. Cryst. Growth PD DEC 15 PY 2016 VL 456 BP 121 EP 132 DI 10.1016/j.jcrysgro.2016.08.047 PG 12 WC Crystallography; Materials Science, Multidisciplinary; Physics, Applied SC Crystallography; Materials Science; Physics GA EE4QR UT WOS:000389590400020 ER PT J AU Liliental-Weber, Z dos Reis, R Weyher, JL Staszczak, G Jakiela, R AF Liliental-Weber, Z. dos Reis, Roberto Weyher, Jan L. Staszczak, Grzegorz Jakiela, Rafal TI The importance of structural inhomogeneity in GaN thin films SO JOURNAL OF CRYSTAL GROWTH LA English DT Article DE Etching; MOCVD; Nitrides; Structural defects; Photoluminescence ID MG-DOPED GAN; TRANSMISSION ELECTRON-MICROSCOPY; VAPOR-PHASE EPITAXY; GALLIUM NITRIDE; GROWN GAN; STACKING-FAULTS; DEFECTS; CRYSTALS; POLARITY; TEM AB This paper describes two types of MOCVD-grown n-type GaN layers (Samples A and B) with similar carrier concentration but behaved differently under galvanic photo-etching. In order to understand this behavior, Transmission Electron Microscopy (TEM) for cross-section and plan-view samples, Secondary Ion Mass Spectroscopy (SIMS) and photoluminescence (PL) techniques were applied. SIMS studies showed that Si, C and O are approximately at the same concentration in both samples, but Sample B also contained Fe and Mg. Both GaN samples were grown on sapphire substrate with Ga growth polarity, which was confirmed by Convergent Beam Electron Diffraction (CBED). Despite a smaller layer thickness in Sample B, the density of edge dislocations is almost one order of magnitude lower than in Sample A. In addition, planar defects formed in this sample in the transition area between the undoped buffer and Si doped layers resulted in a substantial decrease in the density of screw dislocations at the sample surface. These planar defects most probably gave rise to the PL lines observed at 3.42 eV and 3.32 eV. The new PL lines that only appeared in Sample B might be related to Mg impurities found in this sample. There were no detectable gettering of these impurities at dislocations using different diffraction conditions. However, Fe rich platelets were found only in Sample B due to the presence of Fe as well as hexagonal features, similar to defects reported earlier in highly Mg-doped GaN. These structural and chemical non uniformities between the two GaN samples can explain their different etching behaviors. This paper demonstrates that samples with similar carrier concentrations do not necessarily ensure similar structural and optical properties and that additional material characterization are needed to ensure that devices built on such samples have similar performance. (C) 2016 Elsevier B.V. All rights reserved. C1 [Liliental-Weber, Z.; dos Reis, Roberto] Lawrence Berkeley Natl Lab, Div Mat Sci, M-S 62R203-8255, Berkeley, CA 94720 USA. [Weyher, Jan L.; Staszczak, Grzegorz] Unipress, Inst High Pressure Phys PAS, Warsaw, Poland. [Jakiela, Rafal] Inst Phys PAS, Al Lotnikow 32-46, PL-02668 Warsaw, Poland. RP Liliental-Weber, Z (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, M-S 62R203-8255, Berkeley, CA 94720 USA. EM z_liliental-weber@lbl.gov FU Office of Science, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering, of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work is supported by the Director, Office of Science, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. Use of the facility in the National Center for Electron Microscopy in LBNL, Berkeley, CA is greatly appreciated. NR 35 TC 0 Z9 0 U1 12 U2 12 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-0248 EI 1873-5002 J9 J CRYST GROWTH JI J. Cryst. Growth PD DEC 15 PY 2016 VL 456 BP 160 EP 167 DI 10.1016/j.jcrysgro.2016.08.059 PG 8 WC Crystallography; Materials Science, Multidisciplinary; Physics, Applied SC Crystallography; Materials Science; Physics GA EE4QR UT WOS:000389590400027 ER PT J AU Eby, J Leembruggen, M Suranyi, P Wijewardhana, LCR AF Eby, Joshua Leembruggen, Madelyn Suranyi, Peter Wijewardhana, L. C. R. TI Collapse of axion stars SO JOURNAL OF HIGH ENERGY PHYSICS LA English DT Article DE Classical Theories of Gravity; Cosmology of Theories beyond the SM ID CP CONSERVATION; INVISIBLE AXION; HARMLESS AXION; DARK-MATTER; INVARIANCE; DYNAMICS; FIELD; PSEUDOPARTICLES; OSCILLATIONS; MINICLUSTERS AB Axion stars, gravitationally bound states of low-energy axion particles, have a maximum mass allowed by gravitational stability. Weakly bound states obtaining this maximum mass have sufficiently large radii such that they are dilute, and as a result, they are well described by a leading-order expansion of the axion potential. Heavier states are susceptible to gravitational collapse. Inclusion of higher-order interactions, present in the full potential, can give qualitatively different results in the analysis of collapsing heavy states, as compared to the leading-order expansion. In this work, we find that collapsing axion stars are stabilized by repulsive interactions present in the full potential, providing evidence that such objects do not form black holes. In the last moments of collapse, the binding energy of the axion star grows rapidly, and we provide evidence that a large amount of its energy is lost through rapid emission of relativistic axions. C1 [Eby, Joshua; Leembruggen, Madelyn; Suranyi, Peter; Wijewardhana, L. C. R.] Univ Cincinnati, Dept Phys, Cincinnati, OH 45221 USA. [Eby, Joshua] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. RP Eby, J (reprint author), Univ Cincinnati, Dept Phys, Cincinnati, OH 45221 USA.; Eby, J (reprint author), Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. EM ebyja@mail.uc.edu; leembrmn@mail.uc.edu; peter.suranyi@uc.edu; rohana.wijewardhana@uc.edu FU University of Cincinnati; Department of Physics; Mary J. Hanna Fellowship through the Department of Physics at University of Cincinnati; U.S. Department of Energy, Office of Science, Office of Workforce Development for Teachers and Scientists, Office of Science Graduate Student Research (SCGSR) program; DOE [DE-SC0014664] FX We thank P. Argyres, R. Gass, A. Kagan, D. Kulkarni, J. Leeney, M. Ma, and C. Vaz for conversations. M.L. thanks the WISE program and Professor U. Ghia for support and encouragement, and the University of Cincinnati and the Department of Physics for a summer research fellowship. The work of JE was partially supported by a Mary J. Hanna Fellowship through the Department of Physics at University of Cincinnati, and also by the U.S. Department of Energy, Office of Science, Office of Workforce Development for Teachers and Scientists, Office of Science Graduate Student Research (SCGSR) program. The SCGSR program is administered by the Oak Ridge Institute for Science and Education for the DOE under contract number DE-SC0014664. NR 47 TC 1 Z9 1 U1 1 U2 1 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1029-8479 J9 J HIGH ENERGY PHYS JI J. High Energy Phys. PD DEC 15 PY 2016 IS 12 AR 066 DI 10.1007/JHEP12(2016)066 PG 20 WC Physics, Particles & Fields SC Physics GA EF0SI UT WOS:000390035800001 ER PT J AU Yildirim, C Kutsal, M Ott, RT Besser, MF Kramer, MJ Kalay, YE AF Yildirim, C. Kutsal, M. Ott, R. T. Besser, M. F. Kramer, M. J. Kalay, Y. E. TI The role of amorphous precursor in phase selection hierarchy in marginal metallic glasses SO MATERIALS & DESIGN LA English DT Article DE Phase selection; Medium-range order; Nanocrystallization; Marginal metallic glass ID NANOCRYSTAL DEVELOPMENT; CRYSTALLIZATION; ALLOYS; TEMPERATURE AB The solid state amorphous structure and devitrification products of Al90Tb10 alloys produced by Cu block meltspinning and magnetron sputtering were investigated by a combined study of differential scanning calorimetry, in-situ X-ray diffraction and conventional transmission electron microscopy. The as-prepared specimens were found to be fully amorphous according to the electron and X-ray diffraction. The thermal analysis and in-situ XRD analyses of the amorphous samples having the same chemistry but different processing history showed clear differences in the devitrification pathways in terms of nanocrystal population, size and the phase selection. The variations in the crystallization path were explained on the basis of distinct topological and chemical medium range ordering observed in as-quenched and as-sputtered amorphous structures. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Yildirim, C.; Kutsal, M.; Kalay, Y. E.] METU, Dept Met & Mat Engn, TR-06800 Ankara, Turkey. [Ott, R. T.; Besser, M. F.; Kramer, M. J.] Ames Lab DOE, Ames, IA 50011 USA. RP Kalay, YE (reprint author), METU, Dept Met & Mat Engn, TR-06800 Ankara, Turkey. EM ekalay@metu.edu.tr FU METU [BAP-07-02-2012-101]; Scientific and Technological Research Council of Turkey (TUBITAK) [113M346]; CALIPSO program; U.S. Department of Energy, Basic Energy Sciences, Division of Materials Science and Engineering [DE-AC02-07CH11358] FX This work was financially supported by METU under the contact number of BAP-07-02-2012-101 and partially supported by the Scientific and Technological Research Council of Turkey (TUBITAK) under grant no. 113M346. The high-energy in-situ X-ray experiments were performed at the BL04 - MSPD beamline of the ALBA Synchrotron Facility and financially supported by CALIPSO program. Inmaculada Peral and Oriol Vallcorba are acknowledged for their valuable help in HEXRD experiments. Work at Ames Laboratory, sample synthesis, was supported by the U.S. Department of Energy, Basic Energy Sciences, Division of Materials Science and Engineering, under contract no. DE-AC02-07CH11358. NR 25 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 15 PY 2016 VL 112 BP 479 EP 484 DI 10.1016/j.matdes.2016.09.060 PG 6 WC Materials Science, Multidisciplinary SC Materials Science GA EB3QE UT WOS:000387279700054 ER PT J AU Madavali, B Kim, HS Lee, KH Isoda, Y Gascoin, F Hong, SJ AF Madavali, Babu Kim, Hyo-Seob Lee, Kap-Ho Isoda, Yukihiro Gascoin, Franck Hong, Soon-Jik TI Large scale production of high efficient and robust p-type Bi-Sb-Te based thermoelectric materials by powder metallurgy SO MATERIALS & DESIGN LA English DT Article DE P-type Bi-Sb-Te alloys; Gas atomization; Thermoelectric materials; Mechanical milling; Microstructures ID BISMUTH-ANTIMONY TELLURIDE; MECHANICAL-PROPERTIES; ALLOYS; MERIT; MICROSTRUCTURE; FIGURE; (BI,SB)(2)TE-3; NANOCOMPOSITES; TEMPERATURE; PERFORMANCE AB Development of large scale high performance thermoelectric materials is one of the challenges in thermoelectric energy conversion. We have successfully fabricated large scale production (3-5 kg/min) of bismuth antimony telluride (Bi-Sb-Te) alloys by gas atomization (GA) and achieved a high figure of merit (ZT) value over unity (1) at 350 K. To getmore performance from thermoelectric materials, we controlled the grain size of GA powders via mechanical milling (GA + MA) and consolidated the resultant nano powder by spark plasma sintering. The ZT values of GA + MA samples were greatly improved (15%) over those of GA bulk due to shifting control of their grain size from micron order to submicron order. The improved ZT values are due to the suppression of lattice thermal conductivity, which was drastically decreased due high scattering of phonons at numerous grain boundaries and twin boundaries. The mechanical properties were greatly improved (GA + MA sample hardness improved >61% over the GA sample), which would provide impressive benefits for device fabrication and practical applications for thermoelectric energy conversion. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Madavali, Babu; Hong, Soon-Jik] Kongju Natl Univ, Div Adv Mat Engn, 275 Budae Dong, Cheonan 330717, Chungnam, South Korea. [Kim, Hyo-Seob] Iowa State Univ, Ames Lab, Met Dev 208, Ames, IA 50011 USA. [Lee, Kap-Ho] Chungnam Natl Univ, Dept Mat Sci & Engn, Taejon 305764, South Korea. [Isoda, Yukihiro] Natl Inst Mat Sci NIMS, Sengen 1-2-1, Tsukuba, Ibaraki 3050047, Japan. [Gascoin, Franck] Lab CRISMAT UMR 6508 CNRS ENSICAEN UCBN, 6 Blvd Marechal Juin, F-14050 Caen 04, France. RP Hong, SJ (reprint author), Kongju Natl Univ, Div Adv Mat Engn, 275 Budae Dong, Cheonan 330717, Chungnam, South Korea. EM hongsj@kongju.ac.kr OI Madavali, Babu/0000-0002-8486-701X FU 'Energy Efficiency & Resources Core Technology Program' of the Korea Institute of Energy Technology Evaluation and Planning (KETEP) - Ministry of Trade, Industry & Energy, Republic of Korea [20152020001210]; Basic Science Research Program through the National Research Foundation of Korea - Ministry of Education, Science and Technology [NRF-2015-R1D1A1A09060920] FX This work was supported by 'Energy Efficiency & Resources Core Technology Program' of the Korea Institute of Energy Technology Evaluation and Planning (KETEP) granted financial resource from the Ministry of Trade, Industry & Energy, Republic of Korea (20152020001210). And, part of the work is supported by the Basic Science Research Program through the National Research Foundation of Korea (NRF-2015-R1D1A1A09060920) funded by the Ministry of Education, Science and Technology. NR 46 TC 0 Z9 0 U1 13 U2 13 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 15 PY 2016 VL 112 BP 485 EP 494 DI 10.1016/j.matdes.2016.09.089 PG 10 WC Materials Science, Multidisciplinary SC Materials Science GA EB3QE UT WOS:000387279700055 ER PT J AU Pannell, TC Goud, RK Schell, DJ Borole, AP AF Pannell, Tyler C. Goud, R. Kannaiah Schell, Daniel J. Borole, Abhijeet P. TI Effect of fed-batch vs. continuous mode of operation on microbial fuel cell performance treating biorefinery wastewater SO BIOCHEMICAL ENGINEERING JOURNAL LA English DT Article DE Fermentation inhibitors; Bioelectrochemical system; Exoelectrogenic; Biofilm-forming; Hydrolysate; Corn stover ID BIOELECTROCHEMICAL SYSTEMS; ELECTRICITY-GENERATION; BACTERIAL COMMUNITIES; MICROORGANISMS; EFFICIENCY; CONVERSION; GLUCOSE AB Bioelectrochemical systems have been shown to treat low-value biorefinery streams while recovering energy, however, low current densities and anode conversion efficiencies (ACE) limit their application. A bioanode was developed via enrichment of electroactive biofilm under fed-batch and continuous feeding conditions using corn stover-derived waste stream. The continuously-fed MFC exhibited a current density of 5.8 +/- 0.06 A/m(2) and an ACE of 39% +/- 4. The fed-batch MFC achieved a similar current density and an ACE of 19.2%, however, its performance dropped after 36 days of operation to 1.1 A/m(2) and 0.5%, respectively. In comparison, the ACE of the continuously-fed MFC remained stable achieving an ACE of 30% +/- 3 after 48 days of operation. An MFC treating a biorefinery stream post fuel separation achieved a current density of 10.7 +/- 0.1 A/m(2) and an ACE of 57% +/- 9 at an organic loading of 12.5 g COD/L-day. Characterization of the microbial communities indicate higher abundance of Firmicutes and Proteobacteria and lower abundance of Bacteriodetes and a higher level of Geobacter spp. (1.4% vs. 0.2%) in continuously-fed MFC vs. fed-batch MFC. The results demonstrate that limiting substrate to the equivalent maximum current that the anode can generate, maintains MFC performance over a long term for high strength wastewaters, such as those generated in the biorefinery. (C) 2016 Elsevier B.V. All rights reserved. C1 [Pannell, Tyler C.; Goud, R. Kannaiah; Borole, Abhijeet P.] Univ Tennessee, Knoxville, TN 37996 USA. [Schell, Daniel J.] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Borole, Abhijeet P.] Oak Ridge Natl Lab, Biosci Div, Oak Ridge, TN 37831 USA. [Borole, Abhijeet P.] Univ Tennessee, Bredesen Ctr Interdisciplinary Res & Educ, Knoxville, TN 37996 USA. RP Borole, AP (reprint author), Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA. EM borolea@ornl.gov OI Borole, Abhijeet/0000-0001-8423-811X FU ASTRO Program; U.S. Department of Energy [DE-AC05-00OR22725]; BioEnergy Technologies Office, Energy Efficiency and Renewable Energy; Laboratory Directed Research and Development Program of Oak Ridge National Laboratory (ORNL) FX Financial support for TCP was obtained from ASTRO Program, administered by the Oak Ridge Associated Universities. ORNL is managed by UT-Battelle, Inc. via a contract # DE-AC05-00OR22725 for the U.S. Department of Energy. The authors acknowledge support from BioEnergy Technologies Office, Energy Efficiency and Renewable Energy. Partial support from the Laboratory Directed Research and Development Program of Oak Ridge National Laboratory (ORNL) is also acknowledged. NR 35 TC 1 Z9 1 U1 32 U2 32 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 1369-703X EI 1873-295X J9 BIOCHEM ENG J JI Biochem. Eng. J. PD DEC 15 PY 2016 VL 116 SI SI BP 85 EP 94 DI 10.1016/j.bej.2016.04.029 PG 10 WC Biotechnology & Applied Microbiology; Engineering, Chemical SC Biotechnology & Applied Microbiology; Engineering GA ED8HK UT WOS:000389112400010 ER PT J AU Lewis, AJ Borole, AP AF Lewis, Alex J. Borole, Abhijeet P. TI Understanding the impact of flow rate and recycle on the conversion of a complex biorefinery stream using a flow-through microbial electrolysis cell SO BIOCHEMICAL ENGINEERING JOURNAL LA English DT Article DE Switchgrass; Bio-oil aqueous phase; Pyrolysis; Integrated hydrogen production; Organic loading rate; Hydraulic retention time ID DOMESTIC WASTE-WATER; HYDROGEN GAS-PRODUCTION; BIOELECTROCHEMICAL SYSTEMS; FUEL-CELLS; PERFORMANCE; RESISTANCE; EFFICIENCY; CATHODE; ANODES; MEC AB The effect of flow rate and recycle on the conversion of a biomass-derived pyrolysis aqueous phase in a microbial electrolysis cell (MEC) were investigated to demonstrate production of renewable hydrogen in biorefinery. A continuous MEC operation was investigated under one-pass and recycle conditions using the complex, biomass-derived, fermentable, mixed substrate feed at a constant concentration of 0.026 g/L, while testing flow rates ranging from 0.19 to 3.6 mLimin. This corresponds to an organic loading rate (OLR) of 0.54-10 g/L-day. Mass transfer issues observed at low flow rates were alleviated using high flow rates. Increasing the flow rate to 3.6 mL/min (3.7 min HRT) during one-pass operation increased the hydrogen productivity 3-fold, but anode conversion efficiency (ACE) decreased from 57.9% to 9.9%. Recycle of the anode liquid helped to alleviate kinetic limitations and the ACE increased by 1.8-fold and the hydrogen productivity by 1.2-fold compared to the one-pass condition at the flow rate of 3.6 mL/min (10 g/L-d OLR). High COD removal was also achieved under recycle conditions, reaching 74.2 +/- 1.1%, with hydrogen production rate of 2.92 +/- 0.51 L/L-day. This study demonstrates the advantages of combining faster flow rates with a recycle process to improve rate of hydrogen production from a switchgrass-derived stream in the biorefinery. (C) 2016 Elsevier B.V. All rights reserved. C1 [Lewis, Alex J.; Borole, Abhijeet P.] Univ Tennessee, Knoxville, TN 37996 USA. [Borole, Abhijeet P.] Oak Ridge Natl Lab, Biosci Div, Oak Ridge, TN 37831 USA. [Lewis, Alex J.; Borole, Abhijeet P.] Univ Tennessee, Bredesen Ctr Interdisciplinary Res & Educ, Knoxville, TN 37996 USA. RP Borole, AP (reprint author), Oak Ridge Natl Lab, Biosci Div, Oak Ridge, TN 37831 USA. EM borolea@ornl.gov OI Borole, Abhijeet/0000-0001-8423-811X FU U.S. Department of Energy, BioEnergy Technologies Office under the Carbon, Hydrogen and Separations Efficiency for Bio-oil Pathways (CHASE); Bredesen Center for Interdisciplinary Research and Education; UT-Battelle, LLC [DEAC05-00OR22725] FX Funding from the U.S. Department of Energy, BioEnergy Technologies Office under the Carbon, Hydrogen and Separations Efficiency for Bio-oil Pathways (CHASE) program is acknowledged. AJL was partially supported by the Bredesen Center for Interdisciplinary Research and Education. The manuscript has been co-authored by UT-Battelle, LLC, under Contract No. DEAC05-00OR22725 with the U.S. Department of Energy. NR 26 TC 1 Z9 1 U1 18 U2 18 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 1369-703X EI 1873-295X J9 BIOCHEM ENG J JI Biochem. Eng. J. PD DEC 15 PY 2016 VL 116 SI SI BP 95 EP 104 DI 10.1016/j.bej.2016.06.008 PG 10 WC Biotechnology & Applied Microbiology; Engineering, Chemical SC Biotechnology & Applied Microbiology; Engineering GA ED8HK UT WOS:000389112400011 ER PT J AU Conti, M Long, C Marconi, M Berchiolli, R Bazilevs, Y Reali, A AF Conti, Michele Long, Chris Marconi, Michele Berchiolli, Raffaella Bazilevs, Yuri Reali, Alessandro TI Carotid artery hemodynamics before and after stenting: A patient specific CFD study SO COMPUTERS & FLUIDS LA English DT Article; Proceedings Paper CT Conference on Advances in Computational Fluid-Structure Interaction and Flow Simulation (AFSI) CY MAR 19-21, 2014 CL Waseda Univ, Tokyo, JAPAN HO Waseda Univ DE Computational fluid dynamics (CFD); Carotid artery; Hemodynamics; Carotid artery stenting; Penalty method ID BIOPROSTHETIC HEART-VALVES; STRUCTURE INTERACTION SIMULATIONS; FLUID DYNAMIC CHARACTERIZATION; BLOOD-FLOW SIMULATIONS; ZERO-STRESS STATE; BIFURCATION STENOSIS; BOUNDARY-CONDITIONS; MODELS; DESIGN; TIME AB Quantitative assessment of the hemodynamic impact of carotid artery stenting (CAS) represents an important ingredient to understand the CAS long-term outcomes, which are still a matter of clinical debate. Although computational fluid dynamics (CFD) has been extensively used for the biomechanical analysis of carotid arteries in healthy and stenotic conditions, there are few contributions in the literature dealing with post-stenting conditions because (i) current medical images do not have sufficient resolution to accurately reconstruct the stent geometry, and (ii) the generation of a body-fitted mesh of the stent-artery configuration is cumbersome. Motivated by these considerations, the present study proposes a numerical approach able to implicitly account for the stent geometry in the post-operative patient-specific hemodynamic CFD analysis by introducing velocity penalty terms in the weak form of the equations governing blood flow in arteries. Such an approach allows us to compare different patient-specific CAS scenarios, ranging from a healthy carotid to a post-stenting configuration after the treatment of a severe stenosis, and paves the way for rapid CFD-based investigations of the hemodynamic impact of novel endovascular devices with complex grid designs. Test computations as well as patient-specific CAS simulations are presented in this paper, with good results obtained in all cases. (C) 2016 Published by Elsevier Ltd. C1 [Conti, Michele; Reali, Alessandro] Univ Pavia, Dept Civil Engn & Architecture DICAr, Via Ferrata 3, I-27100 Pavia, Italy. [Bazilevs, Yuri] Univ Calif San Diego, Dept Struct Engn, 9500 Gilman Dr, La Jolla, CA 92093 USA. [Long, Chris] Los Alamos Natl Lab, Los Alamos, NM USA. [Marconi, Michele; Berchiolli, Raffaella] IRCCS Cisanello Hosp, Pisa, Italy. [Reali, Alessandro] Tech Univ Munich, Inst Adv Study, Lichtenbergstr 2a, D-85748 Garching, Germany. RP Conti, M (reprint author), Univ Pavia, Dept Civil Engn & Architecture DICAr, Via Ferrata 3, I-27100 Pavia, Italy. EM michele.conti@unipv.it OI Conti, Michele/0000-0003-1275-0653 NR 59 TC 0 Z9 0 U1 10 U2 10 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0045-7930 EI 1879-0747 J9 COMPUT FLUIDS JI Comput. Fluids PD DEC 15 PY 2016 VL 141 SI SI BP 62 EP 74 DI 10.1016/j.compfluid.2016.04.006 PG 13 WC Computer Science, Interdisciplinary Applications; Mechanics SC Computer Science; Mechanics GA ED8FQ UT WOS:000389107800007 ER PT J AU Humayun, MT Divan, R Stan, L Rosenmann, D Gosztola, D Gundel, L Solomon, PA Paprotny, I AF Humayun, Md Tanim Divan, Ralu Stan, Liliana Rosenmann, Daniel Gosztola, David Gundel, Lara Solomon, Paul A. Paprotny, Igor TI Ubiquitous Low-Cost Functionalized Multi-Walled Carbon Nanotube Sensors for Distributed Methane Leak Detection SO IEEE SENSORS JOURNAL LA English DT Article DE Methane; carbon nanotube; chemoresistor ID GAS SENSOR AB This paper presents a highly sensitive, energy efficient, and low-cost distributed methane (CH4) sensor system (DMSS) for continuous monitoring, detection, and localization of CH4 leaks in natural gas infrastructure, such as transmission and distribution pipelines, wells, and production pads. The CH4 sensing element, a key component of the DMSS, consists of a metal-oxide nanocrystal functionalized multi-walled carbon nanotube mesh, which, in comparison with the existing literature, shows stronger relative resistance change while interacting with lower parts per million concentration of CH4. A Gaussian plume triangulation algorithm has been developed for the DMSS. Given a geometric model of the surrounding environment, the algorithm can precisely detect and localize a CH4 leak as well as estimate its mass emission rate. A UV-based surface recovery technique making the sensor recover ten times faster than the reported ones is presented for the DMSS. A control algorithm based on the UV-accelerated recovery is developed, which facilitates faster leak detection. C1 [Humayun, Md Tanim; Paprotny, Igor] Univ Illinois, Dept Elect & Comp Engn, Chicago, IL 60607 USA. [Divan, Ralu; Stan, Liliana; Rosenmann, Daniel; Gosztola, David] Argonne Natl Lab, Ctr Nanoscale Mat, Lemont, IL 60439 USA. [Gundel, Lara] Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA. [Solomon, Paul A.] US EPA, Las Vegas, NV 89119 USA. RP Humayun, MT (reprint author), Univ Illinois, Dept Elect & Comp Engn, Chicago, IL 60607 USA. EM mhumay2@uic.edu; divan@anl.gov; lstan@anl.gov; rosenmann@anl.gov; gosztola@anl.gov; lagundel@lbl.gov; solomon.paul@epa.gov; paprotny@uic.edu FU Center for Nanoscale Materials, Argonne National Laboratory, an Office of Science user facility; U. S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-AC02-06CH11357]; College of Engineering, University of Illinois, Chicago, IL; Aclima Inc. [2015-07496] FX This work was supported in part by the Center for Nanoscale Materials, Argonne National Laboratory, an Office of Science user facility, was supported by the U. S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract DE-AC02-06CH11357. The project is in part funded by the College of Engineering, University of Illinois, Chicago, IL, and by a Grant from Aclima Inc., under Award 2015-07496. NR 26 TC 0 Z9 0 U1 10 U2 10 PU IEEE-INST ELECTRICAL ELECTRONICS ENGINEERS INC PI PISCATAWAY PA 445 HOES LANE, PISCATAWAY, NJ 08855-4141 USA SN 1530-437X EI 1558-1748 J9 IEEE SENS J JI IEEE Sens. J. PD DEC 15 PY 2016 VL 16 IS 24 BP 8692 EP 8699 DI 10.1109/JSEN.2016.2581832 PG 8 WC Engineering, Electrical & Electronic; Instruments & Instrumentation; Physics, Applied SC Engineering; Instruments & Instrumentation; Physics GA ED7NU UT WOS:000389053900005 ER PT J AU Li, L Parker, DS dela Cruz, CR Sefat, AS AF Li, Li Parker, David S. dela Cruz, Clarina R. Sefat, Athena S. TI Multi-layered Chalcogenides with potential for magnetism and superconductivity SO PHYSICA C-SUPERCONDUCTIVITY AND ITS APPLICATIONS LA English DT Article DE Thallium copper chalcogenides; Superconductivity and magnetism; 2D crystal structures ID TRANSITION-METAL DICHALCOGENIDES; IRON-BASED SUPERCONDUCTORS; CRYSTAL-STRUCTURE; COPPER; CHEMISTRY; TRANSPORT; ELEMENTS; SINGLE; SYSTEM; CHARGE AB Layered thallium copper chalcogenides can form single, double, or triple layers of Cu-Ch separated by Tl sheets. Here we report on the preparation and properties of Tl-based materials of TlCu2Se2, TlCu4S3, TlCu4Se3 and TlCu6S4. Having no long-range magnetism for these materials is quite surprising considering the possibilities of inter-and intra-layer exchange interactions through Cu 3d, and we measure by magnetic susceptibility and confirm by neutron diffraction. First principles density-functional theory calculations for both the single-layer TlCu2Se2 (isostructural to the '122' iron-based superconductors) and the double-layer TlCu4Se3 suggest a lack of Fermi-level spectral weight that is needed to drive a magnetic or superconducting instability. However, for multiple structural layers with Fe, there is much greater likelihood for magnetism and superconductivity. Published by Elsevier B.V. C1 [Li, Li; Parker, David S.; Sefat, Athena S.] Oak Ridge Natl Lab, Div Mat Sci & Technol, Oak Ridge, TN 37831 USA. [dela Cruz, Clarina R.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. RP Li, L (reprint author), Oak Ridge Natl Lab, Div Mat Sci & Technol, Oak Ridge, TN 37831 USA. EM lil2@ornl.gov; sefata@ornl.gov OI Sefat, Athena /0000-0002-5596-3504; Li, Li/0000-0003-1683-8118 FU U. S. Department of Energy (DOE), Office of Science, Basic Energy Sciences, Materials Science and Engineering Division; Scientific User Facilities Division, Office of BES, U.S. DOE FX This work was supported by the U. S. Department of Energy (DOE), Office of Science, Basic Energy Sciences, Materials Science and Engineering Division (L.L, D.P, A.S). The work at ORNL's High Flux Isotope Reactor (HFIR) was sponsored by the Scientific User Facilities Division, Office of BES, U.S. DOE (C.D.). NR 43 TC 0 Z9 0 U1 25 U2 25 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0921-4534 EI 1873-2143 J9 PHYSICA C JI Physica C PD DEC 15 PY 2016 VL 531 BP 25 EP 29 DI 10.1016/j.physc.2016.10.005 PG 5 WC Physics, Applied SC Physics GA EC9PZ UT WOS:000388477900006 ER PT J AU Qu, YT Campbell, PG Gu, L Knipe, JM Dzenitis, E Santiago, JG Stadermann, M AF Qu, Yatian Campbell, Patrick G. Gu, Lei Knipe, Jennifer M. Dzenitis, Ella Santiago, Juan G. Stadermann, Michael TI Energy consumption analysis of constant voltage and constant current operations in capacitive deionization SO DESALINATION LA English DT Article DE Capacitive deionization; Energy consumption; Constant current and constant voltage ID CYCLIC VOLTAMMETRY; CARBON ELECTRODES; DESALINATION; OPTIMIZATION; POROSITY AB We report our studies to compare energy consumption of a CDI cell in constant voltage (CV) and constant current (CC) operations, with a focus on understanding the underlying physics of consumption patterns. The comparison is conducted under conditions that the CV and CC operations result in the same amounts of input charge and within identical charging phase durations. We present two electrical circuit models to simulate energy consumption in charging phase: one is a simple RC circuit model, and the other a transmission line circuit model. We built and tested a CDI cell to validate the transmission line model, and performed a series of experiments to compare CV versus CC operation under the condition of equal applied charge and charging duration. The experiments show that CC mode consumes energy at 33.8 kJ per mole of ions removed, which is only 28% of CV mode energy consumption (120.6 kJ/mol), but achieves similar level of salt removals. Together, the models and experiment support our major conclusion that CC is more energy efficient than CV for equal charge and charging duration. The models also suggest that the lower energy consumption of CC in charging is due to its lower resistive dissipation. (C) 2016 Elsevier B.V. All rights reserved. C1 [Qu, Yatian; Santiago, Juan G.] Stanford Univ, Dept Mech Engn, Stanford, CA 94305 USA. [Qu, Yatian; Campbell, Patrick G.; Knipe, Jennifer M.; Stadermann, Michael] Lawrence Livermore Natl Lab, 7000 East Ave, Livermore, CA USA. [Gu, Lei] Stanford Univ, Dept Elect Engn, Stanford, CA 94305 USA. [Dzenitis, Ella] Dartmouth Coll, Hanover, NH 03755 USA. RP Santiago, JG (reprint author), Stanford Univ, Dept Mech Engn, Stanford, CA 94305 USA.; Stadermann, M (reprint author), Lawrence Livermore Natl Lab, 7000 East Ave, Livermore, CA USA. EM juan.santiago@stanford.edu; stadermann2@llnl.gov OI Campbell, Patrick/0000-0003-0167-4624 FU LLNL LDRD project [15-ERD-068]; US DOE [DE-AC52-07NA27344]; TomKat Center for Sustainable Energy at Stanford University FX Yatian Qu would like to thank the Lawrence Scholar program. This work was supported by LLNL LDRD project 15-ERD-068. Work at LLNL was performed under the auspices of the US DOE by LLNL under Contract DE-AC52-07NA27344. Yatian Qu and Juan G. Santiago also gratefully acknowledge support from the TomKat Center for Sustainable Energy at Stanford University. NR 33 TC 1 Z9 1 U1 44 U2 44 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0011-9164 EI 1873-4464 J9 DESALINATION JI Desalination PD DEC 15 PY 2016 VL 400 BP 18 EP 24 DI 10.1016/j.desal.2016.09.014 PG 7 WC Engineering, Chemical; Water Resources SC Engineering; Water Resources GA EA6KT UT WOS:000386738800003 ER PT J AU Sikes, EL Elmore, AC Allen, KA Cook, MS Guilderson, TP AF Sikes, Elisabeth L. Elmore, Aurora C. Allen, Katherine A. Cook, Mea S. Guilderson, Thomas P. TI Glacial water mass structure and rapid delta O-18 and delta C-13 changes during the last glacial termination in the Southwest Pacific SO EARTH AND PLANETARY SCIENCE LETTERS LA English DT Article DE delta C-13; delta O-18; deglaciation; last glaciation; ocean-atmosphere CO2 exchange; Southern Ocean ID MERIDIONAL OVERTURNING CIRCULATION; SOUTHERN-OCEAN SEDIMENTS; ATMOSPHERIC CO2; NEW-ZEALAND; CARBON-DIOXIDE; NORTH-ATLANTIC; SEA-ICE; ISOTOPIC COMPOSITION; INTIMATE PROJECT; DEGLACIATION AB Changes in ocean circulation are thought to have contributed to lowering glacial atmospheric CO2 levels by enhancing deep ocean sequestration of carbon that was returned to the atmosphere during glacial terminations. High-resolution benthic foraminiferal delta C-13 and delta O-18 records from a depth transect of cores in the Southwest Pacific Ocean presented here provide evidence that both wind- and thermohaline-driven circulation drove CO2 from the ocean during the last deglaciation. Shallow geochemical stratification in the glacial Southern Ocean was followed by a short pulse of rapid delta C-13 enrichment to intermediate water depths during Heinrich Stadial 1, indicative of better-ventilated intermediate waters co-occurring with documented wind-driven upwelling in the Southern Ocean. Intermediate depth delta C-13 enrichment paused at the start of the Antarctic Cold Reversal (similar to 14.7 ka), implying a brief shallow restratification, while deeper layers were progressively flushed of delta C-13-depleted and delta O-18-enriched waters, likely caused by the increasing influence of deep waters sourced from the North Atlantic. The coincidence of atmospheric CO2 increases with these geochemical shifts in both shallow and deep cores suggests that shifts in both atmospheric and oceanic circulation contributed to the deglacial rise of CO2. (C) 2016 Elsevier B.V. All rights reserved. C1 [Sikes, Elisabeth L.; Elmore, Aurora C.; Allen, Katherine A.] Rutgers State Univ, Inst Marine & Coastal Sci, 71 Dudley Rd, New Brunswick, NJ 08901 USA. [Elmore, Aurora C.] Univ Durham, Dept Geog, South Rd, Durham, England. [Allen, Katherine A.] Univ Maine, Sch Earth & Climate Sci, Bryand Global Sci Ctr 5790, Orono, ME 04469 USA. [Cook, Mea S.] Williams Coll, Dept Geosci, 947 Main St, Williamstown, MA 01267 USA. [Guilderson, Thomas P.] Univ Calif Santa Cruz, Dept Ocean Sci, 1156 High St, Santa Cruz, CA 95064 USA. [Guilderson, Thomas P.] Lawrence Livermore Natl Lab, 7000 East Ave, Livermore, CA 94550 USA. RP Sikes, EL (reprint author), Rutgers State Univ, Inst Marine & Coastal Sci, 71 Dudley Rd, New Brunswick, NJ 08901 USA. EM sikes@marine.rutgers.edu OI Sikes, Elisabeth/0000-0003-2900-3283 FU NSF [OCE-0823487, 0823549-03]; U.S. Department of Energy [DE-AC52-07NA27344]; Hanse-Wissenschaftskolleg; NOAA Climate and Global Change Program FX We thank Susan Trimarchi, Jordan Landers, and Benedetto Schiraldi for analyses and laboratory assistance and Phil Shane for continued assistance with tephra identification. We wholeheartedly thank David Lund and Jean Lynch-Stieglitz for stimulating discussions and insightful input. Conversations with Arnold Gordon contributed greatly to our concept of Southern Ocean water formation mechanisms. Numerous anonymous reviewers had a hand in shaping this manuscript. We thank our editor, Heather Stoll, for guiding this work to publication. Funding for this project came from NSF OCE-0823487 and 0823549-03. A portion of this work was performed under the auspices of the U.S. Department of Energy under contract DE-AC52-07NA27344. This work was also supported by fellowships from the Hanse-Wissenschaftskolleg; support was also provided by the NOAA Climate and Global Change Program (KA), administered by the University Corporation for Atmospheric Research. All data used in this paper is archived with the NOAA Centers for Environmental Information in the online paleoclimate database: http://www.ncdc.noaa.gov/data-access/paleoclimatology-data. NR 83 TC 0 Z9 0 U1 17 U2 17 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0012-821X EI 1385-013X J9 EARTH PLANET SC LETT JI Earth Planet. Sci. Lett. PD DEC 15 PY 2016 VL 456 BP 87 EP 97 DI 10.1016/j.epsl.2016.09.043 PG 11 WC Geochemistry & Geophysics SC Geochemistry & Geophysics GA EB6WO UT WOS:000387526500009 ER PT J AU Kaercher, P Miyagi, L Kanitpanyacharoen, W Zepeda-Alarcon, E Wang, Y Parkinson, D Lebensohn, RA De Carlo, F Wenk, HR AF Kaercher, P. Miyagi, L. Kanitpanyacharoen, W. Zepeda-Alarcon, E. Wang, Y. Parkinson, D. Lebensohn, R. A. De Carlo, F. Wenk, H. R. TI Two-phase deformation of lower mantle mineral analogs SO EARTH AND PLANETARY SCIENCE LETTERS LA English DT Article DE crystallographic preferred orientation; seismic anisotropy; two-phase deformation; lower mantle rheology; 3D X-ray microtomography ID EARTHS LOWER MANTLE; SEISMIC ANISOTROPY; HIGH-PRESSURE; TEXTURE DEVELOPMENT; MGSIO3 PEROVSKITE; HIGH-TEMPERATURE; SLAB; MAGNESIOWUSTITE; BRIDGMANITE; RHEOLOGY AB The lower mantle is estimated to be composed of mostly bridgmanite and a smaller percentage of ferropericlase, yet very little information exists for two-phase deformation of these minerals. To better understand the rheology and active deformation mechanisms of these lower mantle minerals, especially dislocation slip and the development of crystallographic preferred orientation (CPO), we deformed mineral analogs neighborite (NaMgF3, iso-structural with bridgmanite) and halite (NaCl, iso-structural with ferropericlase) together in the deformation-DIA at the Advanced Photon Source up to 51% axial shortening. Development of CPO was recorded in situ with X-ray diffraction, and information on microstructural evolution was collected using X-ray microtomography. Results show that when present in as little as 15% volume, the weak phase (NaCI) controls the deformation. Compared to single phase NaMgF3 samples, samples with just 15% volume NaCI show a reduction of CPO in NaMgF3 and weakening of the aggregate. Microtomography shows both NaMgF3 and NaCl form highly interconnected networks of grains. Polycrystal plasticity simulations were carried out to gain insight into slip activity, CPO evolution, and strain and stress partitioning between phases for different synthetic two-phase microstructures. The results suggest that ferropericlase may control deformation in the lower mantle and reduce CPO in bridgmanite, which implies a less viscous lower mantle and helps to explain why the lower mantle is fairly isotropic. (C) 2016 Published by Elsevier B.V. C1 [Kaercher, P.] Univ Liverpool, Dept Earth Ocean & Ecol Sci, Liverpool, Merseyside, England. [Miyagi, L.] Univ Utah, Dept Geol & Geophys, Salt Lake City, UT 84112 USA. [Kanitpanyacharoen, W.] Chulalongkorn Univ, Dept Geol, Bangkok, Thailand. [Zepeda-Alarcon, E.; Wenk, H. R.] Univ Calif Berkeley, Dept Earth & Planetary Sci, Berkeley, CA 94720 USA. [Wang, Y.; De Carlo, F.] Argonne Natl Lab, Adv Photon Source, Lemont, IL USA. [Parkinson, D.] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA USA. [Lebensohn, R. A.] Los Alamos Natl Lab, Mat Sci & Technol Div, Los Alamos, NM USA. RP Kaercher, P (reprint author), Univ Liverpool, Dept Earth Ocean & Ecol Sci, Liverpool, Merseyside, England. EM kaercher@liverpool.ac.uk RI Lebensohn, Ricardo/A-2494-2008 OI Lebensohn, Ricardo/0000-0002-3152-9105 FU CDAC; NSF [EAR-1343908, EAR-1344579, EAR-136127]; NSF/CSEDI [1067513] FX This work was supported by CDAC and NSF grant EAR-1343908, NSF/CSEDI 1067513. LM acknowledges support from CDAC and NSF grant EAR-1344579. YW acknowledges support from NSF grant EAR-136127. Portions of this work were performed at GeoSoilEnviroCARS (Sector 13) and beamline 2-BM-B (XOR) of the Advanced Photon Source (APS), Argonne National Laboratory. We thank the Advanced Light Source (ALS) of the Lawrence Berkeley National Laboratory (LBNL) for the use of beamline 8.3.2. P. Kaercher is grateful to David Martin for providing a beautiful sample of neighborite and to James Wu for his help in synthesizing neighborite. All authors greatly appreciate the constructive comments from all three reviewers. NR 55 TC 0 Z9 0 U1 5 U2 5 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0012-821X EI 1385-013X J9 EARTH PLANET SC LETT JI Earth Planet. Sci. Lett. PD DEC 15 PY 2016 VL 456 BP 134 EP 145 DI 10.1016/j.epsl.2016.09.030 PG 12 WC Geochemistry & Geophysics SC Geochemistry & Geophysics GA EB6WO UT WOS:000387526500013 ER PT J AU Crum, JV Neeway, JJ Riley, BJ Zhu, ZH Olszta, MJ Tang, M AF Crum, Jarrod V. Neeway, James J. Riley, Brian J. Zhu, Zihua Olszta, Matthew J. Tang, Ming TI Dilute condition corrosion behavior of glass-ceramic waste form SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article ID THERMAL-EXPANSION; TEMPERATURE AB Borosilicate glass-ceramics are being developed to immobilize high-level waste generated by aqueous reprocessing into a stable waste form. The corrosion behavior of this multiphase waste form is expected to be complicated by multiple phases and crystal-glass interfaces. A modified single-pass flow-through test was performed on polished monolithic coupons at a neutral pH (25 degrees C) and 90 degrees C for 33 d. The measured glass corrosion rates by micro analysis in the samples ranged from 0.019 to 0.29 g m(-2) d(-1) at a flow rate per surface area = 1.73 x 10(-6) m s(-1). The crystal phases (oxyapatite and Ca-rich powellite) corroded below quantifiable rates, by micro analysis. While, Ba-rich powellite corroded considerably in O10 sample. The corrosion rates of C1 and its replicate C20 were elevated an order of magnitude by mechanical stresses at crystal-glass interface caused by thermal expansion mismatch during cooling and unique morphology (oxyapatite clustering). (C) 2016 Elsevier B.V. C1 [Crum, Jarrod V.; Neeway, James J.; Riley, Brian J.; Zhu, Zihua; Olszta, Matthew J.] Pacific NW Natl Lab, Richland, WA 99352 USA. [Tang, Ming] Los Alamos Natl Lab, Los Alamos, NM USA. RP Crum, JV (reprint author), Pacific NW Natl Lab, Richland, WA 99352 USA. EM jarrod.crum@pnnl.gov RI Zhu, Zihua/K-7652-2012; OI Neeway, Jim/0000-0001-7046-8408; Riley, Brian/0000-0002-7745-6730 FU Pacific Northwest National Laboratory [DE-AC05-76RL01830]; U.S. Department of Energy (DOE) Office of Nuclear Energy under the Fuel Cycle Research and Development Program; Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory FX The Pacific Northwest National Laboratory is operated by Battelle under Contract Number DE-AC05-76RL01830. This work was funded by the U.S. Department of Energy (DOE) Office of Nuclear Energy under the Fuel Cycle Research and Development Program. A portion of the research was performed at the Environmental Molecular Sciences Laboratory (EMSL), a DOE Office of Science user facility sponsored by the Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory. NR 21 TC 0 Z9 0 U1 21 U2 21 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 1 EP 11 DI 10.1016/j.jnucmat.2016.08.002 PG 11 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100001 ER PT J AU Hoggan, RE Zuck, LD Cannon, WR Lessing, PA AF Hoggan, Rita E. Zuck, Larry D. Cannon, W. Roger Lessing, Paul A. TI Processing of surrogate nuclear fuel pellets for better dimensional control with dry bag isostatic pressing SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article ID POWDER COMPACTS; SEGREGATION AB A study of improved methods of processing fuel pellets was undertaken using ceria and zirconia/yttria/alumina as surrogates. Through proper granulation, elimination of fines and vertical vibration (tapping) of the parts bag prior to dry bag isostatic pressing (DBIP), reproducibility of diameter profiles among multiple pellets of ceria was improved by almost an order of magnitude. Reproducibility of sintered pellets in these studies was sufficient to allow pellets to be introduced into the cladding with a gap between the pellet and cladding on the order of 50 mm to 100 mm but not a uniform gap with tolerance of +/- 12 mm as is currently required. Deviation from the mean diameter along the length of multiple pellets, and deviation from roundness, decreased after sintering. This is not generally observed with dry pressed pellets. Sintered shrinkage was uniform to +/- 0.05% and thus, as an alternative, pellets may be machined to tolerance before sintering, thus avoiding the waste associated with post-sinter grinding. (C) 2016 Elsevier B.V. All rights reserved. C1 [Hoggan, Rita E.; Zuck, Larry D.; Cannon, W. Roger; Lessing, Paul A.] Idaho Natl Lab, POB 1625, Idaho Falls, ID 83415 USA. RP Cannon, WR (reprint author), Idaho Natl Lab, POB 1625, Idaho Falls, ID 83415 USA. EM Rita.hoggan@inl.gov; Larry.zuck@inl.gov; cannon@rutgers.edu; p.a.l.2@hotmail.com FU U.S. Department of Energy [DE-AC07-05ID14517] FX This manuscript has been authored by Battelle Energy Alliance, LLC under Contract No. DE-AC07-05ID14517 with the U.S. Department of Energy. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a nonexclusive, paid-up, irrevocable, world-wide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes. NR 16 TC 0 Z9 0 U1 1 U2 1 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 34 EP 41 DI 10.1016/j.jnucmat.2016.05.034 PG 8 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100005 ER PT J AU Brown, DW Okuniewski, MA Sisneros, TA Clausen, B Moore, GA Balogh, L AF Brown, D. W. Okuniewski, M. A. Sisneros, T. A. Clausen, B. Moore, G. A. Balogh, L. TI Neutron diffraction measurement of residual stresses, dislocation density and texture in Zr-bonded U-10Mo "mini" fuel foils and plates SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article ID X-RAY-DIFFRACTION; NUCLEAR-FUEL; RIETVELD REFINEMENT; STRAIN-MEASUREMENT; CRYSTALLITE-SIZE; LATTICE-STRAIN; PARTICLE-SIZE; PARAMETERS; SEPARATION; BEHAVIOR AB Al clad U-10Mo fuel plates are being considered for conversion of several research reactors from high-enriched to low-enriched U fuel. Neutron diffraction measurements of the textures, residual phase stresses, and dislocation densities in the individual phases of the mini-foils throughout several processing steps and following hot-isostatic pressing to the Al cladding, have been completed. Recovery and recrystallization of the bare U-10Mo fuel foil, as indicated by the dislocation density and texture, are observed depending on the state of the material prior to annealing and the duration and temperature of the annealing process. In general, the cladding procedure significantly reduces the dislocation density, but the final state of the clad plate, both texture and dislocation density, depends strongly on the final processing step of the fuel foil. In contrast, the residual stress state of the final plate is dominated by the thermal expansion mismatch of the constituent materials. (C) 2016 Published by Elsevier B.V. C1 [Brown, D. W.; Sisneros, T. A.; Clausen, B.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Okuniewski, M. A.] Purdue Univ, W Lafayette, IN 47907 USA. [Okuniewski, M. A.; Moore, G. A.] Idaho Natl Lab, Idaho Falls, ID 83415 USA. [Balogh, L.] Queens Univ, Kingston, ON, Canada. RP Brown, DW (reprint author), Los Alamos Natl Lab, Los Alamos, NM 87545 USA. EM dbrown@lanl.gov RI Balogh, Levente/S-1238-2016 FU U.S. Department of Energy; National Nuclear Security Administration's Office of Materials Management and Minimization through the DOE Idaho Operations Office [DE-AC07-05ID14517]; United States Department of Energy's Office of Basic Energy Sciences; Department of Energy [DE-AC52-06NA25396] FX This research was supported by the U.S. Department of Energy and the National Nuclear Security Administration's Office of Materials Management and Minimization through the DOE Idaho Operations Office Contract DE-AC07-05ID14517. This work has benefited from the use of the Manual Lujan, Jr. Neutron Scattering Center at LANSCE, which was funded by the United States Department of Energy's Office of Basic Energy Sciences. Los Alamos National Laboratory is operated by Los Alamos National Security LLC under Department of Energy contract DE-AC52-06NA25396. NR 45 TC 0 Z9 0 U1 8 U2 8 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 63 EP 74 DI 10.1016/j.jnucmat.2016.09.022 PG 12 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100009 ER PT J AU Muntifering, B Fang, YW Leff, AC Dunn, A Qu, JM Taheri, ML Dingreville, R Hattar, K AF Muntifering, Brittany Fang, Youwu Leff, Asher C. Dunn, Aaron Qu, Jianmin Taheri, Mitra L. Dingreville, Remi Hattar, Khalid TI In situ Transmission Electron Microscopy He+ implantation and thermal aging of nanocrystalline iron SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article DE Nanocrystalline iron; In situ TEM; Helium implantation; Annealing ID NEUTRON-IRRADIATION DAMAGE; HEAVY-ION IRRADIATION; CR MODEL ALLOYS; DISLOCATION LOOPS; RADIATION-DAMAGE; ALPHA-IRON; GRAIN-BOUNDARIES; HELIUM; FE; EVOLUTION AB The high density of interfaces in nanostructured materials are hypothesized to improve radiation tolerance compared to coarse-grained materials. In order to investigate the roles of vacancies, selfinterstitials, and helium, both room temperature in situ TEM He+ implantation and annealing, as well as high temperature He+ implantation was performed on nanocrystalline iron. Dislocation loops are formed by the accumulation of mobile point defects rather than by displacement cascades at intermediate temperatures. Around 600 degrees C, loops disappeared through gradual shrinking, which is hypothesized to correspond to the annihilation of self-interstitial atoms by mobile vacancies that also resulted in cavity formation. The room temperature implantation resulted in cavities evenly distributed throughout the grain after annealing, whereas cavities were predominately observed at grain boundaries for the elevated temperature implantation. This difference is associated with the formation of stable helium-vacancy complexes in the grains during room temperature implantation, which is not present during high temperature implantation. (C) 2016 Elsevier B.V. All rights reserved. C1 [Muntifering, Brittany; Dunn, Aaron; Dingreville, Remi; Hattar, Khalid] Sandia Natl Labs, Albuquerque, NM 87185 USA. [Muntifering, Brittany; Fang, Youwu; Qu, Jianmin] Northwestern Univ, Dept Civil & Environm Engn, Evanston, IL 60208 USA. [Leff, Asher C.; Taheri, Mitra L.] Drexel Univ, Dept Mat Sci & Engn, Philadelphia, PA 19104 USA. [Dunn, Aaron] Georgia Tech CNRS, Georgia Inst Technol, George W Woodruff Sch Mech Engn, UMI 2958, F-57070 Metz, France. [Qu, Jianmin] Tufts Univ, Sch Engn, Medford, MA 02155 USA. RP Muntifering, B (reprint author), Sandia Natl Labs, Albuquerque, NM 87185 USA. EM brmunti@sandia.gov FU US Department of Energy's Nuclear Energy University Program [DE-NE0000678]; United States Department of Energy Basic Energy Sciences (DOE/BES) under the Early Career program [DE-SC0008274]; U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX The authors thank Dan Bufford, Dan Buller, Cajer Gong, Osman El-Atwani, James Nathaniel, Mike Marshal, and Sarah Blair for their assistance and insightful discussion. This work is primarily supported by the US Department of Energy's Nuclear Energy University Program (DE-NE0000678). MLT and ACL gratefully acknowledge funding from the United States Department of Energy Basic Energy Sciences (DOE/BES) under the Early Career program through contract DE-SC0008274. Sandia National Laboratories is a multiprogram laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. NR 44 TC 0 Z9 0 U1 16 U2 16 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 139 EP 146 DI 10.1016/j.jnucmat.2016.10.001 PG 8 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100019 ER PT J AU Zheng, GQ He, LF Carpenter, D Sridharan, K AF Zheng, Guiqiu He, Lingfeng Carpenter, David Sridharan, Kumar TI Corrosion-induced microstructural developments in 316 stainless steel during exposure to molten Li2BeF4(FLiBe) salt SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article DE Nuclear reactor; 316 stainless steel; Molten salt; Microstructure; Corrosion ID MATERIALS CHALLENGES; STRUCTURAL-MATERIALS; NUCLEAR-ENERGY; FLIBE SALT; SYSTEMS; DIFFUSION; CHROMIUM AB The microstructural developments in the near-surface regions of AISI 316 stainless steel during exposure to molten Li2BeF4 (FLiBe) salt have been investigated with the goal of using this material for the construction of the fluoride salt-cooled high-temperature reactor (FHR), a leading nuclear reactor concept for the next generation nuclear plants (NGNP). Tests were conducted in molten FLiBe salt (melting point: 459 degrees C) at 700 degrees C in graphite crucibles and 316 stainless steel crucibles for exposure duration of up to 3000 h. Corrosion-induced microstructural changes in the near-surface regions of the samples were characterized using scanning electron microscopy (SEM) in conjunction with energy dispersive x-ray spectroscopy (EDS) and electron backscatter diffraction (EBSD), and scanning transmission electron microscopy (STEM) with EDS capabilities. Intergranular corrosion attack in the near-surface regions was observed with associated Cr depletion along the grain boundaries. High-angle grain boundaries (15-180 degrees) were particularly prone to intergranular attack and Cr depletion. The depth of attack extended to the depths of 22 mu m after 3000-h exposure for the samples tested in graphite crucible, while similar exposure in 316 stainless steel crucible led to the attack depths of only about 11 mm. Testing in graphite crucibles led to the formation of nanometer-scale Mo2C, Cr7C3 and Al4C3 particle phases in the near-surface regions of the material. The copious depletion of Cr in the near-surface regions induced a gmartensite to a-ferrite phase (FeNix) transformation. Based on the microstructural analysis, a thermal diffusion controlled corrosion model was developed and experimentally validated for predicting long-term corrosion attack depth. (C) 2016 Elsevier B.V. All rights reserved. C1 [Zheng, Guiqiu; Carpenter, David] MIT, Nucl Reactor Lab, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [He, Lingfeng] Idaho Natl Lab, Idaho Fall, ID USA. [Sridharan, Kumar] Univ Wisconsin, Dept Engn Phys, Madison, WI USA. RP Zheng, GQ (reprint author), MIT, Nucl Reactor Lab, 77 Massachusetts Ave, Cambridge, MA 02139 USA. EM guiqiuzheng@gmail.com OI He, Lingfeng/0000-0003-2763-1462; Zheng, Guiqiu/0000-0002-5783-5848 FU U.S. Department of Energy Nuclear Energy University Program [DE-AC07-05ID14517] FX This research is financially supported by the U.S. Department of Energy Nuclear Energy University Program Contract No. DE-AC07-05ID14517. NR 32 TC 0 Z9 0 U1 16 U2 16 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 147 EP 155 DI 10.1016/j.jnucmat.2016.10.023 PG 9 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100020 ER PT J AU Perron, A Turchi, PEA Landa, A Oudot, B Ravat, B Delaunay, F AF Perron, A. Turchi, P. E. A. Landa, A. Oudot, B. Ravat, B. Delaunay, F. TI Thermodynamic assessments and inter-relationships between systems involving Al, Am, Ga, Pu, and U SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article ID PHASE-TRANSFORMATIONS; ALLOYS; URANIUM; PLUTONIUM; ALUMINUM; DIAGRAM AB A newly developed self-consistent CALPHAD thermodynamic database involving Al, Am, Ga, Pu, and U is presented. A first optimization of the slightly characterized Am-Al and completely unknown Am-Ga phase diagrams is proposed. To this end, phase diagram features as crystal structures, stoichiometric compounds, solubility limits, and melting temperatures have been studied along the U-Al -> Pu-Al -> Am-Al, and U-Ga -> Pu-Ga -> Am-Ga series, and the thermodynamic assessments involving Al and Ga alloying are compared. In addition, two distinct optimizations of the Pu-Al phase diagram are proposed to account for the low temperature and Pu-rich region controversy. The previously assessed thermodynamics of the other binary systems (Am-Pu, Am-U, Pu-U, and Al-Ga) is also included in the database and is briefly described in the present work. Finally, predictions on phase stability of ternary and quaternary systems of interest are reported to check the consistency of the database. Published by Elsevier B.V. C1 [Perron, A.; Turchi, P. E. A.; Landa, A.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Oudot, B.; Ravat, B.; Delaunay, F.] CEA, Ctr Valduc, F-21120 Is Sur Tille, France. RP Perron, A (reprint author), Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. EM perron1@llnl.gov FU U.S Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344]; CEA-Centre de Valduc (France); Post-doctoral program at LLNL; Scott K. McCall FX This work was performed under the auspices of the U.S Department of Energy by Lawrence Livermore National Laboratory under contract DE-AC52-07NA27344. This work was done as part of the international agreement on cooperation between DOE-NNSA and CEA-DAM in fundamental science supporting stockpile stewardship. A.P. gratefully acknowledges the financial support from the CEA-Centre de Valduc (France), the Post-doctoral program at LLNL, and Scott K. McCall for a thorough reading of the manuscript. NR 48 TC 0 Z9 0 U1 8 U2 8 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 187 EP 200 DI 10.1016/j.jnucmat.2016.09.012 PG 14 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100025 ER PT J AU Buck, EC Mausolf, EJ McNamara, BK Soderquist, CZ Schwantes, JM AF Buck, Edgar C. Mausolf, Edward J. McNamara, Bruce K. Soderquist, Chuck Z. Schwantes, Jon M. TI Sequestration of radioactive iodine in silver-palladium phases in commercial spent nuclear fuel SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article DE AgI; Fuel dissolution; Scanning electron microscopy; Energy dispersive x-ray spectroscopy; Elemental mapping ID HIGH-BURNUP; FISSION-PRODUCTS; REACTOR ACCIDENT; RELEASE; DISSOLUTION; PARTICLES; METAL; UO2 AB Radioactive iodine is the Achilles' heel in the design for the safe geological disposal of spent uranium oxide (UO2) nuclear fuel. Furthermore, iodine's high volatility and aqueous solubility were mainly responsible for the high early doses released during the accident at Fukushima Daiichi in 2011. Studies Kienzler et al., however, have indicated that the instant release fraction (IRF) of radioiodine (I-131/129) does not correlate directly with increasing fuel burn-up. In fact, there is a peak in the release of iodine at around 50-60 MW d/kgU, and with increasing burn-up, the IRF of I-131/129 decreases. The reasons for this decrease have not fully been understood. We have performed microscopic analysis of chemically processed high burn-up UO2 fuel (80 MW d/kgU) and have found recalcitrant nano-particles containing, Pd, Ag, I, and Br, possibly consistent with a high pressure phase of silver iodide in the undissolved residue. It is likely that increased levels of Ag and Pd from Pu-239 fission in high burnup fuels leads to the formation of these metal halides. The occurrence of these phases in UO2 nuclear fuels may reduce the impact of long-lived I-129 on the repository performance assessment calculations. (C) 2016 Published by Elsevier B.V. C1 [Buck, Edgar C.; Mausolf, Edward J.; McNamara, Bruce K.; Soderquist, Chuck Z.; Schwantes, Jon M.] Pacific Northwest Natl Lab, POB 999,Mail Stop P7-27, Richland, WA 99352 USA. RP Buck, EC (reprint author), Pacific Northwest Natl Lab, POB 999,Mail Stop P7-27, Richland, WA 99352 USA. EM edgar.buck@pnnl.gov OI Buck, Edgar/0000-0001-5101-9084 FU Laboratory Directed Research and Development program within the Pacific Northwest National Laboratory (PNNL); DOE by Battelle Memorial Institute [DE-AC05-76RL01830] FX This work was funded by the Laboratory Directed Research and Development program within the Pacific Northwest National Laboratory (PNNL). PNNL is operated for DOE by Battelle Memorial Institute under contract DE-AC05-76RL01830. NR 37 TC 0 Z9 0 U1 7 U2 7 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 229 EP 235 DI 10.1016/j.jnucmat.2016.10.029 PG 7 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100029 ER PT J AU Gigax, JG Chen, T Kim, H Wang, J Price, LM Aydogan, E Maloy, SA Schreiber, DK Toloczko, MB Garner, FA Shao, L AF Gigax, J. G. Chen, T. Kim, Hyosim Wang, J. Price, L. M. Aydogan, E. Maloy, S. A. Schreiber, D. K. Toloczko, M. B. Garner, F. A. Shao, Lin TI Radiation response of alloy T91 at damage levels up to 1000 peak dpa SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article DE Void swelling; Ion irradiation; T91; High dpa; Depth dependence; Injected interstitial suppression; Microchemical evolution ID FERRITIC-MARTENSITIC STEELS; HEAVY-ION IRRADIATION; MICROSTRUCTURAL EVOLUTION; NEUTRON-IRRADIATION; AUSTENITIC ALLOYS; FAST-REACTOR; INJECTED INTERSTITIALS; SWELLING SUPPRESSION; DISPLACEMENT RATE; CHARGED-PARTICLE AB Ferritic/martensitic alloys are required for advanced reactor components to survive 500-600 neutron-induced dpa. Ion-induced void swelling of ferritic/martensitic alloy T91 in the quenched and tempered condition has been studied using a defocused, non-rastered 3.5 MeV Fe-ion beam at 475 degrees C to produce damage levels up to 1000 peak displacements per atom (dpa). The high peak damage level of 1000 dpa is required to reach 500-600 dpa level due to injected interstitial suppression of void nucleation in the peak dpa region, requiring data extraction closer to the surface at lower dpa levels. At a relatively low peak damage level of 250 dpa, voids began to develop, appearing first in the near-surface region. With increasing ion fluence, swelling was observed deeper in the specimen, but remained completely suppressed in the back half of the ion range, even at 1000 peak dpa. The local differences in dpa rate in the front half of the ion range induce an "internal temperature shift" that strongly influences the onset of swelling, with shorter transient regimes resulting from lower dpa rates, in agreement not only with observations in neutron irradiation studies but also in various ion irradiations. Swelling was accompanied by radiation-induced precipitation of Cu-rich and Si, Ni, Mn-rich phases were observed by atom probe tomography, indicating concurrent microchemical evolution was in progress. In comparison to other ferritic/martensitic alloys during ion irradiation, T91 exhibits good swelling resistance with a swelling incubation period of about 400 local dpa. (C) 2016 Elsevier B.V. All rights reserved. C1 [Gigax, J. G.; Chen, T.; Kim, Hyosim; Wang, J.; Price, L. M.; Aydogan, E.; Garner, F. A.; Shao, Lin] Texas A&M Univ, Dept Nucl Engn, College Stn, TX 77840 USA. [Wang, J.; Schreiber, D. K.; Toloczko, M. B.] Pacific Northwest Natl Lab, Richland, WA 99354 USA. [Aydogan, E.; Maloy, S. A.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Garner, F. A.] Radiat Effects Consulting, Richland, WA 99354 USA. RP Gigax, JG (reprint author), Texas A&M Univ, Dept Nucl Engn, College Stn, TX 77840 USA. EM gigaxj@tamu.edu OI Maloy, Stuart/0000-0001-8037-1319 FU U.S. Department of Energy, NEUP program [DE-NE0008297]; Environmental and Molecular Science Laboratory at Pacific Northwest National Laboratory [49117] FX The study is supported by U.S. Department of Energy, NEUP program, through grant DE-NE0008297. The authors acknowledge the Microscopy and Imaging Center (MIC) and Materials Characterization Facility (MCF) of Texas A&M University for instrument access. The authors also acknowledge the Environmental and Molecular Science Laboratory at Pacific Northwest National Laboratory for APT system access supported under user proposal #49117. NR 72 TC 0 Z9 0 U1 10 U2 10 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 257 EP 265 DI 10.1016/j.jnucmat.2016.10.003 PG 9 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100032 ER PT J AU Middleburgh, SC Grimes, RW Lahoda, EJ Stanek, CR Andersson, DA AF Middleburgh, S. C. Grimes, R. W. Lahoda, E. J. Stanek, C. R. Andersson, D. A. TI Non-stoichiometry in U3Si2 SO JOURNAL OF NUCLEAR MATERIALS LA English DT Article DE Accident tolerant fuel; Density functional theory; Stoichiometry; Silicide ID STRUCTURAL STABILITY; MOLECULAR-DYNAMICS; URANIUM SILICIDES; FISSION-PRODUCTS; IRRADIATION; BEHAVIOR; FABRICATION; CHEMISTRY; ELEMENTS; DIOXIDE AB Uranium silicides, in particular U3Si2, are being explored as an advanced nuclear fuel with increased accident tolerance as well as competitive economics compared to the baseline UO2 fuel. Here we use density functional theory calculations and thermochemical analysis to assess the stability of U3Si2 with respect to non-stoichiometry reactions in both the hypo- and hyper-stoichiometric regimes. We find that the degree of non-stoichiometry in U3Si2 is much smaller than in UO2 and at most reaches a few percent at high temperature. Non-stoichiometry impacts fuel performance by determining whether the loss of uranium due to fission leads to a non-stoichiometric U3Si2 +/- x phase or precipitation of a second U-Si phase. We also investigate the U5Si4 phase as a candidate for the equilibrium phase diagram. (C) 2016 Elsevier B.V. All rights reserved. C1 [Middleburgh, S. C.] Westinghouse Elect Sweden AB, SE-72163 Vasteras, Sweden. [Middleburgh, S. C.; Grimes, R. W.] Imperial Coll London, Dept Mat, London SW7 2AZ, England. [Lahoda, E. J.] Westinghouse Elect Co LLC, Cranberry Woods, PA USA. [Stanek, C. R.; Andersson, D. A.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. RP Middleburgh, SC (reprint author), Westinghouse Elect Sweden AB, SE-72163 Vasteras, Sweden.; Andersson, DA (reprint author), Los Alamos Natl Lab, MST Struct & Property Relat 8, Los Alamos, NM 87545 USA. EM middlesc@westinghouse.com; andersson@lanl.gov FU U.S. Department of Energy, Office of Nuclear Energy, Nuclear Energy Advanced Modeling Simulation (NEAMS) program; National Nuclear Security Administration of the U.S. Department of Energy [DE-AC52-06NA25396] FX The authors would like to thank Dr. Lars Hallstadius and Dr. Peng Xu for their support and discussions related to the accident tolerant fuels. Additionally, we would like to acknowledge the entire CARAT consortium on accident tolerant fuels for their ongoing efforts related to high density fuels and cladding materials. Work performed by D.A. Andersson and C.R Stanek was funded by the U.S. Department of Energy, Office of Nuclear Energy, Nuclear Energy Advanced Modeling Simulation (NEAMS) program. Los Alamos National Laboratory, an affirmative action/equal opportunity employer, is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration of the U.S. Department of Energy under Contract No. DE-AC52-06NA25396. NR 38 TC 0 Z9 0 U1 16 U2 16 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0022-3115 EI 1873-4820 J9 J NUCL MATER JI J. Nucl. Mater. PD DEC 15 PY 2016 VL 482 BP 300 EP 305 DI 10.1016/j.jnucmat.2016.10.016 PG 6 WC Materials Science, Multidisciplinary; Nuclear Science & Technology SC Materials Science; Nuclear Science & Technology GA EC2PP UT WOS:000387966100036 ER PT J AU Brown, DW Bernardin, JD Carpenter, JS Clausen, B Spernjak, D Thompson, JM AF Brown, D. W. Bernardin, J. D. Carpenter, J. S. Clausen, B. Spernjak, D. Thompson, J. M. TI Neutron diffraction measurements of residual stress in additively manufactured stainless steel SO MATERIALS SCIENCE AND ENGINEERING A-STRUCTURAL MATERIALS PROPERTIES MICROSTRUCTURE AND PROCESSING LA English DT Article DE Additive manufacture; Neutron diffraction; Residual stress ID SUPPORT STRUCTURES; STRAIN-MEASUREMENT; CLAD AB Charpy test specimens were additively manufactured (AM) on a single stainless steel plate from a 17-4 class stainless steel using a powder-bed, laser melting technique on an EOS M280 direct metal laser sintering (DMLS) machine. Cross-hatched mesh support structures for the Charpy test specimens were varied in strut width and density to parametrically study their influence on the build stability and accuracy as the DMLS process has been known to generate parts with large amounts of residual stress. Neutron diffraction was used to profile the residual stresses in several of the AM samples before and after the samples were removed from the support structure for the purpose of determining residual stresses. The residual stresses were found to depend very little on theproperties of the support structure over the limited range studied here. The largest stress component was in the long direction of each of the samples studied and was roughly 2/3 of the yield stress of the material. The stress field was altered considerably when the specimen was removed from the support structure. It was noted in this study that a single Charpy specimen developed a significant tear between the growth plate and support structure. The presence of the tear in the support structure strongly affected the observed stress field: the asymmetric tear resulted in a significantly asymmetric stress field that propagated through removal of the sample from the base plate. The altered final residual stress state of the sample as well as its observed final shape indicates that the tear initiated during the build and developed without disrupting the fabrication process, suggesting a need for in-situ monitoring. C1 [Brown, D. W.; Bernardin, J. D.; Carpenter, J. S.; Clausen, B.; Spernjak, D.; Thompson, J. M.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. RP Brown, DW (reprint author), Los Alamos Natl Lab, Los Alamos, NM 87545 USA. OI Carpenter, John/0000-0001-8821-043X FU U.S. Department of Energy [DE-AC52-06NA25396]; Los Alamos Neutron Science Center by the NNSA FX Los Alamos National Laboratory, an affirmative action equal opportunity employer, is operated by Los Alamos National Security, LLC, for the National Nuclear Security Administration (NNSA) of the U.S. Department of Energy under contract DE-AC52-06NA25396. The authors gratefully acknowledge the financial support of the Los Alamos Neutron Science Center by the NNSA. NR 21 TC 0 Z9 0 U1 33 U2 33 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0921-5093 EI 1873-4936 J9 MAT SCI ENG A-STRUCT JI Mater. Sci. Eng. A-Struct. Mater. Prop. Microstruct. Process. PD DEC 15 PY 2016 VL 678 BP 291 EP 298 DI 10.1016/j.msea.2016.09.086 PG 8 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Metallurgy & Metallurgical Engineering SC Science & Technology - Other Topics; Materials Science; Metallurgy & Metallurgical Engineering GA EB8HX UT WOS:000387633200031 ER PT J AU Somerville, L Bareno, J Trask, S Jennings, P McGordon, A Lyness, C Bloom, I AF Somerville, L. Bareno, J. Trask, S. Jennings, P. McGordon, A. Lyness, C. Bloom, I. TI The effect of charging rate on the graphite electrode of commercial lithium-ion cells: A post-mortem study SO JOURNAL OF POWER SOURCES LA English DT Article DE Lithium-ion; Increased charge rate; Aging; Materials characterization ID CYCLE-LIFE; AGING MECHANISMS; BATTERIES; IDENTIFICATION; COMPONENTS; XPS AB Increased charging rates negatively affect the lifetime of lithium-ion cells by increasing cell resistance and reducing capacity. This work is a post-mortem study of 18650-type cells subjected to charge rates of 0.7-, 2-, 4-, and 6-C. For cells charged at 0.7-C to 4-C, this performance degradation is primarily related to surface film thickness with no observable change in surface film chemical composition. However, at charge rates of 6-C, the chemical composition of the surface film changes significantly, suggesting that this change is the reason for the sharper increase in cell resistance compared to the lower charge rates. In addition, we found that surface film formation was not uniform across the electrode. Surface film was thicker and chemically different along the central band of the electrode "jelly roll". This result is most likely attributable to an increase in temperature that results from non-uniform electrode wetting during manufacture. This non-uniform change further resulted in active material delamination from the current collector owing to chemical changes to the binder for the cell charged at 6-C. (C) 2016 The Authors and UChicago Argonne, LLC, Operator of Argonne National Laboratory. Published by Elsevier B.V. C1 [Somerville, L.; Bareno, J.; Trask, S.; Bloom, I.] Argonne Natl Lab, 9700 S Cass Ave, Lemont, IL 60561 USA. [Somerville, L.; Jennings, P.; McGordon, A.] Univ Warwick, WMG, Coventry CV4 7AL, W Midlands, England. [Lyness, C.] Jaguar Land Rover, Banbury Rd, Warwick CV35 0XJ, England. RP Bloom, I (reprint author), Argonne Natl Lab, 9700 S Cass Ave, Lemont, IL 60561 USA. EM ira.bloom@anl.gov FU Engineering and Physical Sciences Research Council (EPSRC) [EP/101585X/1]; WMG centre HVM Catapult; Jaguar Land Rover Automotive PLC; U.S. Department of Energy (DOE), Office of Vehicle Technologies (VTO) [DE-ACO206CH11357]; University of Chicago as Operator of Argonne National Laboratory ("Argonne") [W-31-109-Eng-38]; U.S. Department of Energy FX We acknowledge support from the Engineering and Physical Sciences Research Council (EPSRC) (EP/101585X/1) and the WMG centre HVM Catapult. We also acknowledge support from Jaguar Land Rover Automotive PLC.; The work at Argonne National Laboratory was performed under the auspices of the U.S. Department of Energy (DOE), Office of Vehicle Technologies (VTO), under Contract No. DE-ACO206CH11357.; The submitted issue has been created by the University of Chicago as Operator of Argonne National Laboratory ("Argonne") under Contract No. W-31-109-Eng-38 with the U.S. Department of Energy. The U.S. Government retains for itself, and others acting on its behalf, a paid-up, non-exclusive, irrevocable, worldwide license in said article to reproduce, prepare derivative works, distribute copies to the public, and perform publicly and display publicly, by or on behalf of the Government. NR 18 TC 0 Z9 0 U1 58 U2 58 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0378-7753 EI 1873-2755 J9 J POWER SOURCES JI J. Power Sources PD DEC 15 PY 2016 VL 335 BP 189 EP 196 DI 10.1016/j.jpowsour.2016.10.002 PG 8 WC Chemistry, Physical; Electrochemistry; Energy & Fuels; Materials Science, Multidisciplinary SC Chemistry; Electrochemistry; Energy & Fuels; Materials Science GA EB6VV UT WOS:000387524600022 ER PT J AU Vecharynski, E Knyazev, A AF Vecharynski, Eugene Knyazev, Andrew TI Preconditioned steepest descent-like methods for symmetric indefinite systems SO LINEAR ALGEBRA AND ITS APPLICATIONS LA English DT Article DE Linear system; MINRES; Steepest descent; Convergence; Symmetric indefinite; Preconditioning ID GENERALIZED CONJUGATE-GRADIENT; STABILIZED STOKES SYSTEMS; FAST ITERATIVE SOLUTION; HERMITIAN EIGENPROBLEMS; INTERIOR EIGENVALUES; LINEAR-EQUATIONS AB This paper addresses the question of what exactly is an analogue of the preconditioned steepest descent (PSD) algorithm in the case of a symmetric indefinite system with an SPD preconditioner. We show that a basic PSD-like scheme for an SPD-preconditioned symmetric indefinite system is mathematically equivalent to the restarted PMINRES, where restarts occur after every two steps. A convergence bound is derived. If certain information on the spectrum of the preconditioned system is available, we present a simpler PSD-like algorithm that performs only one-dimensional residual minimization. Our primary goal is to bridge the theoretical gap between optimal (PMINRES) and PSD-like methods for solving symmetric indefinite systems, as well as point out situations where the PSD-like schemes can be used in practice. (C) 2016 Elsevier Inc. All rights reserved. C1 [Vecharynski, Eugene] Lawrence Berkeley Natl Lab, Computat Res Div, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Knyazev, Andrew] Mitsubishi Elect Res Labs, 201 Broadway, Cambridge, MA 02139 USA. RP Vecharynski, E (reprint author), Lawrence Berkeley Natl Lab, Computat Res Div, 1 Cyclotron Rd, Berkeley, CA 94720 USA. EM eugene.vecharynski@gmail.com; Andrew.Knyazev@merl.com NR 29 TC 0 Z9 0 U1 2 U2 2 PU ELSEVIER SCIENCE INC PI NEW YORK PA 360 PARK AVE SOUTH, NEW YORK, NY 10010-1710 USA SN 0024-3795 EI 1873-1856 J9 LINEAR ALGEBRA APPL JI Linear Alg. Appl. PD DEC 15 PY 2016 VL 511 BP 274 EP 295 DI 10.1016/j.laa.2016.09.011 PG 22 WC Mathematics, Applied; Mathematics SC Mathematics GA EA8BQ UT WOS:000386860700014 ER PT J AU Nandanwar, SU Coldsnow, K Utgikar, V Sabharwall, P Aston, DE AF Nandanwar, Sachin U. Coldsnow, Kai Utgikar, Vivek Sabharwall, Piyush Aston, D. Eric TI Capture of harmful radioactive contaminants from off-gas stream using porous solid sorbents for clean environment - A review SO CHEMICAL ENGINEERING JOURNAL LA English DT Review DE Off-gas stream; Volatile contaminants; Environment; Adsorption; Porous solid sorbents; Removal of gases ID METAL-ORGANIC FRAMEWORKS; PRESSURE-INDUCED AMORPHIZATION; CHALCOGEN-BASED AEROGELS; WALLED CARBON NANOTUBES; SILVER-MORDENITE; VOLATILE IODINE; NOBLE-GASES; ACTIVATED-CHARCOAL; KRYPTON ADSORPTION; WASTE FORMS AB Nuclear energy production is growing rapidly worldwide to satisfy increasing energy demands. Reprocessing of used nuclear fuel (UNF) is expected to play an important role for sustainable development of nuclear energy by increasing the energy extracted from the fuel and reducing the generation of the high level waste (HLW). However, during the reprocessing of used nuclear fuel (UNF) gaseous radioactive nuclides including iodine, krypton, xenon, carbon, and tritium are released into the atmosphere through off-gas streams. The volatile iodine (1291), and krypton (Kr-85) gases have long lived-isotopes; which have adverse effects on the environment as well as human health. Consequently, the capture of these two target radionuclides (species) is essential for the enhanced growth of nuclear energy. In this review we discuss several techniques for capture of volatile contaminants iodine, krypton, and xenon, focusing upon adsorption using solid sorbents, which has shown promising results for more than 70 years. Commonly used and recently developed sorbents are summarized in this article along with a short review of the results. Metal-organic-frameworks (MOFs), gaining favor in recent years as sorbents for the capture of off-gas contaminants are also discussed. Finally, some considerations of future trends and prospects for investigations of the capture of volatile radionuclides are presented. (C) 2016 Elsevier B.V. All rights reserved. C1 [Nandanwar, Sachin U.; Coldsnow, Kai; Utgikar, Vivek; Aston, D. Eric] Univ Idaho, Dept Chem & Mat Engn, 875 Perimeter Dr,MS 1021, Moscow, ID 83844 USA. [Sabharwall, Piyush] Idaho Natl Lab, Idaho Falls, ID 83415 USA. RP Utgikar, V (reprint author), Univ Idaho, Dept Chem & Mat Engn, 875 Perimeter Dr,MS 1021, Moscow, ID 83844 USA. EM vutgikar@uidaho.edu FU US Department of Energy - Nuclear Energy University Program (DOE-NEUP) [DE-NE0000660] FX We would like to thank the US Department of Energy - Nuclear Energy University Program (DOE-NEUP) for financial support of this work (Project No.: DE-NE0000660). NR 107 TC 0 Z9 0 U1 69 U2 69 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 1385-8947 EI 1873-3212 J9 CHEM ENG J JI Chem. Eng. J. PD DEC 15 PY 2016 VL 306 BP 369 EP 381 DI 10.1016/j.cej.2016.07.073 PG 13 WC Engineering, Environmental; Engineering, Chemical SC Engineering GA EA2KH UT WOS:000386420700042 ER PT J AU Maginot, PG Ragusa, JC Morel, JE AF Maginot, Peter G. Ragusa, Jean C. Morel, Jim E. TI High-order solution methods for grey discrete ordinates thermal radiative transfer SO JOURNAL OF COMPUTATIONAL PHYSICS LA English DT Article DE Thermal radiation transport; Discontinuous finite element method; Runge-Kutta; Discrete ordinates ID DIFFUSION-SYNTHETIC ACCELERATION; S-N TRANSPORT; SLAB GEOMETRY; SDIRK-METHODS; EQUATIONS; DISCRETIZATIONS; MESHES AB This work presents a solution methodology for solving the grey radiative transfer equations that is both spatially and temporally more accurate than the canonical radiative transfer solution technique of linear discontinuous finite element discretization in space with implicit Euler integration in time. We solve the grey radiative transfer equations by fully converging the nonlinear temperature dependence of the material specific heat, material opacities, and Planck function. The grey radiative transfer equations are discretized in space using arbitrary-order self-lumping discontinuous finite elements and integrated in time with arbitrary-order diagonally implicit Runge-Kutta time integration techniques. Iterative convergence of the radiation equation is accelerated using a modified interior penalty diffusion operator to precondition the full discrete ordinates transport operator. Published by Elsevier Inc. C1 [Maginot, Peter G.] Lawrence Livermore Natl Lab, Livermore, CA 94551 USA. [Ragusa, Jean C.; Morel, Jim E.] Texas A&M Univ, Dept Nucl Engn, College Stn, TX 77843 USA. RP Maginot, PG (reprint author), Lawrence Livermore Natl Lab, Livermore, CA 94551 USA. EM maginot1@llnl.gov; jean.ragusa@tamu.edu; morel@tamu.edu OI Maginot, Peter/0000-0002-8496-2412; Morel, Jim/0000-0001-7723-003X FU U.S. Department of Energy [DE-AC52-07NA27344]; Department of Energy, National Nuclear Security Administration [DE-NA0002376] FX The work of P.G. Maginot was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. The work of J.C. Ragusa and J.E. Morel was supported in part by the Department of Energy, National Nuclear Security Administration, under Award Number(s) DE-NA0002376. NR 32 TC 0 Z9 0 U1 6 U2 6 PU ACADEMIC PRESS INC ELSEVIER SCIENCE PI SAN DIEGO PA 525 B ST, STE 1900, SAN DIEGO, CA 92101-4495 USA SN 0021-9991 EI 1090-2716 J9 J COMPUT PHYS JI J. Comput. Phys. PD DEC 15 PY 2016 VL 327 BP 719 EP 746 DI 10.1016/j.jcp.2016.09.055 PG 28 WC Computer Science, Interdisciplinary Applications; Physics, Mathematical SC Computer Science; Physics GA DZ7TH UT WOS:000386069200035 ER PT J AU Patel, S Lee, T AF Patel, Saumil Lee, Taehun TI A new splitting scheme to the discrete Boltzmann equation for non-ideal gases on non-uniform meshes SO JOURNAL OF COMPUTATIONAL PHYSICS LA English DT Article DE Multiphase; Spectral-element method; Discontinuous Galerkin method; Lattice Boltzmann method ID INCOMPRESSIBLE 2-PHASE FLOWS; MULTIPHASE FLOWS; DENSITY RATIO; CONSERVATION; SIMULATION AB We present a novel numerical procedure for solving the discrete Boltzmann equations (DBE) on non-uniform meshes. Our scheme is based on the Strang splitting method where we seek to investigate two-phase flow applications. In this note, we investigate the onset of parasitic currents which arise in many computational two-phase algorithms. To the best of our knowledge, the results presented in this work show, for the first time, a spectral element discontinuous Galerkin (SEDG) discretization of a discrete Boltzmann equation which successfully eliminates parasitic currents on non-uniform meshes. With the hope that this technique can be used for applications in complex geometries, calculations are performed on non-uniform mesh distributions by using high-order (spectral), body-fitting quadrilateral elements. Validation and verification of our work is carried out by comparing results against the classical 2D Young-Laplace law problem for a static drop. (C) 2016 Elsevier Inc. All rights reserved. C1 [Patel, Saumil; Lee, Taehun] CUNY City Coll, Dept Mech Engn, New York, NY 10031 USA. [Patel, Saumil] Argonne Natl Lab, Argonne Leadership Comp Facil, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Lee, T (reprint author), CUNY City Coll, Dept Mech Engn, New York, NY 10031 USA. EM spatel@anl.gov; thlee@ccny.cuny.edu RI Lee, Taehun/G-2695-2010 OI Lee, Taehun/0000-0001-9965-5637 FU U.S. Department of Energy, Office of Nuclear Energy's Nuclear Energy University Programs FX This work is supported in part by the U.S. Department of Energy, Office of Nuclear Energy's Nuclear Energy University Programs. We also thank Dr. Misun Min of Argonne National Laboratory for her help in developing the solver. NR 28 TC 0 Z9 0 U1 15 U2 15 PU ACADEMIC PRESS INC ELSEVIER SCIENCE PI SAN DIEGO PA 525 B ST, STE 1900, SAN DIEGO, CA 92101-4495 USA SN 0021-9991 EI 1090-2716 J9 J COMPUT PHYS JI J. Comput. Phys. PD DEC 15 PY 2016 VL 327 BP 799 EP 809 DI 10.1016/j.jcp.2016.09.060 PG 11 WC Computer Science, Interdisciplinary Applications; Physics, Mathematical SC Computer Science; Physics GA DZ7TH UT WOS:000386069200038 ER PT J AU Castelletto, N White, JA Ferronatoc, M AF Castelletto, Nicola White, Joshua A. Ferronatoc, Massimiliano TI Scalable algorithms for three-field mixed finite element coupled poromechanics SO JOURNAL OF COMPUTATIONAL PHYSICS LA English DT Article DE Poromechanics; Preconditioners; Iterative methods; Mixed formulation; Algebraic multigrid ID NONSYMMETRIC LINEAR-SYSTEMS; BIOTS CONSOLIDATION MODEL; NAVIER-STOKES EQUATIONS; SADDLE-POINT PROBLEMS; LAND SUBSIDENCE; GROUNDWATER EXPLOITATION; NUMERICAL-SIMULATION; BONE POROELASTICITY; ELASTICITY PROBLEMS; SEQUENTIAL-METHODS AB We introduce a class of block preconditioners for accelerating the iterative solution of coupled poromechanics equations based on a three-field formulation. The use of a displacement/velocity/pressure mixed finite-element method combined with a first order backward difference formula for the approximation of time derivatives produces a sequence of linear systems with a 3 x 3 unsymmetric and indefinite block matrix. The preconditioners are obtained by approximating the two-level Schur complement with the aid of physically-based arguments that can be also generalized in a purely algebraic approach. A theoretical and experimental analysis is presented that provides evidence of the robustness, efficiency and scalability of the proposed algorithm. The performance is also assessed for a real-world challenging consolidation experiment of a shallow formation. (C) 2016 Elsevier Inc. All rights reserved. C1 [Castelletto, Nicola] Stanford Univ, Energy Resources Engn, Stanford, CA 94305 USA. [White, Joshua A.] Lawrence Livermore Natl Lab, Atmospher Earth & Energy Div, Livermore, CA USA. [Ferronatoc, Massimiliano] Univ Padua, Dept Civil Environm & Architectural Engn, I-35100 Padua, Italy. RP Castelletto, N (reprint author), Stanford Univ, Energy Resources Engn, Stanford, CA 94305 USA. EM ncastell@stanford.edu; jawhite@llnl.gov; massimiliano.ferronato@unipd.it FU Reservoir Simulation Industrial Affiliates Consortium at Stanford University-SUPRI-B; Total S.A. through the Stanford Total Enhanced Modeling of Source rock-STEMS-project; University of Padova project "Stable and efficient discretizations of the mechanics of faults"; U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07-NA27344] FX Funding for this research was provided by the Reservoir Simulation Industrial Affiliates Consortium at Stanford University-SUPRI-B-(to N.C.), by Total S.A. through the Stanford Total Enhanced Modeling of Source rock-STEMS-project (to N.C. and J.A.W.), and by the University of Padova project "Stable and efficient discretizations of the mechanics of faults" (to M.F.). This financial support is gratefully acknowledged. Portions of this work were performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07-NA27344. NR 76 TC 0 Z9 0 U1 8 U2 8 PU ACADEMIC PRESS INC ELSEVIER SCIENCE PI SAN DIEGO PA 525 B ST, STE 1900, SAN DIEGO, CA 92101-4495 USA SN 0021-9991 EI 1090-2716 J9 J COMPUT PHYS JI J. Comput. Phys. PD DEC 15 PY 2016 VL 327 BP 894 EP 918 DI 10.1016/j.jcp.2016.09.063 PG 25 WC Computer Science, Interdisciplinary Applications; Physics, Mathematical SC Computer Science; Physics GA DZ7TH UT WOS:000386069200044 ER PT J AU Bogin, GE Luecke, J Ratcliff, MA Osecky, E Zigler, BT AF Bogin, Gregory E., Jr. Luecke, Jon Ratcliff, Matthew A. Osecky, Eric Zigler, Bradley T. TI Effects of iso-octane/ethanol blend ratios on the observance of negative temperature coefficient behavior within the Ignition Quality Tester SO FUEL LA English DT Article DE IQT; Iso-octane; Ethanol; Ignition; NTC; Fuel blends ID CONSTANT-VOLUME COMBUSTION; REFERENCE FUELS; HIGH-PRESSURES; AUTOIGNITION; GASOLINE; ETHANOL; MIXTURES; SURROGATES; KINETICS; ENGINE AB An ignition delay study investigating the reduction in low temperature heat release (LTHR) and negative temperature coefficient (NTC) region with increasing ethanol concentration in binary blends of ethanol/isooctane was conducted in the Ignition Quality Tester (IQT). The IQT is advantageous for studying multi component fuels such as iso-octane/ethanol which are difficult to study at lower temperatures covering the NTC region in traditional systems (e.g., shock tubes, rapid compression machines, etc.). The high octane numbers and concomitant long ignition delay times of ethanol and iso-octane are ideal for study in the IQT allowing the system to reach a quasi-homogeneous mixture; allowing the effect of fuel chemistry on ignition delay to be investigated with minimal impact from the fuel spray due to the relatively long ignition times. NTC behavior from iso-octane/ethanol blends was observed for the first time using an IQT. Temperature sweeps of iso-octane/ethanol volumetric blends (100/0, 90/10, 80/20, 50/50, and 0/100) were conducted from 623 to 993 K at 0.5, 1.0 and 1.5 MPa and global equivalence ratios ranging from 0.7 to 1.0. Ignition of the iso-octane/ethanol blends in the IQT was also modeled using a 0-D homogeneous batch reactor model. Significant observations include: (1) NTC behavior was observed for ethanol/isooctane fuel blends up to 20% ethanol. (2) Ethanol produced shorter ignition delay times than isooctane in the high temperature region. (3) The initial increase in ethanol from 0% to 10% had a lesser impact on ignition delay than increasing ethanol from 10% to 20%. (4) The 0-D model predicts that at 0.5 and 1.0 MPa ethanol produces the shortest ignition time in the high-temperature regime, as seen experimentally. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Bogin, Gregory E., Jr.; Osecky, Eric] Colorado Sch Mines, Golden, CO 80401 USA. [Luecke, Jon; Ratcliff, Matthew A.; Zigler, Bradley T.] Natl Renewable Energy Lab, Golden, CO USA. RP Bogin, GE (reprint author), Colorado Sch Mines, Golden, CO 80401 USA. EM gbogin@mines.edu FU DOE [DE-AC36-08-GO28308]; National Renewable Energy Laboratory; U.S. DOE Office of Energy Efficiency and Renewable Energy (EERE); Bioenergy Technologies and Vehicle Technologies Offices; U.S. Department of Energy (DOE) Vehicle Technologies Office; U.S. Department of Energy (DOE) Fuel Technologies FX The authors thank the U.S. Department of Energy's (DOE's) Vehicle Technologies Office and Fuel Technologies Program Manager Kevin Stork for their support of this fuels research. This work was supported by the DOE under Contract No. DE-AC36-08-GO28308 with the National Renewable Energy Laboratory. This research was conducted as part of the Co-Optimization of Fuels & Engines (Co-Optima) project sponsored by the U.S. DOE Office of Energy Efficiency and Renewable Energy (EERE) and the Bioenergy Technologies and Vehicle Technologies Offices. The Co-Optima project is a collaborative project of multiple national laboratories initiated to simultaneously accelerate the introduction of affordable, scalable, and sustainable biofuels and high-efficiency, low emission vehicle engines. NR 29 TC 1 Z9 1 U1 15 U2 15 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0016-2361 EI 1873-7153 J9 FUEL JI Fuel PD DEC 15 PY 2016 VL 186 BP 82 EP 90 DI 10.1016/j.fuel.2016.08.021 PG 9 WC Energy & Fuels; Engineering, Chemical SC Energy & Fuels; Engineering GA DY7OK UT WOS:000385318600009 ER PT J AU Martinez, N Garcia, R Fierro, JLG Wheeler, C Austin, RN Gallagher, JR Miller, JT Krause, TR Escalona, N Sepulveda, C AF Martinez, N. Garcia, R. Fierro, J. L. G. Wheeler, C. Austin, R. N. Gallagher, J. R. Miller, J. T. Krause, T. R. Escalona, N. Sepulveda, C. TI Effect of Cu addition as a promoter on Re/SiO2 catalysts in the hydrodeoxygenation of 2-methoxyphenol as a model bio oil compound SO FUEL LA English DT Article DE Cu promoter; Re metal; Hydrodeoxygenation; Active sites; Hydrogen spillover ID MOLYBDENUM NITRIDE CATALYSTS; HYDROGEN SPILLOVER; GUAIACOL HYDRODEOXYGENATION; BIOMASS PYROLYSIS; SUPPORT; RHENIUM; HYDRODESULFURIZATION; CONVERSION; ANISOLE; NI AB The promoting effect of Cu on Re/SiO2 catalysts was studied for guaiacol hydrodeoxygenation. Cu(x)Re/SiO2 catalysts containing from 0 to 1.91 wt% Cu and 13 wt% of Re were prepared by successive wet impregnation and characterized using X-ray diffraction (XRD), nitrogen sorption, CO chemisorption, X-ray photoelectron spectroscopy (XPS), X-ray absorption spectroscopy (XAS) and surface acidity techniques. Batch reactions were carried out at 300 degrees C and 5 MPa of H-2. The Cu(x)Re/SiO2 catalysts displayed higher activities than the Re/SiO2 catalyst with a maximum activity at 1.58 wt% Cu. At loadings above 1.5 wt%, aggregate formation and a loss of metallic Re active sites lead to a decreased activity. The increase of the activity was attributed not only to Cu increasing the Re reducibility, but also to Cu somehow increasing the metallic Re active sites favoring guaiacol conversion. All catalysts displayed the same product distribution, confirming that the Cu in the Cu(x)Re/SiO2 not change the nature of the active site in the metallic Re nanoparticles. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Martinez, N.; Garcia, R.; Sepulveda, C.] Univ Concepcion, Fac Ciencias Quim, Casilla 160C, Concepcion, Chile. [Fierro, J. L. G.] CSIC, Inst Catalisis & Petroquim, Madrid 28049, Spain. [Wheeler, C.; Austin, R. N.] Univ Maine, Dept Chem & Biol Engn, Orono, ME 04469 USA. [Wheeler, C.; Austin, R. N.] Univ Maine, Forest Bioprod Res Inst, Orono, ME 04469 USA. [Gallagher, J. R.; Krause, T. R.] Argonne Natl Lab, Chem Sci & Engn Div, Lemont, IL 60439 USA. [Miller, J. T.] Purdue Univ, Sch Chem Engn, W Lafayette, IN 47907 USA. [Escalona, N.] Pontificia Univ Catolica Chile, Dept Ingn Quim & Bioproc, Escuela Ingn, Ave Vicuna Mackenna 4860, Santiago, Chile. [Escalona, N.] Pontificia Univ Catolica Chile, Dept Quim Fis, Fac Quim, Santiago, Chile. RP Sepulveda, C (reprint author), Univ Concepcion, Fac Ciencias Quim, Casilla 160C, Concepcion, Chile. EM cathsepulveda@udec.cl RI Wheeler, M Clayton/C-9649-2012 OI Wheeler, M Clayton/0000-0003-1113-1324 FU CONICYT-Chile [1140528, PFB-27, FONDEQUIP EQM 120096]; U.S. Department of Energy, Office of Science, Basic Energy Sciences [DE-FG02-07ER46373]; U. S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-AC02-06CH11357]; Department of Energy; MRCAT member institutions FX The authors thank CONICYT-Chile for FONDECYT No 1140528, PFB-27 and FONDEQUIP EQM 120096 grants. MCW, RNA and CS acknowledge support from the U.S. Department of Energy, Office of Science, Basic Energy Sciences, under Award # DE-FG02-07ER46373. Use of the Advanced Photon Source was supported by the U. S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract No. DE-AC02-06CH11357. MRCAT operations are supported by the Department of Energy and the MRCAT member institutions. NR 56 TC 1 Z9 1 U1 43 U2 43 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0016-2361 EI 1873-7153 J9 FUEL JI Fuel PD DEC 15 PY 2016 VL 186 BP 112 EP 121 DI 10.1016/j.fuel.2016.08.065 PG 10 WC Energy & Fuels; Engineering, Chemical SC Energy & Fuels; Engineering GA DY7OK UT WOS:000385318600012 ER PT J AU Jia, DN Bi, XT Lim, CJ Sokhansanj, S Tsutsumi, A AF Jia, Dening Bi, Xiaotao Lim, C. Jim Sokhansanj, Shahab Tsutsumi, Atsushi TI Biomass drying in a pulsed fluidized bed without inert bed particles SO FUEL LA English DT Article DE Fluidized bed; Pulsation; Modeling; Drying; Mass transfer; Biomass ID EFFECTIVE MOISTURE DIFFUSIVITY; FIELD-ASSISTED FLUIDIZATION; HEAT-TRANSFER COEFFICIENT; MAGNETIC-FIELD; VIBROFLUIDIZED BEDS; ELECTRIC-FIELD; MASS-TRANSFER; FINE POWDERS; DRYER; FLOW AB Batch drying was performed in the pulsed fluidized bed with various species of biomass particles as an indicator of gas-solid contact efficiency and mass transfer rate under different operating conditions including pulsation duty cycle and particle size distribution. The fluidization of cohesive biomass particles benefited from the shorter opening time of pulsed gas flow and increased peak pressure drop. The presence of fines enhanced gas-solid contact of large and irregular biomass particles, as well as the mass transfer efficiency. A drying model based on two-phase theory was proposed, from which effective diffusivity was calculated for various gas flow rates, temperature and pulsation frequency. Intricate relationship was discovered between pulsation frequency and effective diffusivity, as mass transfer was deeply connected with the hydrodynamics. Effective diffusivity was also found to be proportional to gas flow rate and drying temperature. Operating near the natural frequency of the system also favored drying and mass transfer. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Jia, Dening; Bi, Xiaotao; Lim, C. Jim; Sokhansanj, Shahab] Univ British Columbia, Dept Chem & Biol Engn, 2360 East Mall, Vancouver, BC V6T 1Z3, Canada. [Sokhansanj, Shahab] Oak Ridge Natl Lab, Div Environm Sci, POB 2008, Oak Ridge, TN 37831 USA. [Tsutsumi, Atsushi] Univ Tokyo, Inst Ind Sci, Collaborat Res Ctr Energy Engn, Meguro Ku, 4-6-1 Komaba, Tokyo 1538505, Japan. RP Bi, XT (reprint author), Univ British Columbia, Dept Chem & Biol Engn, 2360 East Mall, Vancouver, BC V6T 1Z3, Canada. EM xbi@chbe.ubc.ca OI Jia, Dening/0000-0001-7515-5400 FU Natural Sciences and Engineering Research Council of Canada (NSERC) FX The authors are grateful to the Natural Sciences and Engineering Research Council of Canada (NSERC) for the financial support in the form of a Canada-Japan Joint Strategic Project, Tolko Industries Ltd. for the generous donation of tested biomass samples, and Noram Engineering and Constructions for its in-kind contribution to the project. NR 91 TC 0 Z9 0 U1 15 U2 15 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0016-2361 EI 1873-7153 J9 FUEL JI Fuel PD DEC 15 PY 2016 VL 186 BP 270 EP 284 DI 10.1016/j.fuel.2016.08.100 PG 15 WC Energy & Fuels; Engineering, Chemical SC Energy & Fuels; Engineering GA DY7OK UT WOS:000385318600028 ER PT J AU Aston, JE Thompson, DN Westover, TL AF Aston, John E. Thompson, David N. Westover, Tyler L. TI Performance assessment of dilute-acid leaching to improve corn stover quality for thermochemical conversion SO FUEL LA English DT Article DE Corn stover; Pyrolysis; Hydrothermal liquefaction; Combustion; Leaching; Ash ID HYDROTHERMAL LIQUEFACTION; BIO-OIL; INORGANIC CONSTITUENTS; AIR CLASSIFICATION; BIOMASS; PYROLYSIS; FEEDSTOCK; IMPACT; PRETREATMENT; REMOVAL AB Lignocellulosic biomass is a sustainable energy source that can help meet the demand for biofuels in the United States. However, the quality and availability of such feedstocks greatly affect their suitability for downstream conversion. This work reports the effects of dilute-acid leaching at various aqueous loadings, temperatures and catalyst loadings (sulfuric acid) on the quality of a traditional biochemical feedstock, corn stover, as a potential feedstock for thermochemical conversions. At 95 wt% aqueous, dilute-acid leaching was observed to effectively remove 97.3% of the alkali metals and alkaline earth metals that can negatively affect degradation pathways during pyrolysis and result in greater yield of non-condensable gases. In addition, up to 98.4% of the chlorine and 88.8% of the phosphorus, which can cause equipment corrosion and foul upgrading catalysts, respectively, were removed. At 25 degrees C in the absence of the acid catalyst, only 6.8% of the alkali metals and alkaline earth metals were removed; however, 88.0% of chloride was still removed. The ratio of alkaline/acidic ash species has been suggested to proportionately relate to slagging in combustion applications. The initial alkali/acid ratio of the ash species present in the untreated corn stover was 0.38 (significant slagging risk). At 95 wt% aqueous, this ratio was decreased to 0.18 (moderate slagging risk). At 0 wt% catalyst and 90 degrees C, the ratio was decreased to 0.07, 0.08 and 0.06 at 0.5 wt% catalyst at 25 degrees C, 50 degrees C and 90 degrees C, respectively (low slagging risk). Increasing the catalyst loading to 1.0% slightly decreased the measured alkali/acid ratio of remaining ash. The results presented here show that a water wash or a dilute-acid preprocessing step can improve corn stover quality for pyrolysis, hydrothermal liquefaction and combustion. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Aston, John E.; Thompson, David N.] Idaho Natl Lab, Biol & Chem Proc Dept, Idaho Falls, ID USA. [Westover, Tyler L.] Idaho Natl Lab, Biofuels & Renewable Energy Technol Dept, Idaho Falls, ID USA. RP Aston, JE (reprint author), Idaho Natl Lab, POB 1625, Idaho Falls, ID 83415 USA. EM John.Aston@inl.gov FU US Department of Energy, Office of Energy Efficiency and Renewable Energy under DOE Idaho Operations Office [DE-AC07-05ID14517] FX This work was supported by the US Department of Energy, Office of Energy Efficiency and Renewable Energy under DOE Idaho Operations Office Contract No. DE-AC07-05ID14517. Additional analytic support was provided by Rachel Emerson, Manunya Phanphanich and Karen Delezene-Briggs at the INL. Huffman Laboratories performed the ash compositional analyses of untreated and treated samples. NR 41 TC 0 Z9 0 U1 28 U2 28 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0016-2361 EI 1873-7153 J9 FUEL JI Fuel PD DEC 15 PY 2016 VL 186 BP 311 EP 319 DI 10.1016/j.fuel.2016.08.056 PG 9 WC Energy & Fuels; Engineering, Chemical SC Energy & Fuels; Engineering GA DY7OK UT WOS:000385318600032 ER PT J AU Finstad, K Pfeiffer, M McNicol, G Barnes, J Demergasso, C Chong, G Amundson, R AF Finstad, Kari Pfeiffer, Marco McNicol, Gavin Barnes, Jaime Demergasso, Cecilia Chong, Guillermo Amundson, Ronald TI Rates and geochemical processes of soil and salt crust formation in Salars of the Atacama Desert, Chile SO GEODERMA LA English DT Article DE Groundwater; Salts; Evaporation; Isotope; Salt crust ID NORTHERN CHILE; HYPERARID CORE; CHLORINE ISOTOPE; CLIMATE-CHANGE; FORE-ARC; GROUNDWATER; EVAPORATION; EVAPORITES; DEPOSITS; FRACTIONATION AB The hyperarid Atacama Desert contains numerous local basins with surficial salt crusts, known as salars, where evaporation of shallow groundwater drives the major soil processes. We examine chemical and isotopic profiles in two soils of differing ages from the Salar Llamara to determine the geochemical processes involved in their formation. Evaporation, which provides salts to the soils through mineral precipitation, decreases with increasing salt crust thickness, and average similar to 0.03 mm m(-2) d(-1) over geological time frames. Salt distribution varies predictably with depth and soil age, with the most soluble compounds concentrated nearest to the land surface, indicating the direction of fluid flow. delta S-34 values of mineral sulfate tend to decrease with decreasing soil depth, following a pattern indicative of Rayleigh-like fractionation as solute-rich waters migrate toward the land surface. delta C-13 and delta O-18 values of carbonate suggest that the uppermost halite layers, which contain very small amounts of carbonate, have a strong biological signature. In contrast, carbonate-rich layers deeper in the profiles consist of largely unmodified lacustrine carbonate that formed in highly evaporitic lake conditions. The continuous upward evaporation of water and dissolved solutes creates a rugged and physically dynamic halite crust composed of rounded salt nodules. The crust undergoes deliquescence as atmospheric relative humidity rises from marine air intrusions, and we found that the halite nodules on the surface of the Salar Llamara are nearly always at or above deliquescence relative humidity. The interiors of these nodules are therefore able to buffer the large diurnal changes in atmospheric relative humidity allowing for the survival of halophilic microbial communities in an otherwise very dry environment. Radiocarbon measurements of occluded organic C in the surface crusts indicate that C cycling occurs at differing rates depending on local micrometeorological conditions, and that a given salt crust feature may persist for thousands of years once formed. (C) 2016 Elsevier B.V. All rights reserved. C1 [Finstad, Kari; Pfeiffer, Marco; McNicol, Gavin; Amundson, Ronald] Univ Calif Berkeley, Dept Environm Sci Policy & Management, 137 Mulford Hall, Berkeley, CA 94720 USA. [Pfeiffer, Marco] Univ Chile, Fac Ciencias Agron, Dept Ingn & Suelos, Santa Rosa 11315, La Pintana, Chile. [McNicol, Gavin] Lawrence Livermore Natl Lab, Ctr Accelerator Mass Spectrometry, Livermore, CA 94550 USA. [Barnes, Jaime] Univ Texas Austin, Dept Geol Sci, Austin, TX 78712 USA. [Demergasso, Cecilia] Univ Catolica Norte, Ctr Biotecnol, Antofagasta, Chile. [Chong, Guillermo] Univ Catolica Norte, Dept Ciencias Geol, Antofagasta, Chile. RP Finstad, K (reprint author), Univ Calif Berkeley, Dept Environm Sci Policy & Management, 137 Mulford Hall, Berkeley, CA 94720 USA. EM karifinstad@berkeley.edu RI Barnes, Jaime/B-5454-2011; OI Pfeiffer, Marco/0000-0002-3636-539X; Demergasso, Cecilia/0000-0003-4563-3066 FU NASA Earth and Space Sciences Fellowship; NSF Doctoral Dissertation Improvement Grant; CONICYT for Becas Chile Scholarship; Fulbright Foreign Student Program Scholarship; University of California Agricultural Experiment Station; NSF [0819972] FX We are grateful for all the support received while completing this work. Funding to K.F. through the NASA Earth and Space Sciences Fellowship and NSF Doctoral Dissertation Improvement Grant, to M.P. through the CONICYT for Becas Chile Scholarship and the Fulbright Foreign Student Program Scholarship, and to R.A. through the University of California Agricultural Experiment Station and NSF grant # 0819972. We would like to thank D. Drew for help with chlorine isotope analyses. Finally, we thank the reviewers for their thoughtful and thorough comments which have strengthened this manuscript. NR 56 TC 0 Z9 0 U1 47 U2 47 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0016-7061 EI 1872-6259 J9 GEODERMA JI Geoderma PD DEC 15 PY 2016 VL 284 BP 57 EP 72 DI 10.1016/j.geoderma.2016.08.020 PG 16 WC Soil Science SC Agriculture GA DY7PU UT WOS:000385322500007 ER PT J AU Sang, LZ Knesting, KM Bulusu, A Sigdel, AK Giordano, AJ Marder, SR Berry, JJ Graham, S Ginger, DS Pemberton, JE AF Sang, Lingzi Knesting, Kristina M. Bulusu, Anuradha Sigdel, Ajaya K. Giordano, Anthony J. Marder, Seth R. Berry, Joseph J. Graham, Samuel Ginger, David S. Pemberton, Jeanne E. TI Effect of time and deposition method on quality of phosphonic acid modifier self-assembled monolayers on indium zinc oxide SO APPLIED SURFACE SCIENCE LA English DT Article DE Self-assembly; Phosphonic acid deposition methods; Indium zinc oxide (IZO); Organic photovoltaic (OPV) ID SCANNING-TUNNELING-MICROSCOPY; FIELD-EFFECT TRANSISTORS; PRESSURE SOLID-PHASES; POLYMER SOLAR-CELLS; LIGHT-EMITTING-DIODES; TIN OXIDE; PM-IRRAS; PHENYLPHOSPHONIC ACID; SURFACE-ENERGY; METAL-SURFACES AB Phosphonic acid (PA) self-assembled monolayers (SAMs) are utilized at critical interfaces between transparent conductive oxides (TCO) and organic active layers in organic photovoltaic devices (OPVs). The effects of PA deposition method and time on the formation of close-packed, high-quality monolayers is investigated here for SAMs fabricated by solution deposition, micro-contact printing, and spray coating. The solution deposition isotherm for pentafluorinated benzylphosphonic acid (F5BnPA) on indium-doped zinc oxide (IZO) is studied using polarization modulation-infrared reflection-absorption spectroscopy (PM-IRRAS) at room temperature as a model PA/IZO system. Fast surface adsorption occurs within the first min; however, well-oriented high-quality SAMs are reached only after similar to 48 h, presumably through a continual process of molecular adsorption/desorption and monolayer filling accompanied by molecular reorientation. Two other rapid, soak-free deposition techniques, micro-contact printing and spray coating, are also explored. SAM quality is compared for deposition of phenyl phosphonic acid (PPA), F-13-octylphosphonic acid (F(13)OPA), and pentafluorinated benzyl phosphonic acid (F(5)BnPA) by solution deposition, micro-contact printing and spray coating using PM-IRRAS. In contrast to micro-contact printing and spray coating techniques, 48-168h solution deposition at both room temperature and 70 degrees C result in contamination- and surface etch-free close-packed monolayers with good reproducibility. SAMs fabricated by micro-contact printing and spray coating are much less well ordered. (C) 2016 Elsevier B.V. All rights reserved. C1 [Sang, Lingzi; Pemberton, Jeanne E.] Univ Arizona, Dept Chem & Biochem, Tucson, AZ 85721 USA. [Knesting, Kristina M.; Ginger, David S.] Univ Washington, Dept Chem, Seattle, WA 98195 USA. [Bulusu, Anuradha; Graham, Samuel] Georgia Inst Technol, Sch Mech Engn, Atlanta, GA 30332 USA. [Sigdel, Ajaya K.; Berry, Joseph J.] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Giordano, Anthony J.; Marder, Seth R.] Georgia Inst Technol, Sch Chem & Biochem, Atlanta, GA 30332 USA. [Giordano, Anthony J.; Marder, Seth R.] Georgia Inst Technol, Ctr Organ Photon & Elect, Atlanta, GA 30332 USA. RP Pemberton, JE (reprint author), Univ Arizona, Dept Chem & Biochem, Tucson, AZ 85721 USA. EM pembertn@email.arizona.edu FU Center for Interface Science: Solar Electric Materials, an Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-SC0001084]; National Science Foundation [DGE-0644493]; Department of Energy Office of Science Graduate Fellowship Program (DOE SCGF) [DE-AC05-06OR23100] FX This work was supported as part of the Center for Interface Science: Solar Electric Materials, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under award number DE-SC0001084. A.J.G. acknowledges a National Science Foundation Graduate Research Fellowship (DGE-0644493), and K.M.K. acknowledges the Department of Energy Office of Science Graduate Fellowship Program (DOE SCGF), made possible in part by the American Recovery and Reinvestment Act of 2009, administered by ORISE-ORAU under contract DE-AC05-06OR23100. NR 70 TC 0 Z9 0 U1 88 U2 88 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0169-4332 EI 1873-5584 J9 APPL SURF SCI JI Appl. Surf. Sci. PD DEC 15 PY 2016 VL 389 BP 190 EP 198 DI 10.1016/j.apsusc.2016.06.183 PG 9 WC Chemistry, Physical; Materials Science, Coatings & Films; Physics, Applied; Physics, Condensed Matter SC Chemistry; Materials Science; Physics GA DX7OL UT WOS:000384577600023 ER PT J AU Yang, WD Marshak, A McBride, PJ Chiu, JC Knyazikhin, Y Schmidt, KS Flynn, C Lewis, ER Eloranta, EW AF Yang, Weidong Marshak, Alexander McBride, Patrick J. Chiu, J. Christine Knyazikhin, Yuri Schmidt, K. Sebastian Flynn, Connor Lewis, Ernie R. Eloranta, Edwin W. TI Observation of the spectrally invariant properties of clouds in cloudy-to-clear transition zones during the MAGIC field campaign SO ATMOSPHERIC RESEARCH LA English DT Article DE Transition zone; Cloud; Cloud-aerosol interaction; Air entrainment and mixing; Spectral invariance; MAGIC field campaign ID TRADE-WIND CUMULUS; RADIATIVE-TRANSFER; OPTICAL-THICKNESS; ZENITH RADIANCE; ENTRAINMENT; HUMIDITY; MODEL AB We use the spectrally invariant method to study the variability of cloud optical thickness tau and droplet effective radius r(eff) in transition zones (between the cloudy and clear sky columns) observed from Solar Spectral Flux Radiometer (SSFR) and Shortwave Array Spectroradiometer-Zenith (SASZe) during the Marine ARM GPCI Investigation of Clouds (MAGIC) field campaign. The measurements from the SSFR and the SASZe are different, however inter-instrument differences of self-normalized measurements (divided by their own spectra at a fixed time) are small. The spectrally invariant method approximates the spectra in the cloud transition zone as a linear combination of definitely clear and cloudy spectra, where the coefficients, slope and intercept, characterize the spectrally invariant properties of the transition zone. Simulation results from the SBDART (Santa Barbara DISORT Atmospheric Radiative Transfer) model demonstrate that (1) the slope of the visible band is positively correlated with the cloud optical thickness tau while the intercept of the near-infrared band has high negative correlation with the cloud drop effective radius r(eff) even without the exact knowledge of tau; (2) the above relations hold for all Solar Zenith Angle (SZA) and for cloud-contaminated skies. In observations using redundant measurements from SSFR and SASZe, we find that during cloudy-to-clear transitions, (a) the slopes of the visible band decrease, and (b) the intercepts of the near-infrared band remain almost constant near cloud edges. The finding in simulations and observations suggest that, while the optical thickness decreases during the cloudy-to-clear transition, the cloud drop effective radius does not change when cloud edges are approached. These results support the hypothesis that inhomogeneous mixing dominates near cloud edges in the studied cases. (C) 2016 Elsevier B.V. All rights reserved. C1 [Yang, Weidong; Marshak, Alexander] NASA, Goddard Space Flight Ctr, Climate & Radiat Branch, Code 661, Greenbelt, MD 20771 USA. [Yang, Weidong] Univ Space Res Assoc, Columbia, MD USA. [McBride, Patrick J.] ASTRA, Boulder, CO USA. [Chiu, J. Christine] Univ Reading, Dept Meteorol, Reading, Berks, England. [Knyazikhin, Yuri] Boston Univ, Dept Geog & Environm, Boston, MA 02215 USA. [Schmidt, K. Sebastian] Univ Colorado, Atmospher & Space Phys Lab, Campus Box 392, Boulder, CO 80309 USA. [Flynn, Connor] Pacific Northwest Natl Lab, POB 999,MSIN K4-28, Richland, WA 99352 USA. [Lewis, Ernie R.] Brookhaven Natl Lab, Environm & Climate Sci Dept, Upton, NY 11973 USA. [Eloranta, Edwin W.] Univ Wisconsin, Space Sci & Engn Ctr, Madison, WI USA. RP Yang, WD (reprint author), NASA, Goddard Space Flight Ctr, Climate & Radiat Branch, Code 661, Greenbelt, MD 20771 USA. EM weidong.yang@nasa.gov RI Chiu, Christine/E-5649-2013; Marshak, Alexander/D-5671-2012; OI Chiu, Christine/0000-0002-8951-6913; SCHMIDT, KONRAD SEBASTIAN/0000-0003-3899-228X FU Office of Science (BER), U.S. Department of Energy (DOE) [DE-SC0005457, DE-SC0011666]; U.S. Department of Energy's Atmospheric System Research Program (Office of Science, BER) [DE-SC00112704]; Horizon Lines; Captain and crew of the Horizon Spirit FX This research was supported by the Office of Science (BER), U.S. Department of Energy (DOE), under grant DE-SC0005457. J. C. Chiu was supported by the Office of Science (BER), U.S. Department of Energy (DOE) under grant DE-SC0011666. E. Lewis was supported by the U.S. Department of Energy's Atmospheric System Research Program (Office of Science, BER) under Contract No. DE-SC00112704. Thanks to Warren Gore of NASA Ames Research Center for his support of the SSFR during MAGIC. We thank Horizon Lines and the Captain and crew of the Horizon Spirit for their support and hospitality during MAGIC. We would also like to thank David Troyan and Tami Toto for ship movement correction; and Laurie Gregory, Richard Wagener and Cimel Electronique for their help with deploying the Cimel sun photometer on the ship. The MAGIC data can be found at http://www.arm.gov/campaigns/amf2012magic. NR 35 TC 0 Z9 0 U1 10 U2 10 PU ELSEVIER SCIENCE INC PI NEW YORK PA 360 PARK AVE SOUTH, NEW YORK, NY 10010-1710 USA SN 0169-8095 EI 1873-2895 J9 ATMOS RES JI Atmos. Res. PD DEC 15 PY 2016 VL 182 BP 294 EP 301 DI 10.1016/j.atmosres.2016.08.004 PG 8 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA DY1QG UT WOS:000384868900025 ER PT J AU Frohlich-Nowoisky, J Kampf, CJ Weber, B Huffman, JA Pohlker, C Andreae, MO Lang-Yona, N Burrows, SM Gunthe, SS Elbert, W Su, H Hoor, P Thines, E Hoffmann, T Despres, VR Poschl, U AF Froehlich-Nowoisky, Janine Kampf, Christopher J. Weber, Bettina Huffman, J. Alex Poehlker, Christopher Andreae, Meinrat O. Lang-Yona, Naama Burrows, Susannah M. Gunthe, Sachin S. Elbert, Wolfgang Su, Hang Hoor, Peter Thines, Eckhard Hoffmann, Thorsten Despres, Viviane R. Poeschl, Ulrich TI Bioaerosols in the Earth system: Climate, health, and ecosystem interactions SO ATMOSPHERIC RESEARCH LA English DT Review DE Bioaerosol; Biological ice nuclei; Allergens; Bacteria; Fungi ID BIOLOGICAL AEROSOL-PARTICLES; ICE NUCLEATION ACTIVITY; METHYLAMINO-L-ALANINE; REAL-TIME PCR; AIRBORNE BACTERIAL COMMUNITIES; CLOUD CONDENSATION NUCLEI; SEA SPRAY AEROSOL; BET V 1; RAGWEED AMBROSIA-ARTEMISIIFOLIA; AMYOTROPHIC-LATERAL-SCLEROSIS AB Aerosols of biological origin play a vital role in the Earth system, particularly in the interactions between atmosphere, biosphere, climate, and public health. Airborne bacteria, fungal spores, pollen, and other bioparticles are essential for the reproduction and spread of organisms across various ecosystems, and they can cause or enhance human, animal, and plant diseases. Moreover, they can serve as nuclei for cloud droplets, ice crystals, and precipitation, thus influencing the hydrological cycle and climate. The sources, abundance, composition, and effects of biological aerosols and the atmospheric microbiome are, however, not yet well characterized and constitute a large gap in the scientific understanding of the interaction and co-evolution of life and climate in the Earth system. This review presents an overview of the state of bioaerosol research, highlights recent advances, and outlines future perspectives in terms of bioaerosol identification, characterization, transport, and transformation processes, as well as their interactions with climate, health, and ecosystems, focusing on the role bioaerosols play in the Earth system. (C) 2016 The Authors and Battelle Memorial Institute. Published by Elsevier B.V. C1 [Froehlich-Nowoisky, Janine; Kampf, Christopher J.; Weber, Bettina; Poehlker, Christopher; Andreae, Meinrat O.; Lang-Yona, Naama; Elbert, Wolfgang; Su, Hang; Poeschl, Ulrich] Max Planck Inst Chem, Multiphase Chem Dept, Mainz, Germany. [Froehlich-Nowoisky, Janine; Kampf, Christopher J.; Weber, Bettina; Poehlker, Christopher; Andreae, Meinrat O.; Lang-Yona, Naama; Elbert, Wolfgang; Su, Hang; Poeschl, Ulrich] Max Planck Inst Chem, Biogeochem Dept, Mainz, Germany. [Kampf, Christopher J.; Hoffmann, Thorsten] Johannes Gutenberg Univ Mainz, Inst Inorgan & Analyt Chem, Mainz, Germany. [Huffman, J. Alex] Univ Denver, Dept Chem & Biochem, Denver, CO USA. [Burrows, Susannah M.] Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. [Gunthe, Sachin S.] IIT Madras, Dept Civil Engn, Madras, Tamil Nadu, India. [Hoor, Peter] Johannes Gutenberg Univ Mainz, Inst Atmospher Phys, Mainz, Germany. [Thines, Eckhard] Johannes Gutenberg Univ Mainz, Inst Microbiol & Wine Res, Mainz, Germany. [Despres, Viviane R.] Johannes Gutenberg Univ Mainz, Inst Gen Bot, Mainz, Germany. RP Frohlich-Nowoisky, J; Poschl, U (reprint author), Max Planck Inst Chem, Multiphase Chem Dept, Mainz, Germany.; Frohlich-Nowoisky, J; Poschl, U (reprint author), Max Planck Inst Chem, Biogeochem Dept, Mainz, Germany. EM j.frohlich@mpic.de; u.poschl@mpic.de RI Poschl, Ulrich/A-6263-2010; Huffman, J. Alex/A-7449-2010; Ghasemi, Elahe/Q-5340-2016; Su, Hang/A-6226-2010; Froehlich, Janine/D-6227-2015; Pohlker, Christopher/S-5207-2016; Andreae, Meinrat/B-1068-2008; Kampf, Christopher/B-3430-2014; OI Poschl, Ulrich/0000-0003-1412-3557; Huffman, J. Alex/0000-0002-5363-9516; Su, Hang/0000-0003-4889-1669; Froehlich, Janine/0000-0002-1278-0054; Andreae, Meinrat/0000-0003-1968-7925; Kampf, Christopher/0000-0002-8751-5140; Burrows, Susannah/0000-0002-0745-7252 FU Max Planck Society; Weizmann Institute of Science - National Postdoctoral Award Program for Advancing Women in Science; University of Denver; U.S. Department of Energy, Office of Science Biological and Environmental Research Program FX The authors gratefully acknowledge stimulating scientific exchange and discussions with numerous members of the scientific community, in particular with colleagues involved in the referenced studies, on which this review and perspective article is building, and with members of the Mainz Bioaerosol Laboratory (MBAL). N.L.-Y. acknowledges support from the Max Planck Society and from the Weizmann Institute of Science - National Postdoctoral Award Program for Advancing Women in Science. J.A.H. acknowledges internal support from the University of Denver. S.M.B. acknowledges support from the U.S. Department of Energy, Office of Science Biological and Environmental Research Program. NR 520 TC 4 Z9 4 U1 149 U2 149 PU ELSEVIER SCIENCE INC PI NEW YORK PA 360 PARK AVE SOUTH, NEW YORK, NY 10010-1710 USA SN 0169-8095 EI 1873-2895 J9 ATMOS RES JI Atmos. Res. PD DEC 15 PY 2016 VL 182 BP 346 EP 376 DI 10.1016/j.atmosres.2016.07.018 PG 31 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA DY1QG UT WOS:000384868900029 ER PT J AU Villarrubia, CWN Soavi, F Santoro, C Arbizzani, C Serov, A Rojas-Carbonell, S Gupta, G Atanassov, P AF Villarrubia, Claudia W. Narvaez Soavi, Francesca Santoro, Carlo Arbizzani, Catia Serov, Alexey Rojas-Carbonell, Santiago Gupta, Gautam Atanassov, Plamen TI Self-feeding paper based biofuel cell/self-powered hybrid mu-supercapacitor integrated system SO BIOSENSORS & BIOELECTRONICS LA English DT Article DE Enzymatic fuel cell; Supercapacitor; Paper-based microfluidic system; Power pulses ID GLUCOSE-OXIDASE; METHYLENE GREEN; FUEL-CELLS; ELECTRODES; BIOCAPACITOR; BIOSENSORS; DEVICES; ENZYMES; BIOELECTROCATALYSIS; PERFORMANCE AB For the first time, a paper based enzymatic fuel cell is used as self-recharged supercapacitor. In this supercapacitive enzymatic fuel cell (SC-EFC), the supercapacitive features of the electrodes are exploited to demonstrate high power output under pulse operation. Glucose dehydrogenase-based anode and bilirubin oxidase-based cathode were assembled to a quasi-2D capillary-driven microfluidic system. Capillary flow guarantees the continuous supply of glucose, cofactor and electrolytes to the anodic enzyme and the gas-diffusional cathode design provides the passive supply of oxygen to the catalytic layer of the electrode. The paper-based cell was self-recharged under rest and discharged by high current pulses up to 4 mA cm(-2). The supercapacitive behavior and low equivalent series resistance of the cell permitted to achieve up to a maximum power of 0.87 mW cm(-2) (10.6 mW) for pulses of 0.01 s at 4 mA cm(-2). This operation mode "allowed the system to achieve at least one order of magnitude higher current/power generation compared to the steady state operation. (C) 2016 Elsevier B.V. All rights reserved. C1 [Villarrubia, Claudia W. Narvaez; Gupta, Gautam] Los Alamos Natl Lab, MPA Mat Synth & Integrated Devices 11, Los Alamos, NM USA. [Soavi, Francesca; Arbizzani, Catia] Alma Mater Studiorum Univ Bologna, Dept Chem Giacomo Ciamician, Via Selmi 2, I-40126 Bologna, Italy. [Santoro, Carlo; Serov, Alexey; Rojas-Carbonell, Santiago; Atanassov, Plamen] Univ New Mexico, Dept Chem & Biol Engn, CMEM, Albuquerque, NM 87131 USA. RP Soavi, F (reprint author), Alma Mater Studiorum Univ Bologna, Dept Chem Giacomo Ciamician, Via Selmi 2, I-40126 Bologna, Italy.; Atanassov, P (reprint author), Univ New Mexico, Dept Chem & Biol Engn, CMEM, Albuquerque, NM 87131 USA. EM francesca.soavi@unibo.it; plamen@unm.edu FU Alma Mater Studiorum - Universita di Bologna (Researcher Mobility Program) FX FS and CA acknowledge financial support by Alma Mater Studiorum - Universita di Bologna (Researcher Mobility Program). NR 58 TC 1 Z9 1 U1 95 U2 96 PU ELSEVIER ADVANCED TECHNOLOGY PI OXFORD PA OXFORD FULFILLMENT CENTRE THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0956-5663 EI 1873-4235 J9 BIOSENS BIOELECTRON JI Biosens. Bioelectron. PD DEC 15 PY 2016 VL 86 BP 459 EP 465 DI 10.1016/j.bios.2016.06.084 PG 7 WC Biophysics; Biotechnology & Applied Microbiology; Chemistry, Analytical; Electrochemistry; Nanoscience & Nanotechnology SC Biophysics; Biotechnology & Applied Microbiology; Chemistry; Electrochemistry; Science & Technology - Other Topics GA DY1KG UT WOS:000384853300063 PM 27424264 ER PT J AU Carlisle, JE Solan, D Kane, SL Joe, J AF Carlisle, Juliet E. Solan, David Kane, Stephanie L. Joe, Jeffrey TI Utility-scale solar and public attitudes toward siting: A. critical examination of proximity SO LAND USE POLICY LA English DT Article DE Public opinion; Utility scale solar; Facility siting; Proximity; Land types; Place attachment ID WIND POWER IMPLEMENTATION; ENVIRONMENTAL CONCERN; ENERGY DEVELOPMENT; RENEWABLE ENERGY; CLIMATE-CHANGE; NUCLEAR-POWER; ATTACHMENT; SUPPORT; FRAMEWORK; RESPONSES AB Public opinion polls show that the American public strongly supports the development of large-scale solar power facilities. Yet, often with renewable energy development, when specific developments are proposed, they are met with local opposition. In the past, many scholars relied upon explaining such opposition in terms of a NIMBY (Not In My Backyard). However, NIMBYism is criticized as an overly simple, incorrect, and pejorative characterization of opposition. Yet, while some criticize NIMBY explanations, other research demonstrates that distance indeed matters. Research also demonstrates that place attachment, socio-demographic characteristics, and project-related characteristics also matter. Our study integrates these different factors to better understand the nature of support for large-scale solar developments. Specifically, we consider visual impact of large-scale solar facilities and what effects distance between different types of land and the proposed solar facility might have on public support. Therefore, we examine proximity but not just proximity to one's residence but rather to different types of land. Our data are from a 2013 telephone survey (N = 695) from six Southern Californian counties (Inyo, Kern, Riverside, San Bernardino, San Luis Obispo, and Ventura), selected based on existing and proposed solar developments in those areas and available suitable land. Findings suggest that the visual impact of largescale solar facilities does matter for support and that preference for buffer sizes, and thus proximity of proposed large-scale solar facilities, do change depending on the type of land being considered. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Carlisle, Juliet E.] Univ Idaho, Dept Polit Sci & Philosophy, Moscow, ID 83843 USA. [Solan, David] Boise State Univ, Energy Policy Inst, Boise, ID 83725 USA. [Kane, Stephanie L.] Washington State Univ, Pullman, WA 99164 USA. [Joe, Jeffrey] Idaho Natl Lab, Idaho Falls, ID USA. RP Carlisle, JE (reprint author), Univ Idaho, Dept Polit Sci & Philosophy, Moscow, ID 83843 USA. EM carlisle@uidaho.edu NR 64 TC 0 Z9 0 U1 34 U2 34 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-8377 EI 1873-5754 J9 LAND USE POLICY JI Land Use Pol. PD DEC 15 PY 2016 VL 58 BP 491 EP 501 DI 10.1016/j.landusepol.2016.08.006 PG 11 WC Environmental Studies SC Environmental Sciences & Ecology GA DY1JJ UT WOS:000384851000043 ER PT J AU Wu, Y Li, HX Gao, JE Wang, H Liu, XJ Miller, MK Bei, H Gao, YF Lu, ZP AF Wu, Y. Li, H. X. Gao, J. E. Wang, H. Liu, X. J. Miller, M. K. Bei, H. Gao, Y. F. Lu, Z. P. TI Nanocrystallization in a Cu-doped Fe-based metallic glass SO JOURNAL OF ALLOYS AND COMPOUNDS LA English DT Article DE Amorphous materials; Clusters; Nanostructures; Magnetic measurements ID SOFT-MAGNETIC PROPERTIES; FORMING ABILITY; AMORPHOUS ALLOY; ATOMIC-SCALE; CRYSTALLIZATION; EVOLUTION; ELEMENTS; STAGE AB Evolution of microstructure and magnetic properties during annealing of a Cu-doped Fe75.3C7.0-Si3.3B5.0P8.7Cu0.7 metallic glass were investigated via atom probe tomography. Cu segregation, which contains a rapid nucleation stage and a sluggish growth stage, was found to precede and may trigger the segregation of other elements and promote the following nanocrystallization. The nano-sized alpha-Fe precipitates have a composition close to that of the grain-orientated high-silicon steel, giving rise to the enhancement in the magnetization. (C) 2016 Elsevier B.V. All rights reserved. C1 [Wu, Y.; Li, H. X.; Gao, J. E.; Wang, H.; Liu, X. J.; Lu, Z. P.] Univ Sci & Technol Beijing, State Key Lab Adv Met & Mat, Beijing 100083, Peoples R China. [Wu, Y.; Miller, M. K.; Bei, H.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Wu, Y.; Gao, Y. F.] Univ Tennessee Knoxville, Mat Sci & Engn Dept, Knoxville, TN 37996 USA. RP Lu, ZP (reprint author), Univ Sci & Technol Beijing, State Key Lab Adv Met & Mat, Beijing 100083, Peoples R China. EM luzp@ustb.edu.cn RI Gao, Yanfei/F-9034-2010; Lu, Zhao-Ping/A-2718-2009; Liu, Xiong-Jun/C-7119-2009; OI Gao, Yanfei/0000-0003-2082-857X; Bei, Hongbin/0000-0003-0283-7990 FU National Natural Science Foundation of China [51531001, 51422101, 51371003, 51271212]; 111 Project [B07003]; International S&T Cooperation Program of China [2015DFG52600]; Program for Changjiang Scholars and Innovative Research Team in University [IRT_14R05]; Fundamental Research Fund for the Central Universities [FRF-TP-15-004C1, FRF-TP-14-009C1]; Top-Notch Young Talents Program of China; Beijing Natural Science Foundation [2142022]; Program for Excellent Talents in Beijing Municipality; ORNL's Materials Science and Technology Division (MSTD); Center for Nanophase Materials Sciences (CNMS) - Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy FX This research was supported by National Natural Science Foundation of China (Nos. 51531001, 51422101, 51371003 and 51271212), 111 Project (B07003), International S&T Cooperation Program of China (2015DFG52600) and Program for Changjiang Scholars and Innovative Research Team in University (IRT_14R05), Fundamental Research Fund for the Central Universities (Nos. FRF-TP-15-004C1 and FRF-TP-14-009C1). Y. W. was supported by "The Top-Notch Young Talents Program of China", H. Li appreciates the financial support from Beijing Natural Science Foundation (No. 2142022) and Program for Excellent Talents in Beijing Municipality. Atom probe tomography was supported by ORNL's Materials Science and Technology Division (MSTD) and Center for Nanophase Materials Sciences (CNMS), which is sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy. NR 27 TC 0 Z9 0 U1 59 U2 59 PU ELSEVIER SCIENCE SA PI LAUSANNE PA PO BOX 564, 1001 LAUSANNE, SWITZERLAND SN 0925-8388 EI 1873-4669 J9 J ALLOY COMPD JI J. Alloy. Compd. PD DEC 15 PY 2016 VL 688 BP 822 EP 827 DI 10.1016/j.jallcom.2016.07.242 PN B PG 6 WC Chemistry, Physical; Materials Science, Multidisciplinary; Metallurgy & Metallurgical Engineering SC Chemistry; Materials Science; Metallurgy & Metallurgical Engineering GA DX5RI UT WOS:000384439000103 ER PT J AU Salazar, M Hoffmann, S Singer, V Becker, R Grunert, W AF Salazar, Mariam Hoffmann, Stefanie Singer, Vera Becker, Ralf Gruenert, Wolfgang TI Hybrid catalysts for the selective catalytic reduction (SCR) of NO by NH3 center dot On the role of fast SCR in the reaction network SO APPLIED CATALYSIS B-ENVIRONMENTAL LA English DT Article DE Standard SCR; Ammonia; Hybrid catalysts; Reaction network; Fast SCR ID NO/NO2 MIXTURES; NITROGEN-OXIDES; ACTIVE-SITES; FE-ZSM-5; ZEOLITES; AMMONIA; SPECTROSCOPY; PERFORMANCE; MECHANISM; NH3 AB The SCR of NO by NH3 was studied with hybrid catalysts, in which an oxidation component (Mn-Cu or Ce-Zr mixed oxides) and SCR catalysts of different activities in fast SCR (Fe-ZSM-5 of different Fe content and H-ZSM-5) are combined in physical mixtures. Fast SCR, which is SCR of NO2/NO mixtures, is believed to be the final step of the reaction mechanism causing the synergy and being initiated by NO2 formation over the oxidation component. In our studies, no correlation between fast-SCR activity of the SCR component and the performance of the hybrid was observed. In addition, a hybrid catalyst was found that provided rates of standard SCR significantly exceeding rates in fast SCR achieved by the SCR component alone in a wide temperature range. Therefore, fast SCR is not part of the reaction sequence causing the drastic synergetic effects between the components. (C) 2016 Elsevier B.V. All rights reserved. C1 [Salazar, Mariam; Hoffmann, Stefanie; Singer, Vera; Becker, Ralf; Gruenert, Wolfgang] Ruhr Univ Bochum, Lehrstuhl Tech Chem, POB 102148, D-44780 Bochum, Germany. [Salazar, Mariam] Oak Ridge Natl Lab, Knoxville, TN USA. [Hoffmann, Stefanie] Univ Duisburg Essen, Campus Essen, D-45141 Essen, Germany. [Becker, Ralf] Huntsman Pigments & Addit Germany GmbH, D-47198 Duisburg, Germany. RP Grunert, W (reprint author), Ruhr Univ Bochum, Lehrstuhl Tech Chem, POB 102148, D-44780 Bochum, Germany. EM w.gruenert@techem.ruhr-uni-bochum.de NR 16 TC 0 Z9 0 U1 99 U2 113 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0926-3373 EI 1873-3883 J9 APPL CATAL B-ENVIRON JI Appl. Catal. B-Environ. PD DEC 15 PY 2016 VL 199 BP 433 EP 438 DI 10.1016/j.apcatb.2016.06.043 PG 6 WC Chemistry, Physical; Engineering, Environmental; Engineering, Chemical SC Chemistry; Engineering GA DU6RY UT WOS:000382343500040 ER PT J AU Zou, M Johnson, F Zhang, WM Zhao, Q Rutkowski, SF Zhou, L Kramer, MJ AF Zou, Min Johnson, Francis Zhang, Wanming Zhao, Qi Rutkowski, Stephen F. Zhou, Lin Kramer, Matthew J. TI Processing of alnico permanent magnets by advanced directional solidification methods SO JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS LA English DT Article DE Alnico; Directional solidification; Permanent magnets; Transmission electron microscopy AB Advanced directional solidification methods have been used to produce large (> 15 cm length) castings of Alnico permanent magnets with highly oriented columnar microstructures. In combination with subsequent thermomagnetic and draw thermal treatment, this method was used to enable the high coercivity, high-Titanium Alnico composition of 39% Co, 29.5% Fe, 14% Ni, 7.5% Ti, 7% Al, 3% Cu (wt%) to have an intrinsic coercivity (H-ci,) of 2.0 kOe, a remanence (B-r) of 10.2 kG, and an energy product (BH)(max) of 10.9 MGOe. These properties compare favorably to typical properties for the commercial Alnico 9. Directional solidification of higher Ti compositions yielded anisotropic columnar grained microstructures if high heat extraction rates through the mold surface of at least 200 kW/m(2) were attained. This was achieved through the use of a thin walled (5 mm thick) high thermal conductivity SiC shell mold extracted from a molten Sn bath at a withdrawal rate of at least 200 mm/h. However, higher Ti compositions did not result in further increases in magnet performance. Images of the microstructures collected by scanning electron microscopy (SEM) reveal a majority a phase with inclusions of secondary ay phase. Transmission electron microscopy (TEM) reveals that the a phase has a spinodally decomposed microstructure of FeCo-rich needles in a NiAI-rich matrix. In the 7.5% Ti composition the diameter distribution of the FeCo needles was bimodal with the majority having diameters of approximately 50 nm with a small fraction having diameters of approximately 10 nm. The needles formed a mosaic pattern and were elongated along one (001) crystal direction (parallel to the field used during magnetic annealing). Cu precipitates were observed between the needles. Regions of abnormal spinodal morphology appeared to correlate with secondary phase precipitates. The presence of these abnormalities did not prevent the material from displaying superior magnetic properties in the 7.5% Ti composition. Higher Ti compositions did not display the preferred spinodal microstructure, explaining their inferior magnetic properties. (C) 2016 Elsevier B.V. All rights reserved. C1 [Zou, Min; Johnson, Francis; Zhang, Wanming; Zhao, Qi; Rutkowski, Stephen F.] Gen Elect Global Res, Ceram & Met Technol, Niskayuna, NY USA. [Zhou, Lin; Kramer, Matthew J.] Ames Lab, Ames, IA USA. [Zhou, Lin; Kramer, Matthew J.] Iowa State Univ, Ames, IA USA. RP Zou, M (reprint author), Gen Elect Global Res, Ceram & Met Technol, Niskayuna, NY USA. FU U.S. Department of Energy [DE-E0005573]; agency of the U.S. Gov't; U.S. Department of Energy by Iowa State University [DE-ACO2-07CH11358] FX This work was supported in part by the U.S. Department of Energy under Grant DE-E0005573. [1] This report was prepared as an account of work sponsored by an agency of the U.S. Gov't. Neither the U.S. Gov't nor any agency thereof, nor any of their employees, makes any warranty, express or implied, or assumes any legal liability or responsibility for the accuracy, completeness, or usefulness of any information, apparatus, product, or process disclosed, or represents that its use would not infringe privately owned rights. Reference herein to any specific commercial product, process, or service by trademark, manufacturer, or otherwise does not necessarily constitute or imply endorsement, recommendation or favoring by the U.S. Gov't of any agency thereof. The views and opinions of authors expressed herein do not necessarily state or reflect those of the U.S. Gov't or any agency thereof. Ames Laboratory is operated for the U.S. Department of Energy by Iowa State University under Contract no. DE-ACO2-07CH11358. NR 16 TC 0 Z9 0 U1 73 U2 74 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0304-8853 EI 1873-4766 J9 J MAGN MAGN MATER JI J. Magn. Magn. Mater. PD DEC 15 PY 2016 VL 420 BP 152 EP 157 DI 10.1016/j.jmmm.2016.06.091 PG 6 WC Materials Science, Multidisciplinary; Physics, Condensed Matter SC Materials Science; Physics GA DU4YK UT WOS:000382218700023 ER PT J AU Yen, HJ Tsai, H Zhou, M Holby, EF Choudhury, S Chen, AP Adamska, L Tretiak, S Sanchez, T Iyer, S Zhang, HG Zhu, LX Lin, HQ Dai, LM Wu, G Wang, HL AF Yen, Hung-Ju Tsai, Hsinhan Zhou, Ming Holby, Edward F. Choudhury, Samrat Chen, Aiping Adamska, Lyudmyla Tretiak, Sergei Sanchez, Timothy Iyer, Srinivas Zhang, Hanguang Zhu, Lingxiang Lin, Haiqing Dai, Liming Wu, Gang Wang, Hsing-Lin TI Structurally Defined 3D Nanographene Assemblies via Bottom-Up Chemical Synthesis for Highly Efficient Lithium Storage SO ADVANCED MATERIALS LA English DT Article ID PERFORMANCE ANODE MATERIAL; POROUS GRAPHENE NETWORKS; ION BATTERIES; REVERSIBLE CAPACITY; ENERGY-STORAGE; CARBON NANOSHEETS; LI STORAGE; ELECTRODES; OXIDE; PHOSPHORUS AB Functionalized 3D nanographenes with controlled electronic properties have been synthesized through a multistep organic synthesis method and are further used as promising anode materials for lithium-ion batteries, exhibiting a much increased capacity (up to 950 mAh g(-1)), three times higher than that of the graphite anode (372 mAh g(-1)). C1 [Yen, Hung-Ju; Tsai, Hsinhan; Zhou, Ming; Wang, Hsing-Lin] Los Alamos Natl Lab, Phys Chem & Appl Spect C PCS, Div Chem, Los Alamos, NM 87545 USA. [Holby, Edward F.] Los Alamos Natl Lab, Sigma Div, Los Alamos, NM 87545 USA. [Choudhury, Samrat] Univ Idaho, Chem & Mat Engn, Moscow, ID 83844 USA. [Chen, Aiping; Adamska, Lyudmyla; Tretiak, Sergei] Los Alamos Natl Lab, Ctr Integrated Nanotechnol CINT, Mat Phys & Applicat Div, Los Alamos, NM 87545 USA. [Sanchez, Timothy; Iyer, Srinivas] Los Alamos Natl Lab, Biosci Div, Los Alamos, NM 87545 USA. [Zhang, Hanguang; Zhu, Lingxiang; Lin, Haiqing; Wu, Gang] SUNY Buffalo, Dept Chem & Biol Engn, Buffalo, NY 14260 USA. [Dai, Liming] Case Western Reserve Univ, Dept Macromol Sci & Engn, Ctr Adv Sci & Engn Carbon Case Carbon 4, 10900 Euclid Ave, Cleveland, OH 44106 USA. RP Wang, HL (reprint author), Los Alamos Natl Lab, Phys Chem & Appl Spect C PCS, Div Chem, Los Alamos, NM 87545 USA.; Wu, G (reprint author), SUNY Buffalo, Dept Chem & Biol Engn, Buffalo, NY 14260 USA. EM gangwu@buffalo.edu; hwang@lanl.gov RI Wu, Gang/E-8536-2010; OI Wu, Gang/0000-0003-4956-5208; Sanchez, Timothy/0000-0001-8952-4414 FU Laboratory Directed Research and Development (LDRD) program at Los Alamos National Laboratory (LANL); J. R. Oppenheimer Fellowship; University at Buffalo; SUNY; National Science Foundation [CBET-1511528] FX The authors would like to acknowledge financial support by the Laboratory Directed Research and Development (LDRD) program (E.F.H., S.C., G.W. and H.-LW.) at Los Alamos National Laboratory (LANL). H.-J.Y. thanks the J. R. Oppenheimer Fellowship for supporting the synthesis of NGs and lithium-ion batteries fabrication. S.T. acknowledges the LANL Institutional Computing (IC) Program provided computational resources. G.W. is grateful the start-up fund from the University at Buffalo, SUNY along with National Science Foundation (CBET-1511528). NR 42 TC 0 Z9 0 U1 20 U2 20 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0935-9648 EI 1521-4095 J9 ADV MATER JI Adv. Mater. PD DEC 14 PY 2016 VL 28 IS 46 BP 10250 EP 10256 DI 10.1002/adma.201603613 PG 7 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EI8AL UT WOS:000392726400018 PM 27723130 ER PT J AU Michaelides, A Manolopoulos, DE Vega, C Hamm, P Chandler, DW Brigham, EC Lester, MI AF Michaelides, Angelos Manolopoulos, David E. Vega, Carlos Hamm, Peter Chandler, David W. Brigham, Erinn C. Lester, Marsha I. TI Editorial: The Future of Chemical Physics Conference 2016 SO JOURNAL OF CHEMICAL PHYSICS LA English DT Editorial Material C1 [Michaelides, Angelos] UCL, London Ctr Nanotechnol, Thomas Young Ctr, London WC1E 6BT, England. [Michaelides, Angelos] UCL, Dept Phys & Astron, London WC1E 6BT, England. [Manolopoulos, David E.] Univ Oxford, Dept Chem, Phys & Theoret Chem Lab, South Parks Rd, Oxford OX1 3QZ, England. [Vega, Carlos] Univ Complutense Madrid, Fac Ciencias Quim, Dept Quim Fis 1, E-28040 Madrid, Spain. [Hamm, Peter] Univ Zurich, Dept Chem, Zurich, Switzerland. [Chandler, David W.] Sandia Natl Labs, Combust Res Facil, Livermore, CA 94550 USA. [Brigham, Erinn C.] AIP Publishing, Melville, NY 11747 USA. [Lester, Marsha I.] Univ Penn, Dept Chem, Philadelphia, PA 19104 USA. RP Michaelides, A (reprint author), UCL, London Ctr Nanotechnol, Thomas Young Ctr, London WC1E 6BT, England.; Michaelides, A (reprint author), UCL, Dept Phys & Astron, London WC1E 6BT, England. OI Michaelides, Angelos/0000-0002-9169-169X; Hamm, Peter/0000-0003-1106-6032 FU AIP Publishing FX We gratefully acknowledge the funding for the conference from AIP Publishing. We thank St. Edmund Hall and the Physical and Theoretical Chemistry Laboratory of the University of Oxford for hosting the conference meals and sessions, and the local site staff for all their assistance. We also thank the speakers for preparing and delivering excellent presentations that opened the discussion of the future challenges in chemical physics, the poster presenters for their high quality presentations, and the participants for their active role in the discussion of the Future of Chemical Physics. NR 0 TC 0 Z9 0 U1 2 U2 2 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 14 PY 2016 VL 145 IS 22 AR 220401 DI 10.1063/1.4968588 PG 6 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EH2FJ UT WOS:000391582700001 PM 27984894 ER PT J AU Osti, NC Etampawala, TN Shrestha, UM Aryal, D Tyagi, M Diallo, SO Mamontov, E Cornelius, CJ Perahia, D AF Osti, N. C. Etampawala, T. N. Shrestha, U. M. Aryal, D. Tyagi, M. Diallo, S. O. Mamontov, E. Cornelius, C. J. Perahia, D. TI Water dynamics in rigid ionomer networks SO JOURNAL OF CHEMICAL PHYSICS LA English DT Article ID SULFONATED POLYSTYRENE IONOMERS; PROTON-EXCHANGE MEMBRANES; SINGLE-ION CONDUCTORS; NEUTRON-SCATTERING; NAFION MEMBRANE; ATOMISTIC SIMULATION; POLYMER MEMBRANES; DIFFUSIVE MOTIONS; FUEL-CELLS; TRANSPORT AB The dynamics of water within ionic polymer networks formed by sulfonated poly(phenylene) (SPP), as revealed by quasi-elastic neutron scattering (QENS), is presented. These polymers are distinguished from other ionic macromolecules by their rigidity and therefore in their network structure. QENS measurements as a function of temperature as the fraction of ionic groups and humidity were varied have shown that the polymer molecules are immobile while absorbed water molecules remain dynamic. The water molecules occupy multiple sites, either bound or loosely constrained, and bounce between the two. With increasing temperature and hydration levels, the system becomes more dynamic. Water molecules remain mobile even at subzero temperatures, illustrating the applicability of the SPP membrane for selective transport over a broad temperature range. Published by AIP Publishing. C1 [Osti, N. C.; Etampawala, T. N.; Shrestha, U. M.; Aryal, D.; Perahia, D.] Clemson Univ, Dept Chem, Clemson, SC 29634 USA. [Tyagi, M.] NIST, Ctr Neutron Res, Gaithersburg, MD 20899 USA. [Tyagi, M.] Univ Maryland, Dept Mat Sci & Engn, College Pk, MD 20742 USA. [Diallo, S. O.; Mamontov, E.] Oak Ridge Natl Lab, Chem & Engn Mat Div, Oak Ridge, TN 37831 USA. [Cornelius, C. J.] Univ Nebraska Lincoln, Chem & Biomol Engn Dept, Lincoln, NE 68588 USA. [Osti, N. C.] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA. RP Osti, NC (reprint author), Clemson Univ, Dept Chem, Clemson, SC 29634 USA. EM nosti@g.clemson.edu; dperahi@clemson.edu RI Mamontov, Eugene/Q-1003-2015; OI Mamontov, Eugene/0000-0002-5684-2675; Osti, Naresh/0000-0002-0213-2299 FU U.S. Department of Energy [DOE-DE-FG02-07ER46456, DE-FG02-12ER46843]; U.S. Department of Energy, Office of Basic Energy Sciences; Travel Fellowship from the DOE-EPSCoR Grant [DE-FG02-08ER46528]; National Science Foundation [DMR-0944772]; National Institute of Standards and Technology, U.S. Department of Commerce FX This work was supported by the U.S. Department of Energy under the Contract Nos. DOE-DE-FG02-07ER46456 and DE-FG02-12ER46843. The use of neutron scattering facility at Oak Ridge National Laboratory is supported by the U.S. Department of Energy, Office of Basic Energy Sciences. Travel to Oak Ridge National Laboratory to carry out this work was supported by a Travel Fellowship from the DOE-EPSCoR Grant to the University of Tennessee, DE-FG02-08ER46528. This work utilized facilities supported in part by the National Science Foundation under Agreement No. DMR-0944772. We acknowledge the support of the National Institute of Standards and Technology, U.S. Department of Commerce, in providing the neutron research facilities used in this work. Any mention of commercial products within NIST web pages is for information only; it does not imply recommendation or endorsement by NIST. NR 63 TC 0 Z9 0 U1 4 U2 4 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-9606 EI 1089-7690 J9 J CHEM PHYS JI J. Chem. Phys. PD DEC 14 PY 2016 VL 145 IS 22 AR 224901 DI 10.1063/1.4971209 PG 9 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EH2FJ UT WOS:000391582700039 PM 27984911 ER PT J AU Berry, AS Shah, VD Baker, SL Vogel, JW O'Neil, JP Janabi, M Schwimmer, HD Marks, SM Jagust, WJ AF Berry, Anne S. Shah, Vyoma D. Baker, Suzanne L. Vogel, Jacob W. O'Neil, James P. Janabi, Mustafa Schwimmer, Henry D. Marks, Shawn M. Jagust, William J. TI Aging Affects Dopaminergic Neural Mechanisms of Cognitive Flexibility SO JOURNAL OF NEUROSCIENCE LA English DT Article DE aging; cognitive flexibility; dopamine; fMRI; PET; task switching ID POSITRON-EMISSION-TOMOGRAPHY; EVENT-RELATED FMRI; PARKINSONS-DISEASE; WORKING-MEMORY; HUMAN-BRAIN; COMPENSATORY CHANGES; SYNTHESIS CAPACITY; PREFRONTAL CORTEX; NERVE-TERMINALS; HUMAN STRIATUM AB Aging is accompanied by profound changes in the brain's dopamine system that affect cognitive function. Evidence of powerful individual differences in cognitive aging has sharpened focus on identifying biological factors underlying relative preservation versus vulnerability to decline. Dopamine represents a key target in these efforts. Alterations of dopamine receptors and dopamine synthesis are seen in aging, with receptors generally showing reduction and synthesis demonstrating increases. Using the PET tracer 6-[F-18] fluoro-L-mtyrosine, we found strong support for upregulated striatal dopamine synthesis capacity in healthy older adult humans free of amyloid pathology, relative to young people. We next used fMRI to define the functional impact of elevated synthesis capacity on cognitive flexibility, a core component of executive function. We found clear evidence in young adults that low levels of synthesis capacity were suboptimal, associated with diminished cognitive flexibility and altered frontoparietal activation relative to young adults with highest synthesis values. Critically, these relationships between dopamine, performance, and activation were transformed in older adults with higher synthesis capacity. Variability in synthesis capacity was related to intrinsic frontoparietal functional connectivity across groups, suggesting that striatal dopamine synthesis influences the tuning of networks underlying cognitive flexibility. Together, these findings define striatal dopamine's association with cognitive flexibility and its neural underpinnings in young adults, and reveal the alteration in dopamine-related neural processes in aging. C1 [Berry, Anne S.; Shah, Vyoma D.; Baker, Suzanne L.; O'Neil, James P.; Janabi, Mustafa; Jagust, William J.] Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA. [Berry, Anne S.; Shah, Vyoma D.; Vogel, Jacob W.; Schwimmer, Henry D.; Marks, Shawn M.; Jagust, William J.] Univ Calif Berkeley, Helen Wills Neurosci Inst, Berkeley, CA 94720 USA. RP Berry, AS (reprint author), Univ Calif Berkeley, Helen Wills Neurosci Inst, Berkeley, CA 94720 USA. EM aberry@lbl.gov OI Schwimmer, Henry/0000-0002-6055-6401; Marks, Shawn/0000-0001-9884-8461; Vogel, Jacob/0000-0001-6394-9940 FU National Institutes of Health [AG044292, AG047686] FX This work was supported by National Institutes of Health Grants AG044292 and AG047686. We thank the reviewers for valuable comments that greatly benefited this manuscript. NR 75 TC 0 Z9 0 U1 10 U2 10 PU SOC NEUROSCIENCE PI WASHINGTON PA 11 DUPONT CIRCLE, NW, STE 500, WASHINGTON, DC 20036 USA SN 0270-6474 J9 J NEUROSCI JI J. Neurosci. PD DEC 14 PY 2016 VL 36 IS 50 BP 12559 EP 12569 DI 10.1523/JNEUROSCI.0626-16.2016 PG 11 WC Neurosciences SC Neurosciences & Neurology GA EG6GN UT WOS:000391142700005 PM 27807030 ER PT J AU Saha, D Barakat, S Van Bramer, SE Nelson, KA Hensley, DK Chen, JH AF Saha, Dipendu Barakat, Soukaina Van Bramer, Scott E. Nelson, Karl A. Hensley, Dale K. Chen, Jihua TI Noncompetitive and Competitive Adsorption of Heavy Metals in Sulfur-Functionalized Ordered Mesoporous Carbon SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE ordered mesoporous carbon; sulfur functionality; BET surface area; heavy metal; pH dependency; kinetics ID AQUEOUS MERCURY ADSORPTION; OXYGEN REDUCTION REACTION; ACTIVATED CARBON; CONTROLLED-RELEASE; EFFICIENT REMOVAL; DOPED GRAPHENE; CADMIUM; IONS; OXIDE; COMPOSITES AB In this work, sulfur-functionalized ordered mesoporous carbons were synthesized by activating the soft-templated mesoporous carbons with sulfur bearing salts that simultaneously enhanced the surface area and introduced sulfur functionalities onto the parent carbon surface. XPS analysis showed that sulfur content within the mesoporous carbons were between 8.2% and 12.9%. The sulfur functionalities include C-S, C=S, -COS, and SOx. SEM images confirmed the ordered mesoporosity within the material. The BET surface areas of the sulfur-functionalized ordered mesoporous carbons range from 837 to 2865 m(2)/g with total pore volume of 0.71-2.3 cm(3)/g. The carbon with highest sulfur functionality was examined for aqueous phase adsorption of mercury (as HgCl2), lead (as Pb(NO3)(2)), cadmium (as CdCl2), and nickel (as NiCl2) ions in both noncompetitive and competitive mode. Under noncompetitive mode and at a pH greater than 7.0 the affinity of sulfur-functionalized carbons toward heavy metals were in the order of Hg > Pb > Cd > Ni. At lower pH, the adsorbent switched its affinity between Pb and Cd. In the noncompetitive mode, Hg and Pb adsorption showed a strong pH dependency whereas Cd and Ni adsorption did not demonstrate a significant influence of pH. The distribution coefficient for noncompetitive adsorption was in the range of 2448-4000 mL/g for Hg, 290-1990 mL/g for Pb, 550-560 mL/g for Cd, and 115-147 for Ni. The kinetics of adsorption suggested a pseudo-second-order model fits better than other models for all the metals. XPS analysis of metal-adsorption carbons suggested that 7-8% of the adsorbed Hg was converted to HgSO4, 14% and 2% of Pb was converted to PbSO4 and PbS/PbO, respectively, and 5% Cd was converted to CdSO4. Ni was below the detection limit for XPS. Overall results suggested these carbon materials might be useful for the separation of heavy metals. C1 [Saha, Dipendu; Barakat, Soukaina; Nelson, Karl A.] Widener Univ, Dept Chem Engn, One Univ Pl, Chester, PA 19013 USA. [Van Bramer, Scott E.] Widener Univ, Dept Chem, One Univ Pl, Chester, PA 19013 USA. [Hensley, Dale K.; Chen, Jihua] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. RP Saha, D (reprint author), Widener Univ, Dept Chem Engn, One Univ Pl, Chester, PA 19013 USA. EM dsaha@mail.widener.edu FU Widener University; Ivanhoe Foundation for Masters thesis FX D.S. acknowledges Faculty development award from Widener University. S.B. acknowledges the financial support from Ivanhoe Foundation for Masters thesis (Faculty advisor, D.S.). TEM (J.C.) and SEM (D.K.H.) experiments were conducted at the Center for Nanophase Materials Sciences of ORNL, which is a DOE Office of Science User Facility. NR 56 TC 0 Z9 0 U1 48 U2 48 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 14 PY 2016 VL 8 IS 49 BP 34132 EP 34142 DI 10.1021/acsami.6b12190 PG 11 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EE9RG UT WOS:000389963300089 PM 27960359 ER PT J AU Boreen, MA Parker, BF Lohrey, TD Arnold, J AF Boreen, Michael A. Parker, Bernard F. Lohrey, Trevor D. Arnold, John TI A Homoleptic Uranium(III) Tris(aryl) Complex SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID BULKY TERPHENYL LIGANDS; MOLECULAR-STRUCTURE; CHEMISTRY; INSERTION; ALKYLS; ACTIVATION; REACTIVITY; MAGNESIUM; THORIUM; LITHIUM AB The reaction of 3 equiv of Li-C6H3-2,6-(C6H4-4-Bu-t)(2) (Terph-Li) with UI3(1,4-dioxane)(1.5) led to the formation of the homoleptic uranium(III) tris(aryl) complex (Terph)(3)U (1). The U-C bonds are reactive: treatment with excess (PrN)-Pr-i=C=(NPr)-Pr-i yielded the double-insertion product [TerphC((NPr)-Pr-i)(2)](2)U(Terph) (2). Complexes 1 and 2 were characterized by X- ray crystallography, which showed that the U-C bond length in 2 (2.624(4) angstrom) is similar to 0.1 angstrom longer than the average U-C bond length in 1 (2.522(2) angstrom). Thermal decomposition of 1 yielded Terph-H as the only identifiable product; the process is unimolecular with activation parameters Delta H double dagger = 21.5 +/- 0.3 kcal/mol and Delta S double dagger = -7.5 +/- 0.8 cal.mol(-1) K-1, consistent with intramolecular proton abstraction. The protonolysis chemistry of 1 was also explored, which led to the uranium(IV) alkoxide complex U(OCPh3)(4)(DME) (3 center dot DME). C1 [Arnold, John] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. Lawrence Berkeley Lab, Div Chem Sci, Berkeley, CA 94720 USA. RP Arnold, J (reprint author), Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. EM arnold@berkeley.edu FU Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences Heavy Element Chemistry Program of the U.S. Department of Energy (DOE) at LBNL [DE-AC02-05CH11231]; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231]; UC Berkeley FX This work was supported by the Director, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences Heavy Element Chemistry Program of the U.S. Department of Energy (DOE) at LBNL under Contract DE-AC02-05CH11231. The Advanced Light Source is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract DE-AC02-05CH11231. The authors acknowledge Dr. Simon Teat of ALS station 11.3.1 for his assistance with crystallographic data collection for 3.DME. M.A.B. thanks UC Berkeley for a graduate research fellowship. NR 33 TC 0 Z9 0 U1 7 U2 7 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 14 PY 2016 VL 138 IS 49 BP 15865 EP 15868 DI 10.1021/jacs.6b11182 PG 4 WC Chemistry, Multidisciplinary SC Chemistry GA EE9RB UT WOS:000389962800018 PM 27960342 ER PT J AU Zhan, WC He, Q Liu, XF Guo, YL Wang, YQ Wang, L Guo, Y Borisevich, AY Zhang, JS Lu, GZ Dai, S AF Zhan, Wangcheng He, Qian Liu, Xiaofei Guo, Yanglong Wang, Yanqin Wang, Li Guo, Yun Borisevich, Albina Y. Zhang, Jinshui Lu, Guanzhong Dai, Sheng TI A Sacrificial Coating Strategy Toward Enhancement of Metal-Support Interaction for Ultrastable Au Nanocatalysts SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID ATOMIC LAYER DEPOSITION; CATALYTICALLY ACTIVE GOLD; TEMPERATURE CO OXIDATION; SOLVENT-FREE OXIDATION; THERMAL-STABILITY; AU/TIO2 CATALYSTS; NANOPARTICLES; TIO2; SIZE; NANOCLUSTERS AB Supported gold (Au) nanocatalysts hold great promise for heterogeneous catalysis; however, their practical application is greatly hampered by poor thermodynamic stability. Herein, a general synthetic strategy is reported where discrete metal nanoparticles are made resistant to sintering) preserving their catalytic activities in high-temperature oxidation processes. Taking advantage of the unique coating chemistry of dopamine, sacrificial carbon layers are constructed on the material surface, stabilizing the supported catalyst. Upon annealing at high temperature under an inert atmosphere, the interactions between support and metal nanoparticle are dramatically enhanced, while the sacrificial carbon layers can be subsequently removed through oxidative calcination in air. Owing to the improved metal support contact and strengthened electronic interactions, the resulting Au nanocatalysts are resistant to sintering and exhibit excellent durability for catalytic combustion of propylene at elevated temperatures. Moreover, the facile synthetic strategy can be extended to the stabilization of other supported catalysts on a broad range of supports, providing a general approach to enhancing the thermal stability and sintering resistance of supported nano catalysts. C1 [Zhan, Wangcheng; Liu, Xiaofei; Guo, Yanglong; Wang, Yanqin; Wang, Li; Guo, Yun; Lu, Guanzhong] East China Univ Sci & Technol, Key Lab Adv Mat, 130 Meilong Rd, Shanghai 200237, Peoples R China. [Zhan, Wangcheng; Liu, Xiaofei; Guo, Yanglong; Wang, Yanqin; Wang, Li; Guo, Yun; Lu, Guanzhong] East China Univ Sci & Technol, Res Inst Ind Catalysis, 130 Meilong Rd, Shanghai 200237, Peoples R China. [Zhan, Wangcheng; Liu, Xiaofei; Wang, Li; Zhang, Jinshui; Dai, Sheng] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. [He, Qian; Borisevich, Albina Y.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Dai, Sheng] Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. [He, Qian] Cardiff Univ, Cardiff Catalysis Inst, Cardiff CF10 3AT, S Glam, Wales. [He, Qian] Cardiff Univ, Sch Chem, Cardiff CF10 3AT, S Glam, Wales. RP Zhang, JS; Dai, S (reprint author), Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA.; Dai, S (reprint author), Univ Tennessee, Dept Chem, Knoxville, TN 37996 USA. EM jinshui.zhang@hotmail.com; dais@ornl.gov RI zhang, Jinshui/D-9749-2016; He, Qian/J-1277-2014; OI zhang, Jinshui/0000-0003-4649-6526; Zhan, Wangcheng/0000-0001-9094-3915 FU National Key Basic Research Program of China [2013CB933200]; National Key Research and Development Program of China [2016YFC0204300]; 111 project [B08021]; National Natural Science Foundation of China [21571061]; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division; U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division; Oak Ridge National Laboratory (ORNL) Center for Nanophase Materials Sciences - Scientific User Facilities Division, Office of Science, Basic Energy Sciences, U.S. Department of Energy FX W.C.Z., Y.L.G., and G.Z.L. appreciate the financial support from the National Key Basic Research Program of China (2013CB933200), the National Key Research and Development Program of China (2016YFC0204300), and 111 project (B08021). Y.G. appreciates the National Natural Science Foundation of China (21571061); J.Z. and S.D. were supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division. Q.H. and A.Y.B were supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division, and through a user project supported by the Oak Ridge National Laboratory (ORNL) Center for Nanophase Materials Sciences, sponsored by the Scientific User Facilities Division, Office of Science, Basic Energy Sciences, U.S. Department of Energy. J.Z. and S.D. thank Dr. C. Abney (ORNL) for his helpful suggestions. NR 56 TC 1 Z9 1 U1 95 U2 95 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 14 PY 2016 VL 138 IS 49 BP 16130 EP 16139 DI 10.1021/jacs.6b10472 PG 10 WC Chemistry, Multidisciplinary SC Chemistry GA EE9RB UT WOS:000389962800052 PM 27960312 ER PT J AU Li, HX Kim, NT Su, TA Steigerwald, ML Nuckolls, C Darancet, P Leighton, JL Venkataraman, L AF Li, Haixing Kim, Nathaniel T. Su, Timothy A. Steigerwald, Michael L. Nuckolls, Colin Darancet, Pierre Leighton, James L. Venkataraman, Latha TI Mechanism for Si-Si Bond Rupture in Single Molecule Junctions SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID HETEROJUNCTION SOLAR-CELL; ELECTRIC-FIELD; WATER CLUSTERS; AB-INITIO; SILICON; CONDUCTANCE; NANOWIRE; TEMPERATURE; TRANSISTORS; DISILANES AB The stability of chemical bonds can be studied experimentally by rupturing single molecule junctions under applied voltage. Here, we compare voltage-induced bond rupture in two Si-Si backbones: one has no alternate conductive pathway whereas the other contains an additional naphthyl pathway in parallel to the Si-Si bond. We show that in contrast to the first system, the second can conduct through the naphthyl group when the Si-Si bond is ruptured using an applied voltage. We investigate this voltage induced Si-Si bond rupture by ab initio density functional theory calculations and molecular dynamics simulations that ultimately demonstrate that the excitation of molecular vibrational modes by tunneling electrons leads to homolytic Si-Si bond rupture. C1 [Li, Haixing; Venkataraman, Latha] Columbia Univ, Dept Appl Phys & Appl Math, New York, NY 10027 USA. [Kim, Nathaniel T.; Su, Timothy A.; Steigerwald, Michael L.; Nuckolls, Colin; Leighton, James L.; Venkataraman, Latha] Columbia Univ, Dept Chem, New York, NY 10027 USA. [Darancet, Pierre] Argonne Natl Lab, Ctr Nanoscale Mat, 9700 S Cass Ave, Argonne, IL 60439 USA. [Su, Timothy A.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. RP Venkataraman, L (reprint author), Columbia Univ, Dept Appl Phys & Appl Math, New York, NY 10027 USA.; Steigerwald, ML; Nuckolls, C; Leighton, JL; Venkataraman, L (reprint author), Columbia Univ, Dept Chem, New York, NY 10027 USA.; Darancet, P (reprint author), Argonne Natl Lab, Ctr Nanoscale Mat, 9700 S Cass Ave, Argonne, IL 60439 USA. EM mls2064@columbia.edu; cn37@columbia.edu; pdarancet@anl.gov; leighton@chem.columbia.edu; lv2117@columbia.edu OI Su, Timothy/0000-0001-5934-3292 FU National Science Foundation [CHE-1404922]; Semiconductor Research Corporation; New York Center for Advanced Interconnect Science and Technology Program; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-AC02-06CH11357] FX We thank the National Science Foundation for the primary support of this work under Grant CHE-1404922. H.L. is supported in part by the Semiconductor Research Corporation and New York Center for Advanced Interconnect Science and Technology Program. Use of the Center for Nanoscale Materials, an Office of Science user facility, was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract No. DE-AC02-06CH11357. P.D. thanks Badri Narayanan for helpful discussions. NR 36 TC 0 Z9 0 U1 14 U2 14 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 14 PY 2016 VL 138 IS 49 BP 16159 EP 16164 DI 10.1021/jacs.6b10700 PG 6 WC Chemistry, Multidisciplinary SC Chemistry GA EE9RB UT WOS:000389962800055 PM 27960303 ER PT J AU Tsitoura, F Anastassi, ZA Marzuola, JL Kevrekidis, PG Frantzeskakis, DJ AF Tsitoura, F. Anastassi, Z. A. Marzuola, J. L. Kevrekidis, P. G. Frantzeskakis, D. J. TI Dark solitons near potential and nonlinearity steps SO PHYSICAL REVIEW A LA English DT Article ID BOSE-EINSTEIN CONDENSATE; LIGHT-BEAM PROPAGATION; MATTER-WAVE SOLITONS; FESHBACH RESONANCES; SCHRODINGER-EQUATION; SCATTERING; INTERFACES; REFLECTION; COLLISIONS; DYNAMICS AB We study dark solitons near potential and nonlinearity steps and combinations thereof, forming rectangular barriers. This setting is relevant to the contexts of atomic Bose-Einstein condensates (where such steps can be realized by using proper external fields) and nonlinear optics (for beam propagation near interfaces separating optical media of different refractive indices). We use perturbation theory to develop an equivalent particle theory, describing the matter-wave or optical soliton dynamics as the motion of a particle in an effective potential. This Newtonian dynamical problem provides information for the soliton statics and dynamics, including scenarios of reflection, transmission, or quasitrapping at such steps. The case of multiple such steps and its connection to barrier potentials is additionally touched upon. The range of validity of the analytical approximation and radiation effects are also investigated. Our analytical predictions are found to be in very good agreement with the corresponding numerical results, where appropriate. C1 [Tsitoura, F.; Frantzeskakis, D. J.] Univ Athens, Dept Phys, Athens 15784, Greece. [Anastassi, Z. A.] Qatar Univ, Coll Arts & Sci, Dept Math Stat & Phys, Doha 2713, Qatar. [Marzuola, J. L.] Univ N Carolina, Dept Math, Chapel Hill, NC 27599 USA. [Kevrekidis, P. G.] Univ Massachusetts, Dept Math & Stat, Amherst, MA 01003 USA. [Kevrekidis, P. G.] Los Alamos Natl Lab, Ctr Nonlinear Studies & Theoret Div, Los Alamos, NM 87544 USA. RP Tsitoura, F (reprint author), Univ Athens, Dept Phys, Athens 15784, Greece. FU Special Account for Research Grants of the University of Athens; Qatar University [QUUG-CAS-DMSP-13/14-7]; US Department of Energy; US-AFOSR [FA9550-12-1- 0332]; ERC [IRSES-605096]; U.S. NSF [DMS-1312874, DMS-1352353]; [NSF-DMS-1312856]; [BSF-2010239] FX The work of F.T. and D.J.F. was partially supported by the Special Account for Research Grants of the University of Athens. The work of F.T. and Z.A.A. was partially supported by Qatar University under the scope of the Internal Grant QUUG-CAS-DMSP-13/14-7. F.T. acknowledges hospitality at Qatar University, where most of this work was carried out. The work of P.G.K. at Los Alamos is partially supported by the US Department of Energy. P.G.K. also gratefully acknowledges the support of NSF-DMS-1312856, BSF-2010239, as well as from the US-AFOSR under grant FA9550-12-1- 0332, and the ERC under FP7, Marie Curie Actions, People, International Research Staff Exchange Scheme (IRSES-605096). The work of J.L.M. was supported in part by U.S. NSF Grants DMS-1312874 and DMS-1352353. NR 85 TC 0 Z9 0 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9926 EI 2469-9934 J9 PHYS REV A JI Phys. Rev. A PD DEC 14 PY 2016 VL 94 IS 6 AR 063612 DI 10.1103/PhysRevA.94.063612 PG 16 WC Optics; Physics, Atomic, Molecular & Chemical SC Optics; Physics GA EF3SS UT WOS:000390245300005 ER PT J AU Yip, FL Rescigno, TN McCurdy, CW AF Yip, F. L. Rescigno, T. N. McCurdy, C. W. TI Fully differential single-photon double photoionization of atomic magnesium SO PHYSICAL REVIEW A LA English DT Article ID IONIZATION; CONTINUUM AB The valence-shell double ionization of atomic magnesium is calculated using a grid-based representation of the 3s(2) electron configuration in the presence of a fully occupied frozen-core configuration of the remaining ten electrons. Atomic orbitals are constructed from an underlying finite-element discrete variable representation that facilitates accurate representation of the interaction between the inner-shell electrons with those entering the continuum. Length and velocity gauge results are compared with recent theoretical calculations and experimental measurements for the total double-, single-, and triple-differential cross sections, particularly at the photon energy of 55.49 eV for the last one. Comparison between the similar processes of double ionization of the ns(2) atoms helium, beryllium, and magnesium further illuminates the role of valence-shell electron correlation in atomic targets with heliumlike electronic configurations and symmetry. C1 [Yip, F. L.] Calif State Univ, Maritime Acad, Dept Sci & Math, Vallejo, CA 94590 USA. [Rescigno, T. N.; McCurdy, C. W.] Lawrence Berkeley Natl Lab, Chem Sci Div, Berkeley, CA 94720 USA. [McCurdy, C. W.] Univ Calif Davis, Dept Chem, Davis, CA 95616 USA. RP Yip, FL (reprint author), Calif State Univ, Maritime Acad, Dept Sci & Math, Vallejo, CA 94590 USA. FU National Science Foundation [PHY-1509971]; US Department of Energy, Office of Basic Energy Sciences, Division of Chemical Sciences [DE-AC02-05CH1123]; US Department of Energy [DE-SC0007182]; National Energy Research Scientific Computing Center, a DOE Office of Science User Facility [DE-AC02-05CH11231] FX Work performed at California State University, Maritime, was supported by the National Science Foundation, Grant No. PHY-1509971. Work performed at Lawrence Berkeley National Laboratory was supported by the US Department of Energy, Office of Basic Energy Sciences, Division of Chemical Sciences, Contract No. DE-AC02-05CH1123. Work at the University of California, Davis, was supported by the US Department of Energy Grant No. DE-SC0007182. We made use of the resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported under Contract No. DE-AC02-05CH11231. NR 26 TC 0 Z9 0 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9926 EI 2469-9934 J9 PHYS REV A JI Phys. Rev. A PD DEC 14 PY 2016 VL 94 IS 6 AR 063414 DI 10.1103/PhysRevA.94.063414 PG 8 WC Optics; Physics, Atomic, Molecular & Chemical SC Optics; Physics GA EF3SS UT WOS:000390245300003 ER PT J AU Ma, H Li, C Tang, SX Yan, JQ Alatas, A Lindsay, L Sales, BC Tian, ZT AF Ma, Hao Li, Chen Tang, Shixiong Yan, Jiaqiang Alatas, Ahmet Lindsay, Lucas Sales, Brian C. Tian, Zhiting TI Boron arsenide phonon dispersion from inelastic x-ray scattering: Potential for ultrahigh thermal conductivity SO PHYSICAL REVIEW B LA English DT Article AB Cubic boron arsenide (BAs) was predicted to have an exceptionally high thermal conductivity (k) similar to 2000Wm(-1)K(-1) at room temperature, comparable to that of diamond, based on first-principles calculations. Subsequent experimental measurements, however, only obtained a k of similar to 200Wm(-1)K(-1). To gain insight into this discrepancy, we measured phonon dispersion of single-crystal BAs along high symmetry directions using inelastic x-ray scattering and compared these with first-principles calculations. Based on the measured phonon dispersion, we have validated the theoretical prediction of a large frequency gap between acoustic and optical modes and bunching of acoustic branches, which were considered the main reasons for the predicted ultrahigh k. This supports its potential to be a super thermal conductor if very-high-quality single-crystal samples can be synthesized. C1 [Ma, Hao; Li, Chen; Tang, Shixiong; Tian, Zhiting] Virginia Tech, Dept Mech Engn, Blacksburg, VA 24061 USA. [Yan, Jiaqiang; Lindsay, Lucas; Sales, Brian C.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Yan, Jiaqiang] Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USA. [Alatas, Ahmet] Argonne Natl Lab, Adv Photon Source, Argonne, IL 64039 USA. RP Tian, ZT (reprint author), Virginia Tech, Dept Mech Engn, Blacksburg, VA 24061 USA. EM zhiting@vt.edu RI Lindsay, Lucas/C-9221-2012 OI Lindsay, Lucas/0000-0001-9645-7993 FU Virginia Polytechnic Institute and State University; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division; DOE Office of Science by Argonne National Laboratory [DE-AC02-06CH11357] FX This work was funded by the startup fund from Virginia Polytechnic Institute and State University. We thank Dr. Carla Slebodnick at Virginia Tech for her help with single-crystal x-ray diffraction measurements. We are grateful for useful discussions with Dr. David Broido at Boston College. L.L., J.-Q.Y., and B.C.S. acknowledge support from the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. NR 24 TC 0 Z9 0 U1 10 U2 10 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 14 PY 2016 VL 94 IS 22 AR 220303 DI 10.1103/PhysRevB.94.220303 PG 4 WC Physics, Condensed Matter SC Physics GA EF3UQ UT WOS:000390250500001 ER PT J AU Poyhonen, K Weststrom, A Pershoguba, SS Ojanen, T Balatsky, AV AF Poyhonen, Kim Weststrom, Alex Pershoguba, Sergey S. Ojanen, Teemu Balatsky, Alexander V. TI Skyrmion-induced bound states in a p-wave superconductor SO PHYSICAL REVIEW B LA English DT Article ID LATTICE AB In s-wave systems, it has been theoretically shown that a ferromagnetic film hosting a skyrmion can induce a bound state embedded in the opposite-spin continuum. In this work, we consider a case of skyrmion-induced state in a p-wave superconductor. We find that the skyrmion induces a bound state that generally resides within the spectral gap and is isolated from all other states, in contrast to the case of conventional superconductors. To this end, we derive an approximate expression for the T matrix, through which we calculate the spin-polarized local density of states which is observable in scanning tunneling microscopy measurements. We find the unique spectroscopic features of the skyrmion-induced bound state and discuss how our predictions could be employed as experimental probes for p-wave superconducting states. C1 [Poyhonen, Kim; Weststrom, Alex; Ojanen, Teemu] Aalto Univ, Dept Appl Phys LTL, POB 15100, FI-00076 Aalto, Finland. [Pershoguba, Sergey S.; Balatsky, Alexander V.] Los Alamos Natl Lab, Inst Mat Sci, Los Alamos, NM 87545 USA. [Pershoguba, Sergey S.; Balatsky, Alexander V.] KTH Royal Inst Technol, Ctr Quantum Mat, NORDITA, Roslagstullsbacken 23, S-10691 Stockholm, Sweden. [Pershoguba, Sergey S.; Balatsky, Alexander V.] Stockholm Univ, Roslagstullsbacken 23, S-10691 Stockholm, Sweden. RP Poyhonen, K (reprint author), Aalto Univ, Dept Appl Phys LTL, POB 15100, FI-00076 Aalto, Finland. OI Pershoguba, Sergey/0000-0001-5003-3415 FU Academy of Finland; Aalto Centre for Quantum Engineering; ITS at ETH Zurich; US DOE BES E3B7; ERC [DM-321031] FX This work was supported by the Academy of Finland and the Aalto Centre for Quantum Engineering (K.P., A.W., and T.O.), ITS at ETH Zurich and by US DOE BES E3B7, ERC DM-321031 (S.S.P. and A.V.B.). NR 24 TC 0 Z9 0 U1 7 U2 7 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 14 PY 2016 VL 94 IS 21 AR 214509 DI 10.1103/PhysRevB.94.214509 PG 7 WC Physics, Condensed Matter SC Physics GA EF3TV UT WOS:000390248300005 ER PT J AU Wang, Y Lany, S Ghanbaja, J Fagot-Revurat, Y Chen, YP Soldera, F Horwat, D Mucklich, F Pierson, JF AF Wang, Y. Lany, S. Ghanbaja, J. Fagot-Revurat, Y. Chen, Y. P. Soldera, F. Horwat, D. Muecklich, F. Pierson, J. F. TI Electronic structures of Cu2O, Cu4O3, and CuO: A joint experimental and theoretical study SO PHYSICAL REVIEW B LA English DT Article ID P-TYPE CUO; CUPRIC OXIDE; PARAMELACONITE; SPECTRA; ABSORPTION; PHOTOEMISSION; STABILITY AB A joint experimental and theoretical study is presented for the electronic structures of copper oxides including Cu2O, CuO, and the metastable mixed-valence oxide Cu4O3. The optical band gap is determined by experimental optical absorption coefficient, and the electronic structure in valence and conduction bands is probed by photoemission and electron energy loss spectroscopies, respectively. The experimental results are compared with many-body GW calculations utilizing an additional on-site potential for d-orbital energies that facilitates tractable and predictive computations. The side-by-side comparison between the three oxides, including a band insulator (Cu2O) and two Mott/charge-transfer insulators (CuO, Cu4O3) leads to a consistent picture for the optical and band-structure properties of the Cu oxides, strongly supporting indirect band gaps of about 1.2 and 0.8 eV in CuO and Cu4O3, respectively. This comparison also points towards surface oxidation and reduction effects that can complicate the interpretation of the photoemission spectra. C1 [Wang, Y.; Ghanbaja, J.; Fagot-Revurat, Y.; Horwat, D.; Pierson, J. F.] Univ Lorraine, Inst Jean Lamour, UMR CNRS 7198, F-54011 Nancy, France. [Lany, S.] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Chen, Y. P.] Xiangtan Univ, Dept Phys, Xiangtan 411105, Peoples R China. [Soldera, F.; Muecklich, F.] Univ Saarland, Funct Mat, Dept Mat Sci, D-66123 Saarbrucken, Germany. RP Pierson, JF (reprint author), Univ Lorraine, Inst Jean Lamour, UMR CNRS 7198, F-54011 Nancy, France. EM jean-francois.pierson@univ-lorraine.fr FU European Commission; US Department of Energy, Office of Science, Office of Basic Energy Sciences, Energy Frontier Research Center [DE-AC36-08GO28308] FX Y.W. would like to acknowledge the European Commission for the Erasmus Mundus Ph.D. fellowship with the DocMASE project. Y.W. would like to thank Dr. Simon Karl Moser (Ecole Polytechnique Federale de Lausanne), Dr. Junfeng Han (Beijing University of Science and Technology), and Alexis Molter (Universite de Lorraine) for fruitful discussion. F.S. and F.M. would like to thank the Europaische Fonds fur Regionale Entwicklung (EFRE) Funds of the European Commission for support of activities within the AME-Lab project. S.L. was supported by the US Department of Energy, Office of Science, Office of Basic Energy Sciences, as part of an Energy Frontier Research Center under Contract No. DE-AC36-08GO28308 to National Renewable Energy Laboratory (NREL). NR 61 TC 2 Z9 2 U1 27 U2 27 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 14 PY 2016 VL 94 IS 24 AR 245418 DI 10.1103/PhysRevB.94.245418 PG 10 WC Physics, Condensed Matter SC Physics GA EF3XJ UT WOS:000390258000006 ER PT J AU Wu, FC MacDonald, AH AF Wu, Fengcheng MacDonald, A. H. TI Moire assisted fractional quantum Hall state spectroscopy SO PHYSICAL REVIEW B LA English DT Article ID COLLECTIVE EXCITATIONS; GRAPHENE SUPERLATTICES; LANDAU-LEVEL; FERMIONS AB Intra-Landau level excitations in the fractional quantum Hall regime are not accessible via optical absorption measurements. We point out that optical probes are enabled by the periodic potentials produced by a moire pattern. Our observation is motivated by the recent observations of fractional quantum Hall incompressible states in moire-patterned graphene on a hexagonal boron nitride substrate, and is theoretically based on f-sum rule considerations supplemented by a perturbative analysis of the influence of the moire potential on many-body states. C1 [Wu, Fengcheng; MacDonald, A. H.] Univ Texas Austin, Dept Phys, Austin, TX 78712 USA. [Wu, Fengcheng] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Wu, FC (reprint author), Univ Texas Austin, Dept Phys, Austin, TX 78712 USA.; Wu, FC (reprint author), Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. FU Department of Energy, Office of Basic Energy Sciences [DE-FG02-ER45118]; Welch Foundation [TBF1473]; Department of Energy, Office of Science, Materials Sciences and Engineering Division FX Work at Austin was supported by the Department of Energy, Office of Basic Energy Sciences under Contract No. DE-FG02-ER45118 and by the Welch Foundation under Grant No. TBF1473. The work of F.W. at Argonne National Laboratory was supported by the Department of Energy, Office of Science, Materials Sciences and Engineering Division. NR 32 TC 0 Z9 0 U1 12 U2 12 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 14 PY 2016 VL 94 IS 24 AR 241108 DI 10.1103/PhysRevB.94.241108 PG 5 WC Physics, Condensed Matter SC Physics GA EF3XJ UT WOS:000390258000001 ER PT J AU Ye, GZ Cheng, JG Yan, JQ Sun, JP Matsubayashi, K Yamauchi, T Okada, T Zhou, Q Parker, DS Sales, BC Uwatoko, Y AF Ye, G. Z. Cheng, J-G Yan, J-Q Sun, J. P. Matsubayashi, K. Yamauchi, T. Okada, T. Zhou, Q. Parker, D. S. Sales, B. C. Uwatoko, Y. TI Competition of superconductivity with the structural transition in Mo3Sb7 SO PHYSICAL REVIEW B LA English DT Article ID ANDREEV REFLECTION; LOW-TEMPERATURE; GAP AB Prior to the superconducting transition at T-c approximate to 2.3 K, Mo3Sb7 undergoes a symmetry-lowering, cubic-totetragonal structural transition at T-s = 53 K. We have monitored the pressure dependence of these two transitions by measuring the resistivity of Mo3Sb7 single crystals under various hydrostatic pressures up to 15 GPa. The application of external pressure enhances T-c but suppresses T-s until P-c approximate to 10 GPa, above which a pressureinduced first-order structural transition takes place and is manifested by the phase coexistence in the pressure range 8 <= P <= 12 GPa. The cubic phase above 12 GPa is also found to be superconducting with a higher T-c approximate to 6 K that decreases slightly with further increasing pressure. The variations with pressure of T-c and T-s satisfy the Bilbro-McMillan equation, i. e. (TcTs1-n)-T-n = constant, thus suggesting the competition of superconductivity with the structural transition that has been proposed to be accompanied with a spin-gap formation at T-s. Our first-principles calculations suggest the importance of magnetism that competes with the superconductivity in Mo3Sb7. C1 [Ye, G. Z.; Cheng, J-G; Sun, J. P.] Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Beijing 100190, Peoples R China. [Ye, G. Z.; Cheng, J-G; Sun, J. P.] Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China. [Ye, G. Z.; Zhou, Q.] Yunnan Univ, Sch Phys Sci & Astron, Kunming 650091, Peoples R China. [Cheng, J-G; Matsubayashi, K.; Yamauchi, T.; Okada, T.; Uwatoko, Y.] Univ Tokyo, Inst Solid State Phys, Kashiwa, Chiba 2778581, Japan. [Yan, J-Q; Parker, D. S.; Sales, B. C.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Matsubayashi, K.] Univ Electrocommun, Dept Engn Sci, Chofu, Tokyo 1828585, Japan. RP Cheng, JG (reprint author), Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Beijing 100190, Peoples R China.; Cheng, JG (reprint author), Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China.; Cheng, JG (reprint author), Univ Tokyo, Inst Solid State Phys, Kashiwa, Chiba 2778581, Japan. EM jgcheng@iphy.ac.cn FU National Basic Research Program of China [2014CB921500]; National Science Foundation of China [11574377]; Key Research Program of Frontier Sciences of the Chinese Academy of Sciences [XDB07020100, QYZDB-SSW-SLH013]; Opening Project of Wuhan National High Magnetic Field Center [2015KF22]; Huazhong University of Science and Technology; US Department of Energy, Office of Science, Basic Energy Sciences, Materials Science and Engineering Division; Strategic Priority Research Program FX This paper was supported by the National Basic Research Program of China (Grant No. 2014CB921500), the National Science Foundation of China (Grant No. 11574377), the Strategic Priority Research Program and the Key Research Program of Frontier Sciences of the Chinese Academy of Sciences (Grants No. XDB07020100 and No. QYZDB-SSW-SLH013), and the Opening Project of Wuhan National High Magnetic Field Center (Grant No. 2015KF22), Huazhong University of Science and Technology. Work at Oak Ridge National Laboratory was supported by the US Department of Energy, Office of Science, Basic Energy Sciences, Materials Science and Engineering Division. NR 35 TC 1 Z9 1 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 14 PY 2016 VL 94 IS 22 AR 224508 DI 10.1103/PhysRevB.94.224508 PG 7 WC Physics, Condensed Matter SC Physics GA EF3UQ UT WOS:000390250500006 ER PT J AU Humby, P Simon, A Beausang, CW Allmond, JM Burke, JT Casperson, RJ Chyzh, R Dag, M Gell, K Hughes, RO Koglin, J McCleskey, E McCleskey, M Ota, S Ross, TJ Saastamoinen, A Tarlow, T Vyas, G AF Humby, P. Simon, A. Beausang, C. W. Allmond, J. M. Burke, J. T. Casperson, R. J. Chyzh, R. Dag, M. Gell, K. Hughes, R. O. Koglin, J. McCleskey, E. McCleskey, M. Ota, S. Ross, T. J. Saastamoinen, A. Tarlow, T. Vyas, G. TI Investigation of discrete states and quasidiscrete structures observed in Sm-150 and Sm-152 using the (p,t gamma) reaction SO PHYSICAL REVIEW C LA English DT Article ID 2-NEUTRON TRANSFER-REACTIONS; P,T REACTION; HIGH-EXCITATION; EVEN ISOTOPES; TRANSITIONAL NUCLEI; HOLE STATES; SM; SAMARIUM; ENERGY; MODEL AB New levels and gamma-ray transitions were identified in Sm-150,Sm-152 utilizing the (p, t) reaction and particle-gamma coincidence data. A large, peak-like structure observed between 2.3-3.0 MeV in excitation energy in the triton energy spectra was also investigated. The orbital angular-momentum transfer was probed by comparing the experimental angular distributions of the outgoing tritons to calculated distorted wave Born approximation curves. The angular distributions of the outgoing tritons populating the peak-like structure are remarkably similar in the two reactions and are significantly different from the angular distributions associated with the nearby continuum region. Relative partial cross sections for the observed levels, angle averaged between 34 and 58 degrees, were measured. In Sm-150, 39(4)% of the strength of the peak-like structure could be accounted for by the observed discrete states. This compares with a value of 93(15)% for Sm-152. C1 [Humby, P.; Simon, A.; Beausang, C. W.; Gell, K.; Tarlow, T.; Vyas, G.] Univ Richmond, Dept Phys, Richmond, VA 23171 USA. [Humby, P.] Univ Surrey, Dept Phys, Surrey GU2 7XH, England. [Simon, A.] Univ Notre Dame, Dept Phys, Notre Dame, IN 46556 USA. [Allmond, J. M.] Oak Ridge Natl Lab, Div Phys, Oak Ridge, TN 37831 USA. [Burke, J. T.; Casperson, R. J.; Hughes, R. O.; Koglin, J.; Ota, S.] Lawrence Livermore Natl Lab, Livermore, CA 94551 USA. [Chyzh, R.; Dag, M.; McCleskey, E.; McCleskey, M.; Saastamoinen, A.] Texas A&M Univ, Cyclotron Inst, College Stn, TX 77843 USA. [Ross, T. J.] Univ Kentucky, Dept Chem, Lexington, KY 40506 USA. RP Humby, P (reprint author), Univ Richmond, Dept Phys, Richmond, VA 23171 USA.; Humby, P (reprint author), Univ Surrey, Dept Phys, Surrey GU2 7XH, England. FU U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-SC0014277, DE-FG02-05ER41379, DE-FG02-93ER40773]; U.S. Department of Energy, National Nuclear Security Administration [DE-NA0002914, DE-NA0001801, DE-FG52-09NA29467]; National Science Foundation [PHY-130581]; U.S. Department of Energy NNSA Office of Defense Nuclear Nonproliferation Research Development [DE-AC52-07NA27344] FX The authors are grateful to Professor J. L. Wood for information on levels and gamma-ray transitions in 152Sm and for helpful discussion of the data. This material is based on work supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics under Grants No. DE-SC0014277, No. DE-FG02-05ER41379, and No. DE-FG02-93ER40773, by the U.S. Department of Energy, National Nuclear Security Administration under Grants No. DE-NA0002914, No. DE-NA0001801, and No. DE-FG52-09NA29467, by the National Science Foundation under contract PHY-130581, and by the U.S. Department of Energy NNSA Office of Defense Nuclear Nonproliferation Research & Development under Contract No. DE-AC52-07NA27344 (Lawrence Livermore National Laboratory). NR 36 TC 0 Z9 0 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 14 PY 2016 VL 94 IS 6 AR 064314 DI 10.1103/PhysRevC.94.064314 PG 13 WC Physics, Nuclear SC Physics GA EF4BK UT WOS:000390269300002 ER PT J AU Mineart, KP Tallury, SS Li, T Lee, B Spontak, RJ AF Mineart, Kenneth P. Tallury, Syamal S. Li, Tao Lee, Byeongdu Spontak, Richard J. TI Phase-Change Thermoplastic Elastomer Blends for Tunable Shape Memory by Physical Design SO INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH LA English DT Article ID POTENTIAL BIOMEDICAL APPLICATIONS; DIELECTRIC ELASTOMERS; TRIBLOCK COPOLYMER; POLYMERS; COMPOSITES; BEHAVIOR; PROPERTY; OIL AB Intelligent polymeric materials are of increasing interest in contemporary technologies due to their low cost, light weight, facile processability, and inherent ability to change properties, shape, and/or size upon exposure to an external stimulus. In this study, we consider thermally programmable shape-memory polymers (SMPs), which typically rely on chemistry-specific macromolecules composed of two functional species. An elastic, network-forming component permits stretched polymer chains to return to their relaxed state, and a switching component affords at least one thermal transition to regulate fixation of a desired strain state and return to a previous strain state. Here, we produce designer shape-memory materials by combining thermoplastic elastomeric triblock copolymers with a midblock-selective phase-change additive, thereby yielding shape-memory polymer blends (SMPBs). These materials not only exhibit tunable switch points but also controllable recovery kinetics. We further highlight the versatility of SMPBs through laminate welding for intermediate multishape fabrication and liquid metal inclusion for shape-memory electronics. C1 [Mineart, Kenneth P.; Spontak, Richard J.] North Carolina State Univ, Dept Chem & Biomol Engn, Raleigh, NC 27695 USA. [Tallury, Syamal S.; Spontak, Richard J.] North Carolina State Univ, Dept Mat Sci & Engn, Raleigh, NC 27695 USA. [Tallury, Syamal S.] North Carolina State Univ, Fiber & Polymer Sci Program, Raleigh, NC 27695 USA. [Li, Tao; Lee, Byeongdu] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA. [Mineart, Kenneth P.] NIST, Mat Sci & Engn Div, Gaithersburg, MD 20899 USA. [Tallury, Syamal S.] ExxonMobil Chem Co, Baytown, TX 77520 USA. RP Spontak, RJ (reprint author), North Carolina State Univ, Dept Chem & Biomol Engn, Raleigh, NC 27695 USA.; Spontak, RJ (reprint author), North Carolina State Univ, Dept Mat Sci & Engn, Raleigh, NC 27695 USA. EM Rich_Spontak@ncsu.edu OI Lee, Byeongdu/0000-0003-2514-8805; Mineart, Kenneth/0000-0003-2374-4670 FU NC State Nonwovens Institute; MANN+HUMMEL GmbH; U.S. Department of Energy, Office of Sciences [DE-AC02-06CH11357] FX This contribution was identified, in part, by Professor John Gilmer (King University) and Dr. Jason Jenkins (Eastman Chemical Company) as the Best Presentation in the session "Eastman Chemical Student Award in Applied Polymer Science" of the 2016 ACS Fall National Meeting in Philadelphia, PA. K.P.M. and S.S.T. thank the NC State Nonwovens Institute for Ph.D. fellowships. K.P.M. would also like to thank MANN+HUMMEL GmbH for additional support. Use of the Advanced Photon Source is provided by the U.S. Department of Energy, Office of Sciences, under Contract DE-AC02-06CH11357. We are indebted to Professors M.D. Dickey and S.A. Khan for use of their fabrication and testing facilities, and to Mr. S.E. White for technical assistance. NR 42 TC 0 Z9 0 U1 13 U2 13 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0888-5885 J9 IND ENG CHEM RES JI Ind. Eng. Chem. Res. PD DEC 14 PY 2016 VL 55 IS 49 BP 12590 EP 12597 DI 10.1021/acs.iecr.6b04039 PG 8 WC Engineering, Chemical SC Engineering GA EE9RE UT WOS:000389963100010 ER PT J AU Aykol, M Kim, S Hegde, VI Snydacker, D Lu, Z Hao, SQ Kirklin, S Morgan, D Wolverton, C AF Aykol, Muratahan Kim, Soo Hegde, Vinay I. Snydacker, David Lu, Zhi Hao, Shiqiang Kirklin, Scott Morgan, Dane Wolverton, C. TI High-throughput computational design of cathode coatings for Li-ion batteries SO NATURE COMMUNICATIONS LA English DT Article ID RECHARGEABLE LITHIUM BATTERIES; LICOO2 CATHODES; ELECTROCHEMICAL PERFORMANCE; INTERCALATION CATHODE; SPINEL ELECTRODES; OXIDE COATINGS; COBALT OXIDE; STABILITY; VOLTAGE; TRANSITION AB Cathode degradation is a key factor that limits the lifetime of Li-ion batteries. To identify functional coatings that can suppress this degradation, we present a high-throughput density functional theory based framework which consists of reaction models that describe thermodynamic and electrochemical stabilities, and acid-scavenging capabilities of materials. Screening more than 130,000 oxygen-bearing materials, we suggest physical and hydrofluoric-acid barrier coatings such as WO3, LiAl5O8 and ZrP2O7 and hydrofluoric-acid scavengers such as Sc2O3, Li2CaGeO4, LiBO2, Li3NbO4, Mg-3(BO3)(2) and Li2MgSiO4. Using a design strategy to find the thermodynamically optimal coatings for a cathode, we further present optimal hydrofluoric-acid scavengers such as Li2SrSiO4, Li2CaSiO4 and CaIn2O4 for the layered LiCoO2, and Li2GeO3, Li4NiTeO6 and Li2MnO3 for the spinel LiMn2O4 cathodes. These coating materials have the potential to prolong the cycle-life of Li-ion batteries and surpass the performance of common coatings based on conventional materials such as Al2O3, ZnO, MgO or ZrO2. C1 [Aykol, Muratahan; Kim, Soo; Hegde, Vinay I.; Snydacker, David; Lu, Zhi; Hao, Shiqiang; Kirklin, Scott; Wolverton, C.] Northwestern Univ, Dept Mat Sci & Engn, Evanston, IL 60208 USA. [Morgan, Dane] Univ Wisconsin, Dept Mat Sci & Engn, Madison, WI 53706 USA. [Aykol, Muratahan] Lawrence Berkeley Natl Lab, Environm Energy Technol Div, Berkeley, CA 94720 USA. RP Wolverton, C (reprint author), Northwestern Univ, Dept Mat Sci & Engn, Evanston, IL 60208 USA. EM c-wolverton@northwestern.edu OI Morgan, Dane/0000-0002-4911-0046 FU Dow Chemical Company; Northwestern-Argonne Institute of Science and Engineering (NAISE); Center for Electrical Energy Storage: Tailored Interfaces, Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231]; National Science Foundation [DMR-1309957] FX M.A., Z.L., S.H., D.M. and C.W. were supported by The Dow Chemical Company. S. Kim was supported by Northwestern-Argonne Institute of Science and Engineering (NAISE). V.I.H. was supported by the National Science Foundation through grant DMR-1309957. S. Kirklin (OQMD calculations and qmpy software) was supported by the Center for Electrical Energy Storage: Tailored Interfaces, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. This research used resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. NR 77 TC 1 Z9 1 U1 94 U2 94 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 14 PY 2016 VL 7 AR 13779 DI 10.1038/ncomms13779 PG 12 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE7RB UT WOS:000389819600001 PM 27966537 ER PT J AU Kitchaev, DA Ceder, G AF Kitchaev, Daniil A. Ceder, Gerbrand TI Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite SO NATURE COMMUNICATIONS LA English DT Article ID DENSITY-FUNCTIONAL THEORY; TOTAL-ENERGY CALCULATIONS; AUGMENTED-WAVE METHOD; MOLECULAR-STRUCTURE; BASIS-SET; PHASE; SURFACES; NUCLEATION; CHEMISTRY; THERMODYNAMICS AB While the ab initio prediction of the properties of solids and their optimization towards new proposed materials is becoming established, little predictive theory exists as to which metastable materials can be made and how, impeding their experimental realization. Here we propose a quasi-thermodynamic framework for predicting the hydrothermal synthetic accessibility of metastable materials and apply this model to understanding the phase selection between the pyrite and marcasite polymorphs of FeS2. We demonstrate that phase selection in this system can be explained by the surface stability of the two phases as a function of ambient pH within nano-size regimes relevant to nucleation. This result suggests that a first-principles understanding of nano-size phase stability in realistic synthesis environments can serve to explain or predict the synthetic accessibility of structural polymorphs, providing a guideline to experimental synthesis via efficient computational materials design. C1 [Kitchaev, Daniil A.; Ceder, Gerbrand] MIT, Dept Mat Sci & Engn, Cambridge, MA 02139 USA. [Ceder, Gerbrand] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Ceder, Gerbrand] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. RP Kitchaev, DA; Ceder, G (reprint author), MIT, Dept Mat Sci & Engn, Cambridge, MA 02139 USA.; Ceder, G (reprint author), Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA.; Ceder, G (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. EM dkitch@mit.edu; gceder@berkeley.edu OI /0000-0003-2309-3644 FU NSF Software Infrastructure for Sustained Innovation (SI2-SSI) Collaborative Research program of the National Science Foundation [OCI-1147503]; Office of Science of the US. Department of Energy [DE-AC02-05CH11231] FX We thank Wenhao Sun, Pieremanuele Canepa and Sai Jayaraman for fruitful discussions. Support for this work was provided by the NSF Software Infrastructure for Sustained Innovation (SI2-SSI) Collaborative Research program of the National Science Foundation under Award No. OCI-1147503. Computational resources for this project were provided by the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the US. Department of Energy under contract no. DE-AC02-05CH11231. NR 53 TC 1 Z9 1 U1 42 U2 42 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 14 PY 2016 VL 7 AR 13799 DI 10.1038/ncomms13799 PG 7 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6DC UT WOS:000389697900001 PM 27966547 ER PT J AU Schaibley, JR Rivera, P Yu, HY Seyler, KL Yan, JQ Mandrus, DG Taniguchi, T Watanabe, K Yao, W Xu, XD AF Schaibley, John R. Rivera, Pasqual Yu, Hongyi Seyler, Kyle L. Yan, Jiaqiang Mandrus, David G. Taniguchi, Takashi Watanabe, Kenji Yao, Wang Xu, Xiaodong TI Directional interlayer spin-valley transfer in two-dimensional heterostructures SO NATURE COMMUNICATIONS LA English DT Article ID TRANSITION-METAL DICHALCOGENIDES; MONOLAYER WSE2; ELECTRICAL CONTROL; EXCITON DYNAMICS; SEMICONDUCTOR; POLARIZATION; GENERATION; MOS2/WS2 AB Van der Waals heterostructures formed by two different monolayer semiconductors have emerged as a promising platform for new optoelectronic and spin/valleytronic applications. In addition to its atomically thin nature, a two-dimensional semiconductor heterostructure is distinct from its three-dimensional counterparts due to the unique coupled spin-valley physics of its constituent monolayers. Here, we report the direct observation that an optically generated spin-valley polarization in one monolayer can be transferred between layers of a two-dimensional MoSe2-WSe2 heterostructure. Using non-degenerate optical circular dichroism spectroscopy, we show that charge transfer between two monolayers conserves spin-valley polarization and is only weakly dependent on the twist angle between layers. Our work points to a new spin-valley pumping scheme in nanoscale devices, provides a fundamental understanding of spin-valley transfer across the two-dimensional interface, and shows the potential use of two-dimensional semiconductors as a spin-valley generator in two-dimensional spin/valleytronic devices for storing and processing information. C1 [Schaibley, John R.; Rivera, Pasqual; Seyler, Kyle L.; Xu, Xiaodong] Univ Washington, Dept Phys, Seattle, WA 98195 USA. [Yu, Hongyi; Yao, Wang] Univ Hong Kong, Dept Phys, Hong Kong, Hong Kong, Peoples R China. [Yu, Hongyi; Yao, Wang] Univ Hong Kong, Ctr Theoret & Computat Phys, Hong Kong, Hong Kong, Peoples R China. [Yan, Jiaqiang; Mandrus, David G.] Oak Ridge Natl Lab, Div Mat Sci & Technol, Oak Ridge, TN 37831 USA. [Yan, Jiaqiang; Mandrus, David G.] Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USA. [Mandrus, David G.] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. [Taniguchi, Takashi; Watanabe, Kenji] Natl Inst Mat Sci, Adv Mat Lab, Tsukuba, Ibaraki 3050044, Japan. [Xu, Xiaodong] Univ Washington, Dept Mat Sci & Engn, Seattle, WA 98195 USA. RP Schaibley, JR; Xu, XD (reprint author), Univ Washington, Dept Phys, Seattle, WA 98195 USA.; Xu, XD (reprint author), Univ Washington, Dept Mat Sci & Engn, Seattle, WA 98195 USA. EM johnschaibley@email.arizona.edu; xuxd@uw.edu RI Yao, Wang/C-1353-2008; OI Yao, Wang/0000-0003-2883-4528; Rivera, Pasqual/0000-0002-5909-1686; Watanabe, Kenji/0000-0003-3701-8119 FU Department of Energy, Basic Energy Sciences, Materials Sciences and Engineering Division [DE-SC0008145, SC0012509]; Croucher Foundation (Croucher Innovation Award); RGC of Hong Kong [HKU17305914P]; HKU ORA; US DoE, BES, Materials Sciences and Engineering Division; Elemental Strategy Initiative; JSPS; State of Washington; Cottrell Scholar Award; Boeing Distinguished Professorship in Physics FX This work is mainly supported by the Department of Energy, Basic Energy Sciences, Materials Sciences and Engineering Division (DE-SC0008145 and SC0012509). H.Y. and W.Y. are supported by the Croucher Foundation (Croucher Innovation Award), the RGC of Hong Kong (HKU17305914P), and the HKU ORA. J.Y. and D.M. are supported by US DoE, BES, Materials Sciences and Engineering Division. K.W. and T.T. acknowledge support from the Elemental Strategy Initiative performed by the MEXT, Japan and a Grant-in-Aid for Scientific Research on Innovative Areas 'Science of Atomic Layers' from JSPS. P.R. and X.X. acknowledge support from the State of Washington funded Clean Energy Institute. X.X. also acknowledges a Cottrell Scholar Award, and support from the Boeing Distinguished Professorship in Physics. NR 37 TC 0 Z9 0 U1 59 U2 59 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 14 PY 2016 VL 7 AR 13747 DI 10.1038/ncomms13747 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE7RA UT WOS:000389819500001 PM 27966524 ER PT J AU Macaluso, DA Bogolub, K Johnson, A Aguilar, A Kilcoyne, ALD Bilodeau, RC Bautista, M Kerlin, AB Sterling, NC AF Macaluso, D. A. Bogolub, K. Johnson, A. Aguilar, A. Kilcoyne, A. L. D. Bilodeau, R. C. Bautista, M. Kerlin, A. B. Sterling, N. C. TI Absolute single photoionization cross-section measurements of Rb2+ ions: experiment and theory SO JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS LA English DT Article DE rubidium; absolute cross section; photoionization; synchrotron; rubidium ions ID ELECTRON-IMPACT EXCITATION; PLANETARY-NEBULAE; EMISSION-LINES; HIGH-RESOLUTION; ELEMENTS; ABUNDANCES; IDENTIFICATION; SPECTROSCOPY; SPECTRA; STATES AB Absolute single photoionization cross-section measurements of Rb2+ ions were performed using synchrotron radiation and the photo-ion, merged-beams technique at the Advanced Light Source at Lawrence Berkeley National Laboratory. Measurements were made at a photon energy resolution of 13.5 +/- 2.5 meV from 37.31 to 44.08. eV spanning the P-2(3/2)0 ground state and P-2(1/2)0 metastable state ionization thresholds. Multiple autoionizing resonance series arising from each initial state are identified using quantum defect theory. The measurements are compared to Breit-Pauli R-matrix calculations with excellent agreement between theory and experiment. C1 [Macaluso, D. A.; Bogolub, K.; Johnson, A.] Univ Montana, Dept Phys & Astron, Missoula, MT 59812 USA. [Aguilar, A.; Kilcoyne, A. L. D.; Bilodeau, R. C.] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Bilodeau, R. C.] Univ Connecticut, Dept Phys, Storrs, CT 06269 USA. [Bautista, M.] Western Michigan Univ, Dept Phys, Kalamazoo, MI 49008 USA. [Kerlin, A. B.; Sterling, N. C.] Univ West Georgia, Dept Phys, Carrollton, GA 30118 USA. [Bogolub, K.] Univ Colorado, Dept Geol Sci, Boulder, CO 80309 USA. RP Macaluso, DA (reprint author), Univ Montana, Dept Phys & Astron, Missoula, MT 59812 USA. EM david.macaluso@umontana.edu RI Kilcoyne, David/I-1465-2013 FU NSF [AST-1412928]; Montana Space Grant Consortium; US Department of Energy, office of Science, Basic Energy Sciences (BES), Division of Chemical Sciences, Geosciences, and Biosciences [DE-SC0012376]; Office of Science, Office of Basic Energy Sciences, of the US Department of Energy [DE-AC02-05CH11231] FX We gratefully acknowledge support from the NSF through award AST-1412928. D Macaluso gratefully acknowledges support from the Montana Space Grant Consortium. R Bilodeau gratefully acknowledges support from the US Department of Energy, office of Science, Basic Energy Sciences (BES), Division of Chemical Sciences, Geosciences, and Biosciences under grants Nos. DE-SC0012376. Data acquired at beamline 10.0.1.2 at the Advanced Light Source, which is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the US Department of Energy under contract No. DE-AC02-05CH11231. NR 41 TC 0 Z9 0 U1 4 U2 4 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0953-4075 EI 1361-6455 J9 J PHYS B-AT MOL OPT JI J. Phys. B-At. Mol. Opt. Phys. PD DEC 14 PY 2016 VL 49 IS 23 AR 235002 DI 10.1088/0953-4075/49/23/235002 PG 9 WC Optics; Physics, Atomic, Molecular & Chemical SC Optics; Physics GA ED1NM UT WOS:000388612200001 ER PT J AU Paim, FC Langel, SN Fischer, DD Kandasamy, S Shao, LL Alhamo, MA Huang, HC Kumar, A Rajashekara, G Saif, LJ Vlasova, AN AF Paim, Francine C. Langel, Stephanie N. Fischer, David D. Kandasamy, Sukumar Shao, Lulu Alhamo, Moyasar A. Huang, Huang-Chi Kumar, Anand Rajashekara, Gireesh Saif, Linda J. Vlasova, Anastasia N. TI Effects of Escherichia coli Nissle 1917 and Ciprofloxacin on small intestinal epithelial cell mRNA expression in the neonatal piglet model of human rotavirus infection SO GUT PATHOGENS LA English DT Article DE Probiotic; Antibiotic; Commensal microflora; Gnotobiotic piglets; Human rotavirus; Intestinal epithelial cell-specific genes ID ANTIBODY REPERTOIRE DEVELOPMENT; GNOTOBIOTIC PIGS; NEWBORN PIGLETS; COLONIZATION; RESPONSES; FETAL; MICROBIOTA; COMMENSAL; ANTIGENS; BACTERIA AB We evaluated the effects of the probiotic Escherichia coli Nissle 1917 (EcN) and the antibiotic Ciprofloxacin (Cipro) on mRNA expression of intestinal epithelial cells (IEC) in gnotobiotic (Gn) piglets colonized with a defined commensal microflora (DMF) and inoculated with human rotavirus (HRV) that infects IECs. We analyzed mRNA levels of IEC genes for enteroendocrine cells [chromogranin A (CgA)], goblet cells [mucin 2 (MUC2)], transient amplifying progenitor cell [proliferating cell nuclear antigen (PCNA)], intestinal epithelial stem cell (SOX9) and enterocytes (villin). Cipro treatment enhanced HRV diarrhea and decreased the mRNA levels of MUC2 and villin but increased PCNA. These results suggest that Cipro alters the epithelial barrier, potentially decreasing the numbers of mature enterocytes (villin) and goblet cells secreting protective mucin (MUC2). These alterations may induce increased IEC proliferation (PCNA expression) to restore the integrity of the epithelial layer. Coincidental with decreased diarrhea severity in EcN treated groups, the expression of CgA and villin was increased, while SOX9 expression was decreased representing higher epithelial integrity indicative of inhibition of cellular proliferation. Thus, EcN protects the intestinal epithelium from damage by increasing the gene expression of enterocytes and enteroendocrine cells, maintaining the absorptive function and, consequently, decreasing the severity of diarrhea in HRV infection. C1 [Paim, Francine C.; Langel, Stephanie N.; Fischer, David D.; Kandasamy, Sukumar; Shao, Lulu; Alhamo, Moyasar A.; Huang, Huang-Chi; Kumar, Anand; Rajashekara, Gireesh; Saif, Linda J.; Vlasova, Anastasia N.] Ohio State Univ, Food Anim Hlth Res Program, Ohio Agr Res & Dev Ctr, Dept Vet Prevent Med, 1680 Madison Ave, Wooster, OH 44691 USA. [Shao, Lulu] Univ Pittsburgh, Hillman Canc Ctr, 4200 Fifth Ave, Pittsburgh, PA 15260 USA. [Kumar, Anand] Los Alamos Natl Lab, Genom & Syst Biol, Biosci Div, Los Alamos, NM 87545 USA. RP Saif, LJ; Vlasova, AN (reprint author), Ohio State Univ, Food Anim Hlth Res Program, Ohio Agr Res & Dev Ctr, Dept Vet Prevent Med, 1680 Madison Ave, Wooster, OH 44691 USA. EM saif.2@osu.edu; vlasova.1@osu.edu FU National Institutes of Health (NIH) [R01 A1099451] FX This study was supported by grant from the National Institutes of Health (NIH) R01 A1099451 to Dr. L.J. Saif, PI and Dr. Vlasova and Dr. Rajashekara Co PIs. NR 42 TC 0 Z9 0 U1 2 U2 2 PU BIOMED CENTRAL LTD PI LONDON PA 236 GRAYS INN RD, FLOOR 6, LONDON WC1X 8HL, ENGLAND SN 1757-4749 J9 GUT PATHOG JI Gut Pathogens PD DEC 13 PY 2016 VL 8 AR 66 DI 10.1186/s13099-016-0148-7 PG 7 WC Gastroenterology & Hepatology; Microbiology SC Gastroenterology & Hepatology; Microbiology GA EL6GJ UT WOS:000394718100001 PM 27999620 ER PT J AU Sheth, R Barozzi, I Langlais, D Osterwalder, M Nemec, S Carlson, HL Stadler, HS Visel, A Drouin, J Kmita, M AF Sheth, Rushikesh Barozzi, Iros Langlais, David Osterwalder, Marco Nemec, Stephen Carlson, Hanqian L. Stadler, H. Scott Visel, Axel Drouin, Jacques Kmita, Marie TI Distal Limb Patterning Requires Modulation of cis-Regulatory Activities by HOX13 SO CELL REPORTS LA English DT Article ID PIONEER TRANSCRIPTION FACTORS; GENE-EXPRESSION; VERTEBRATE LIMB; AXIAL SKELETON; ENHANCERS; MOUSE; EVOLUTION; ORGANOGENESIS; COLLINEARITY; MECHANISMS AB The combinatorial expression of Hox genes along the body axes is a major determinant of cell fate and plays a pivotal role in generating the animal body plan. Loss of HOXA13 and HOXD13 transcription factors (HOX13) leads to digit agenesis in mice, but how HOX13 proteins regulate transcriptional outcomes and confer identity to the distal-most limb cells has remained elusive. Here, we report on the genome-wide profiling of HOXA13 and HOXD13 in vivo binding and changes of the transcriptome and chromatin state in the transition from the early to the late-distal limb developmental program, as well as in Hoxa13(-/-); Hoxd13(-/-) limbs. Our results show that proper termination of the early limb transcriptional program and activation of the late-distal limb program are coordinated by the dual action of HOX13 on cis-regulatory modules. C1 [Sheth, Rushikesh; Kmita, Marie] Inst Rech Clin Montreal, Lab Genet & Dev, 110 Ave Pins Ouest, Montreal, PQ H2W 1R7, Canada. [Barozzi, Iros; Osterwalder, Marco; Visel, Axel] Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA. [Langlais, David] McGill Univ, Dept Biochem, 3649 Promenade Sir William Osler, Montreal, PQ H3G 0B1, Canada. [Nemec, Stephen; Drouin, Jacques] Inst Rech Clin Montreal, Lab Mol Genet, 110 Ave Pins Ouest, Montreal, PQ H2W 1R7, Canada. [Carlson, Hanqian L.; Stadler, H. Scott] Shriners Hosp Children, Dept Skeletal Biol, 3101 SW Sam Jackson Pk Rd, Portland, OR 97239 USA. [Visel, Axel] US DOE, Joint Genome Inst, Walnut Creek, CA 94598 USA. [Visel, Axel] Univ Calif Merced, Sch Nat Sci, Merced, CA 95340 USA. [Drouin, Jacques; Kmita, Marie] Univ Montreal, Dept Med, Montreal, PQ H3T 1J4, Canada. RP Sheth, R; Kmita, M (reprint author), Inst Rech Clin Montreal, Lab Genet & Dev, 110 Ave Pins Ouest, Montreal, PQ H2W 1R7, Canada.; Kmita, M (reprint author), Univ Montreal, Dept Med, Montreal, PQ H3T 1J4, Canada. EM rushikesh.s.sheth@gmail.com; marie.kmita@ircm.qc.ca FU Canada Research Chair Program [RCHS0192]; Canadian Institutes for Health Research (CIHR) [CIHR MOP-115127, 126110, CIHR MOP-123213, CEERC EPI-120608]; Shriners Hospital [85400]; National Institutes of Health [R24HL123879, U01DE024427, R01HG003988, U54HG006997, UM1HL098166]; CIHR postdoctoral fellowship; NIH; Fonds de recherche du Quebec en Sante; Swiss National Science Foundation (SNSF) fellowship; CIHR; Department of Energy [DE-AC02-05CH11231] FX We thank P. Chambon and D. Duboule for providing the mutant mice lines. This work was supported by the Canada Research Chair Program (grant RCHS0192) and the Canadian Institutes for Health Research (CIHR; grants CIHR MOP-115127 and 126110 to M.K., CIHR MOP-123213 and CEERC EPI-120608 to J.D.) and Shriners Hospital (research grant 85400 to H.S.S.). A.V. was supported by National Institutes of Health grants R24HL123879, U01DE024427, R01HG003988, U54HG006997, and UM1HL098166. R.S. was supported by a CIHR postdoctoral fellowship. I.B. is supported by NIH grants to A.V. D.L. was supported by a fellowship from the Fonds de recherche du Quebec en Sante. M.O. was supported by a Swiss National Science Foundation (SNSF) fellowship. S.N. is supported by CIHR grants to J.D. Research conducted at the E.O. Lawrence Berkeley National Laboratory was performed under Department of Energy contract DE-AC02-05CH11231 (University of California). NR 63 TC 0 Z9 0 U1 5 U2 5 PU CELL PRESS PI CAMBRIDGE PA 600 TECHNOLOGY SQUARE, 5TH FLOOR, CAMBRIDGE, MA 02139 USA SN 2211-1247 J9 CELL REP JI Cell Reports PD DEC 13 PY 2016 VL 17 IS 11 BP 2913 EP 2926 DI 10.1016/j.celrep.2016.11.039 PG 14 WC Cell Biology SC Cell Biology GA EG2SP UT WOS:000390894700013 PM 27974206 ER PT J AU Thimmaiah, S Taufour, V Saunders, S March, S Zhang, YM Kramer, MJ Canfield, PC Miller, GJ AF Thimmaiah, Srinivasa Taufour, Valentin Saunders, Scott March, Stephen Zhang, Yuemei Kramer, Matthew J. Canfield, Paul C. Miller, Gordon J. TI Stabilization of a Metastable Fibrous Bi-21.2(1)(Mn1-xCox)(20) Phase with Pseudo-Pentagonal Symmetry Prepared Using a Bi Self-Flux SO CHEMISTRY OF MATERIALS LA English DT Article ID AUGMENTED-WAVE METHOD; PERMANENT-MAGNETS; MAGNETOOPTICAL PROPERTIES; NEUTRON-DIFFRACTION; INTERMETALLIC COMPOUNDS; CRYSTAL-GROWTH; MNBI FILMS; METAL; FE; PSEUDOMORPHOSIS C1 [Thimmaiah, Srinivasa; Taufour, Valentin; Kramer, Matthew J.; Canfield, Paul C.; Miller, Gordon J.] Iowa State Univ, US DOE, Ames Lab, Ames, IA 50011 USA. [Zhang, Yuemei; Miller, Gordon J.] Iowa State Univ, Dept Chem, Ames, IA 50011 USA. [Taufour, Valentin; Saunders, Scott; March, Stephen; Canfield, Paul C.] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [Kramer, Matthew J.] Iowa State Univ, Dept Mat Sci & Engn, Ames, IA 50011 USA. RP Thimmaiah, S (reprint author), Iowa State Univ, US DOE, Ames Lab, Ames, IA 50011 USA. EM srini@iastate.edu RI Zhang, Yuemei/H-7370-2012 FU U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering; Critical Materials Institute, an Energy Innovation Hub - U.S. Department of Energy, Office of Energy Efficiency and Renewable Energy, Advanced Manufacturing Office; U.S. Department of Energy [DE-AC02-07CH11358] FX We thank Dr. Warren Straszheim for doing WDS on various samples. S.T., and G.J.M., were supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering. V.T., S.S., S.M., M.J.K., and P.C.C. were supported by the Critical Materials Institute, an Energy Innovation Hub funded by the U.S. Department of Energy, Office of Energy Efficiency and Renewable Energy, Advanced Manufacturing Office. This work was carried out at the Ames Laboratory, which is operated for the U.S. Department of Energy by Iowa State University under Contract No. DE-AC02-07CH11358. NR 52 TC 0 Z9 0 U1 15 U2 15 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0897-4756 EI 1520-5002 J9 CHEM MATER JI Chem. Mat. PD DEC 13 PY 2016 VL 28 IS 23 BP 8484 EP 8488 DI 10.1021/acs.chemmater.6b04505 PG 5 WC Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EE8HP UT WOS:000389866600008 ER PT J AU Hudry, D Abeykoon, AMM Dooryhee, E Nykypanchuk, D Dickerson, JH AF Hudry, D. Abeykoon, A. M. M. Dooryhee, E. Nykypanchuk, D. Dickerson, J. H. TI Probing the Crystal Structure and Formation Mechanism of Lanthanide-Doped Upconverting Nanocrystals SO CHEMISTRY OF MATERIALS LA English DT Article ID PAIR DISTRIBUTION FUNCTION; X-RAY-DIFFRACTION; UP-CONVERSION LUMINESCENCE; OPTICAL-PROPERTIES; OXIDE NANOCRYSTALS; LI+ IONS; NANOPARTICLES; ENHANCEMENT; NANOSCALE; EMISSION AB Lanthanide (Ln)-doped upconverting nano crystals (UCNCs), such as NaLnF(4) (with Ln = lanthanide), constitute an important class of nanoscale materials due to their capacity to convert near-infrared photons into near ultraviolet or visible light. Although under intense investigation for more than a decade, UCNCs have been relatively underexplored especially regarding their crystal structure and mechanisms of formation in organic media. The former is needed to explain the relationship between atomic scale structure and upconversion (UC) properties of UCNCs local symmetry for 4f-4f transition probability, Ln(3+) distances for energy migration), while the latter is essential to finely tune the size, morphology, chemical composition, and architecture of well-defined upconverting nanostructures, which constitute the experimental levers to modify the optical properties. In this contribution, we use synchrotron-based diffraction experiments coupled to Rietveld and pair distribution function (PDF) analyses to understand the formation of NaGdF4:Yb:Er UCNCs in organic media and to investigate their crystal structure. Our results reveal a complex mechanism of the formation of NaGdF4:Yb:Er UCNCs based on chemical reactions involving molecular clusters and in situ-generated, crystalline sodium fluoride at high temperature. Additionally, a detailed crystallographic investigation of NaGdF4:Yb:Er UCNCs is presented. Our Rietveld and PDF analyses show that the space group P (6) over bar is the one that best describes the crystal structure of NaGdF4:Yb:Er UCNCs contrary to what has been recently proposed. Further, our Rietveld and PDF data reveal the formation of bulk-like crystal structure down to 10 nm with limited distortions. The results presented in this paper constitute an important step toward the comprehensive understanding of the underlying picture that governs UC properties of lanthanide-doped nanostructures. C1 [Hudry, D.; Dickerson, J. H.] Brown Univ, Dept Phys, Providence, RI 02912 USA. [Abeykoon, A. M. M.; Dooryhee, E.] Brookhaven Natl Lab, Natl Synchrotron Light Source 2, Photon Sci Div, Upton, NY 11973 USA. [Nykypanchuk, D.; Dickerson, J. H.] Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. [Hudry, D.] Karlsruhe Inst Technol, Hermann von Helmholtz Pl 1, D-76344 Eggenstein Leopoldshafen, Germany. RP Hudry, D; Dickerson, JH (reprint author), Brown Univ, Dept Phys, Providence, RI 02912 USA.; Dickerson, JH (reprint author), Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA.; Hudry, D (reprint author), Karlsruhe Inst Technol, Hermann von Helmholtz Pl 1, D-76344 Eggenstein Leopoldshafen, Germany. EM damien.hudry@gmail.com; jdickerson@bnl.gov FU National Science Foundation (NSF) [CHE-1402298]; U.S. Department of Energy, Office of Basic Energy Sciences [DE-SC0012704]; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-SC0012704] FX This research was supported by the National Science Foundation (NSF) Award CHE-1402298. Research was carried out in part at the Center for Functional Nanomaterials, Brookhaven National Laboratory, which is supported by the U.S. Department of Energy, Office of Basic Energy Sciences, under Contract No. DE-SC0012704. Use of the National Synchrotron Light Source II, Brookhaven National Laboratory, is supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract No. DE-SC0012704. NR 48 TC 0 Z9 0 U1 30 U2 30 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0897-4756 EI 1520-5002 J9 CHEM MATER JI Chem. Mat. PD DEC 13 PY 2016 VL 28 IS 23 BP 8752 EP 8763 DI 10.1021/acs.chemmater.6b04140 PG 12 WC Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EE8HP UT WOS:000389866600038 ER PT J AU Thelen, JL Inceoglu, S Venkatesan, NR Mackay, NG Balsara, NP AF Thelen, Jacob L. Inceoglu, Sebnem Venkatesan, Naveen R. Mackay, Nikolaus G. Balsara, Nitash P. TI Relationship between Ion Dissociation, Melt Morphology, and Electrochemical Performance of Lithium and Magnesium Single-Ion Conducting Block Copolymers SO MACROMOLECULES LA English DT Article ID POLY(ETHYLENE OXIDE); POLYMER ELECTROLYTES; MOLECULAR-WEIGHT; TRIBLOCK COPOLYMERS; SALT CONCENTRATION; BATTERIES; TRANSPORT; METAL; CHALLENGES; COMPLEXES AB Single-ion conducting block copolymers, such as poly(ethylene oxide)-b-poly[(styrene-4-sulfonyltrifluoromethylsulfonyl)imide lithium] (PEO P[(STFSI)Li]), represent an exciting new class of materials capable of improving the performance of solid-state batteries with metal anodes. In this work, we report on the synthesis and characterization of a matched set of lithiated (PEO PRSTFSI)Lip and magnesiated (PEO P[(STFSI)2Mg]) single-ion conducting diblock copolymers. We measure the temperature dependence of ionic conductivity, and through analysis using the Vogel Tamman Fulcher (VTF) relation, demonstrate that ion dissociation is significantly lower for all PEO P[(STFSI)2Mg] samples when compared to their PEO P[(STFSI)Li] counterparts. The VTF parameter characterizing the activation barrier to ion hopping was similar for both cations, but the VTF prefactor that reflects effective charge carrier concentration was higher in the lithiated samples by an order of magnitude. We study the melt morphology of the single-ion conducting block copolymers using temperature-dependent X-ray scattering and use the mean-field theory of Leibler to extract the effective Flory Huggins interaction parameter (x) for PEO/P[(STFSI)Li] and PEO/P[(STFSI)2Mg] from the X-ray scattering data. We demonstrate a linear relationship between the charge-concentration-related VTF parameter and the parameter quantifying the enthalpic contribution to x. It is evident that ion dissociation and block copolymer thermodynamics are intimately coupled; ion dissociation in these systems suppresses microphase separation. C1 [Thelen, Jacob L.; Venkatesan, Naveen R.; Mackay, Nikolaus G.; Balsara, Nitash P.] Univ Calif Berkeley, Dept Chem & Biomol Engn, Berkeley, CA 94720 USA. [Venkatesan, Naveen R.] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Thelen, Jacob L.; Inceoglu, Sebnem; Balsara, Nitash P.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Thelen, Jacob L.; Inceoglu, Sebnem; Balsara, Nitash P.] Lawrence Berkeley Natl Lab, JCESR, Berkeley, CA 94720 USA. [Balsara, Nitash P.] Lawrence Berkeley Natl Lab, Environm Energy Technol Div, Berkeley, CA 94720 USA. RP Balsara, NP (reprint author), Univ Calif Berkeley, Dept Chem & Biomol Engn, Berkeley, CA 94720 USA.; Balsara, NP (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA.; Balsara, NP (reprint author), Lawrence Berkeley Natl Lab, JCESR, Berkeley, CA 94720 USA.; Balsara, NP (reprint author), Lawrence Berkeley Natl Lab, Environm Energy Technol Div, Berkeley, CA 94720 USA. EM nbalsara@berkeley.edu FU Joint Center for Energy Storage Research, an Energy Innovation Hub - U.S. Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES); Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work was supported by the Joint Center for Energy Storage Research, an Energy Innovation Hub funded by the U.S. Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES). Thermal analysis was performed at the Molecular Foundry at Lawrence Berkeley National Laboratory. X-ray scattering experiments were performed at Lawrence Berkeley National Laboratory's Advance Light Source, Beam line 7.3.3. The Molecular Foundry and Beamline 7.3.3 of the Advanced Light Source are supported by the Director of the Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract DE-AC02-05CH11231. We thank Polite Stewart, Chenhui Zhu, and Eric Schaible for their assistance with the setup and operation of Beamline 7.3.3 as well as Hilda Buss for her assistance with the NMR analysis of the single-ion conducting block copolymers. NR 41 TC 0 Z9 0 U1 37 U2 37 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0024-9297 EI 1520-5835 J9 MACROMOLECULES JI Macromolecules PD DEC 13 PY 2016 VL 49 IS 23 BP 9139 EP 9147 DI 10.1021/acs.macromol.6b01886 PG 9 WC Polymer Science SC Polymer Science GA EE8HJ UT WOS:000389866000036 ER PT J AU Middleton, LR Tarver, JD Cordaro, J Tyagi, M Soles, CL Frischknecht, AL Winey, KI AF Middleton, L. Robert Tarver, Jacob D. Cordaro, Joseph Tyagi, Madhusudan Soles, Christopher L. Frischknecht, Amalie L. Winey, Karen I. TI Heterogeneous Chain Dynamics and Aggregate Lifetimes in Precise Acid-Containing Polyethylenes: Experiments and Simulations SO MACROMOLECULES LA English DT Article ID AA FORCE-FIELD; NEUTRON-SCATTERING EXPERIMENTS; ION-CONTAINING POLYETHYLENES; X-RAY-SCATTERING; POLYMER ELECTROLYTES; RELAXATION PROCESSES; IONOMER MELTS; MORPHOLOGIES; TEMPERATURE; COPOLYMERS AB Melt state dynamics for a series of strictly linear polyethylenes with precisely spaced associating functional groups were investigated. The periodic pendant acrylic acid groups form hydrogen-bonded acid aggregates within the polyethylene (PE) matrix. The dynamics of these nanoscale heterogeneous morphologies were investigated from picosecond to nanosecond timescales by both quasi-elastic neutron scattering (QENS) measurements and fully atomistic molecular dynamics (MD) simulations. Two dynamic processes were observed. The faster dynamic processes which occur at the picosecond timescales are compositionally insensitive and indicative of spatially restricted local motions. The slower dynamic processes are highly composition dependent and indicate the structural relaxation of the polymer backbone. Higher acid contents, or shorter PE spacers between pendant acid groups, slow the structural relaxation timescale and increase the stretching parameter (beta) of the structural relaxation. Additionally, the dynamics of specific hydrogen atom positions along the backbone correlate structural heterogeneity imposed by the associating acid groups with a mobility gradient along the polymer backbone. At time intervals (<2 ns), the mean-squared displacements for the four methylene groups closest to the acid groups are up to 10 times smaller than those of methylene groups further from the acid groups. At longer timescales acid aggregates rearrange and the chain dynamics of the slow, near-aggregate regions and the faster bridge regions converge, implying a characteristic timescale for the passage of chains between aggregates. The characterization of the nanoscale chain dynamics in these associating polymer systems both provides validation of simulation force fields and provides understanding of heterogeneous chain dynamics in associating polymers. C1 [Middleton, L. Robert; Winey, Karen I.] Univ Penn, Dept Mat Sci & Engn, 3231 Walnut St, Philadelphia, PA 19104 USA. [Winey, Karen I.] Univ Penn, Dept Chem & Biomol Engn, Philadelphia, PA 19104 USA. [Tarver, Jacob D.; Soles, Christopher L.] NIST, Mat Sci & Engn Div, Gaithersburg, MD 20899 USA. [Cordaro, Joseph] Sandia Natl Labs, Livermore, CA 94550 USA. [Frischknecht, Amalie L.] Sandia Natl Labs, Ctr Integrated Nanotechnol, POB 5800, Albuquerque, NM 87185 USA. [Tyagi, Madhusudan; Soles, Christopher L.] NIST, Ctr Neutron Res, Gaithersburg, MD 20899 USA. [Tyagi, Madhusudan] Univ Maryland, Dept Mat Sci & Engn, College Pk, MD 20742 USA. RP Winey, KI (reprint author), Univ Penn, Dept Mat Sci & Engn, 3231 Walnut St, Philadelphia, PA 19104 USA.; Winey, KI (reprint author), Univ Penn, Dept Chem & Biomol Engn, Philadelphia, PA 19104 USA. EM winey@seas.upenn.edu FU National Science Foundation [15-06726]; MRSEC Program of the National Science Foundation [DMR 11-20901]; Sandia Laboratory Directed Research and Development (LDRD) program; U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000]; National Science Foundation as part of the Center for High Resolution Neutron Spectroscopy [DMR-1508249]; National Research Council Research Associateship award at NIST FX At the University of Pennsylvania this work was supported by the National Science Foundation Polymers Program Grant DMR (15-06726). The MAXS facility is funded in part by the MRSEC Program of the National Science Foundation (DMR 11-20901). Any opinions, findings, and conclusions or recommendations expressed in this paper are those of the authors and do not necessarily reflect the views of the United States National Science Foundation. This work was performed, in part, at the Center for Integrated Nanotechnologies, an Office of Science User Facility operated for the U.S. Department of Energy (DOE) Office of Science. This work was also supported by the Sandia Laboratory Directed Research and Development (LDRD) program. Sandia National Laboratories is a multiprogram laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract DE-AC04-94AL85000. The disc chopper spectrometer at the NIST Center for Neutron Research (NCNR) that was used in this work is supported in part by the National Science Foundation under Grant DMR-1508249 as part of the Center for High Resolution Neutron Spectroscopy. This research was performed while J.D.T. held a National Research Council Research Associateship award at NIST. L.R.M. expresses gratitude to Philip J. Griffin and Edward B. Trigg at the University of Pennsylvania for helpful discussions. NR 46 TC 0 Z9 0 U1 11 U2 11 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0024-9297 EI 1520-5835 J9 MACROMOLECULES JI Macromolecules PD DEC 13 PY 2016 VL 49 IS 23 BP 9176 EP 9185 DI 10.1021/acs.macromol.6b01918 PG 10 WC Polymer Science SC Polymer Science GA EE8HJ UT WOS:000389866000039 ER PT J AU Ohno, PE Saslow, SA Wang, HF Geiger, FM Eisenthal, KB AF Ohno, Paul E. Saslow, Sarah A. Wang, Hong-fei Geiger, Franz M. Eisenthal, Kenneth B. TI Phase-referenced nonlinear spectroscopy of the alpha-quartz/water interface SO NATURE COMMUNICATIONS LA English DT Article ID SUM-FREQUENCY GENERATION; 2ND-HARMONIC GENERATION; ENVIRONMENTAL INTERFACES; WATER; PARTICLES; COMPLEX; POINTS; OXIDES; LIGHT AB Probing the polarization of water molecules at charged interfaces by second harmonic generation spectroscopy has been heretofore limited to isotropic materials. Here we report non-resonant nonlinear optical measurements at the interface of anisotropic z-cut alpha-quartz and water under conditions of dynamically changing ionic strength and bulk solution pH. We find that the product of the third-order susceptibility and the interfacial potential, chi((3)) x Phi(0), is given by (chi((3))(1) - i chi((3))(2)) x Phi(0), and that the interference between this product and the second-order susceptibility of bulk quartz depends on the rotation angle of alpha-quartz around the z axis. Our experiments show that this newly identified term, i chi((3)) x Phi(0), which is out of phase from the surface terms, is of bulk origin. The possibility of internally phase referencing the interfacial response for the interfacial orientation analysis of species or materials in contact with alpha-quartz is discussed along with the implications for conditions of resonance enhancement. C1 [Ohno, Paul E.; Saslow, Sarah A.; Geiger, Franz M.] Northwestern Univ, Dept Chem, Inst Technol, Room KG68,2145 Sheridan Rd, Evanston, IL 60208 USA. [Wang, Hong-fei] Pacific Northwest Natl Lab, Div Phys Sci, Phys & Computat Sci Directorate, Richland, WA 99352 USA. [Eisenthal, Kenneth B.] Columbia Univ, Dept Chem, New York, NY 10027 USA. [Saslow, Sarah A.] Pacific Northwest Natl Lab, Earth Syst Sci Div, Energy & Environm Directorate, Richland, WA 99352 USA. RP Geiger, FM (reprint author), Northwestern Univ, Dept Chem, Inst Technol, Room KG68,2145 Sheridan Rd, Evanston, IL 60208 USA. EM geigerf@chem.northwestern.edu RI Wang, Hongfei/B-1263-2010 OI Wang, Hongfei/0000-0001-8238-1641 FU U.S. National Science Foundation (NSF) under graduate fellowship research programme (GRFP); U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division; Materials Synthesis and Simulation Across Scales (MS3) Initiative through LDRD programme at Pacific Northwest National Laboratory (PNNL); Department of Energy by Battelle [DE-AC05-76RL01830]; NSF [CHE-1057483]; [CHE-1464916] FX Signal sensitivity analysis and measurement performed by P.E.O., S.A.S. and F.M.G. was supported by the U.S. National Science Foundation (NSF) under graduate fellowship research programme (GRFP) awards to P.E.O. and S.A.S., and award number CHE-1464916 to F.M.G. Method design/development by F.M.G. and S.A.S. was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division. H.F.W. was supported by the Materials Synthesis and Simulation Across Scales (MS3) Initiative through the LDRD programme at Pacific Northwest National Laboratory (PNNL). PNNL is a multi-programme national laboratory operated for Department of Energy by Battelle under Contract Number DE-AC05-76RL01830. K.B.E. gratefully acknowledges NSF award number CHE-1057483. NR 38 TC 0 Z9 0 U1 31 U2 31 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 13 PY 2016 VL 7 AR 13587 DI 10.1038/ncomms13587 PG 5 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE5DV UT WOS:000389626400001 PM 27958263 ER PT J AU Wilson, RM Hopple, AM Tfaily, MM Sebestyen, SD Schadt, CW Pfeifer-Meister, L Medvedeff, C McFarlane, KJ Kostka, JE Kolton, M Kolka, RK Kluber, LA Keller, JK Guilderson, TP Griffiths, NA Chanton, JP Bridgham, SD Hanson, PJ AF Wilson, R. M. Hopple, A. M. Tfaily, M. M. Sebestyen, S. D. Schadt, C. W. Pfeifer-Meister, L. Medvedeff, C. McFarlane, K. J. Kostka, J. E. Kolton, M. Kolka, R. K. Kluber, L. A. Keller, J. K. Guilderson, T. P. Griffiths, N. A. Chanton, J. P. Bridgham, S. D. Hanson, P. J. TI Stability of peatland carbon to rising temperatures SO NATURE COMMUNICATIONS LA English DT Article ID 16S RIBOSOMAL-RNA; MARCELL EXPERIMENTAL FOREST; POLYMERASE-CHAIN-REACTION; DISSOLVED ORGANIC-CARBON; METHANOGENIC ARCHAEA; PHENOL OXIDASE; CLIMATE SYSTEM; SOIL; CO2; ECOSYSTEM AB Peatlands contain one-third of soil carbon (C), mostly buried in deep, saturated anoxic zones (catotelm). The response of catotelm C to climate forcing is uncertain, because prior experiments have focused on surface warming. We show that deep peat heating of a 2 m-thick peat column results in an exponential increase in CH4 emissions. However, this response is due solely to surface processes and not degradation of catotelm peat. Incubations show that only the top 20-30 cm of peat from experimental plots have higher CH4 production rates at elevated temperatures. Radiocarbon analyses demonstrate that CH4 and CO2 are produced primarily from decomposition of surface-derived modern photosynthate, not catotelm C. There are no differences in microbial abundances, dissolved organic matter concentrations or degradative enzyme activities among treatments. These results suggest that although surface peat will respond to increasing temperature, the large reservoir of catotelm C is stable under current anoxic conditions. C1 [Wilson, R. M.; Chanton, J. P.] Florida State Univ, Earth Ocean & Atmospher Sci, 117 N Woodward Ave, Tallahassee, FL 32306 USA. [Hopple, A. M.; Pfeifer-Meister, L.; Bridgham, S. D.] Univ Oregon, Inst Ecol & Evolut, Eugene, OR 97403 USA. [Tfaily, M. M.] Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA 99354 USA. [Sebestyen, S. D.; Kolka, R. K.] US Forest Serv, USDA, Northern Res Stn, Grand Rapids, MN 55744 USA. [Schadt, C. W.; Kluber, L. A.; Griffiths, N. A.; Hanson, P. J.] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA. [Medvedeff, C.; Keller, J. K.] Chapman Univ, Schmid Coll Sci & Technol, Orange, CA 92866 USA. [McFarlane, K. J.; Guilderson, T. P.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Kostka, J. E.; Kolton, M.] Georgia Inst Technol, Sch Biol Sci, Atlanta, GA 30332 USA. [Kostka, J. E.; Kolton, M.] Georgia Inst Technol, Sch Earth & Atmospher Sci, Atlanta, GA 30332 USA. RP Wilson, RM (reprint author), Florida State Univ, Earth Ocean & Atmospher Sci, 117 N Woodward Ave, Tallahassee, FL 32306 USA. EM rmwilson@fsu.edu RI Sebestyen, Stephen/D-1238-2013; Hanson, Paul J./D-8069-2011; Schadt, Christopher/B-7143-2008; OI Sebestyen, Stephen/0000-0002-6315-0108; Hanson, Paul J./0000-0001-7293-3561; Schadt, Christopher/0000-0001-8759-2448; Kluber, Laurel/0000-0002-9302-9413 FU U.S. Department of Energy, Office of Science, Office of Biological and Environmental Research; U.S. Department of Energy [DE-AC05-00OR22725]; Office of Biological and Environmental Research, Terrestrial Ecosystem Science (TES) Program, U.S. Department of Energy [DE-SC0012088, DE-SC0008092] FX This material is based upon work supported by the U.S. Department of Energy, Office of Science, Office of Biological and Environmental Research. Oak Ridge National Laboratory is managed by UT-Battelle, LLC, for the U.S. Department of Energy. Funding was provided by the U.S. Department of Energy under contract number DE-AC05-00OR22725. Work conducted by J.E.K., M.K., J.P.C. and R.M.W. was supported by contract number DE-SC0012088, and by A.M.H., L.P.-M., C.M., J.K.K. and S.D.B. by contract DE-SC0008092 from the Office of Biological and Environmental Research, Terrestrial Ecosystem Science (TES) Program, U.S. Department of Energy. NR 62 TC 1 Z9 1 U1 56 U2 56 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 13 PY 2016 VL 7 AR 13723 DI 10.1038/ncomms13723 PG 10 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE5DZ UT WOS:000389626800001 PM 27958276 ER PT J AU Lei, H Bakera, NA Li, XT AF Lei, Huan Bakera, Nathan A. Li, Xiantao TI Data-driven parameterization of the generalized Langevin equation SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE generalized Langevin dynamics; data-driven parameterization; coarse-grained molecular models; reaction rate; model reduction ID DISSIPATIVE PARTICLE DYNAMICS; MOLECULAR-DYNAMICS; MEMORY KERNELS; MODEL; SIMULATIONS; POTENTIALS; TRANSPORT; PROTEINS; SURFACE; MOTION AB We present a data-driven approach to determine the memory kernel and random noise in generalized Langevin equations. To facilitate practical implementations, we parameterize the kernel function in the Laplace domain by a rational function, with coefficients directly linked to the equilibrium statistics of the coarse-grain variables. We show that such an approximation can be constructed to arbitrarily high order and the resulting generalized Langevin dynamics can be embedded in an extended stochastic model without explicit memory. We demonstrate how to introduce the stochastic noise so that the second fluctuation-dissipation theorem is exactly satisfied. Results from several numerical tests are presented to demonstrate the effectiveness of the proposed method. C1 [Lei, Huan; Bakera, Nathan A.] Pacific Northwest Natl Lab, Adv Comp Math & Data, Richland, WA 99352 USA. [Bakera, Nathan A.] Brown Univ, Div Appl Math, Providence, RI 02912 USA. [Li, Xiantao] Penn State Univ, Dept Math, University Pk, PA 16802 USA. RP Lei, H (reprint author), Pacific Northwest Natl Lab, Adv Comp Math & Data, Richland, WA 99352 USA. EM huan.lei@pnnl.gov FU US Department of Energy, Office of Science, Office of Advanced Scientific Computing Research as part of the Collaboratory on Mathematics for Mesoscopic Modeling of Materials (CM4) FX We thank George Karniadakis, Eric Darve, William Noid, Panos Stinis, Gregory Schenter, Lei Wu, Dave Sept, J. Andrew McCammon, and Zhen Li for informative discussions and advice and the two anonymous reviewers for very helpful suggestions. This work was supported by the US Department of Energy, Office of Science, Office of Advanced Scientific Computing Research as part of the Collaboratory on Mathematics for Mesoscopic Modeling of Materials (CM4). NR 47 TC 0 Z9 0 U1 3 U2 3 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 13 PY 2016 VL 113 IS 50 BP 14183 EP 14188 DI 10.1073/pnas.1609587113 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6CQ UT WOS:000389696700032 PM 27911787 ER PT J AU Chandrakar, KK Cantrell, W Chang, K Ciochetto, D Niedermeier, D Ovchinnikov, M Shaw, RA Yang, F AF Chandrakar, Kamal Kant Cantrell, Will Chang, Kelken Ciochetto, David Niedermeier, Dennis Ovchinnikov, Mikhail Shaw, Raymond A. Yang, Fan TI Aerosol indirect effect from turbulence-induced broadening of cloud-droplet size distributions SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE aerosol indirect effect; cloud-droplet size distribution; cloud-turbulence interactions ID CUMULUS CLOUDS; ENTRAINMENT; SUPERSATURATION; GROWTH; MICROPHYSICS; MODEL; SUSCEPTIBILITY; DEPENDENCE; DISPERSION; EQUATION AB The influence of aerosol concentration on the cloud-droplet size distribution is investigated in a laboratory chamber that enables turbulent cloud formation through moist convection. The experiments allow steady-state microphysics to be achieved, with aerosol input balanced by cloud-droplet growth and fallout. As aerosol concentration is increased, the cloud-droplet mean diameter decreases, as expected, but the width of the size distribution also decreases sharply. The aerosol input allows for cloud generation in the limiting regimes of fast microphysics (tau(c) < tau(t)) for high aerosol concentration, and slow microphysics (tau(c) > tau(t)) for low aerosol concentration; here, tau(c) is the phase-relaxation time and tau(t) is the turbulence-correlation time. The increase in the width of the droplet size distribution for the low aerosol limit is consistent with larger variability of supersaturation due to the slow microphysical response. A stochastic differential equation for supersaturation predicts that the standard deviation of the squared droplet radius should increase linearly with a system time scale defined as tau(-1)(s) = tau(-1)(c) + tau(-1)(t), and the measurements are in excellent agreement with this finding. The result underscores the importance of droplet size dispersion for aerosol indirect effects: increasing aerosol concentration changes the albedo and suppresses precipitation formation not only through reduction of the mean droplet diameter but also by narrowing of the droplet size distribution due to reduced supersaturation fluctuations. Supersaturation fluctuations in the low aerosol/slow microphysics limit are likely of leading importance for precipitation formation. C1 [Chandrakar, Kamal Kant; Cantrell, Will; Chang, Kelken; Ciochetto, David; Niedermeier, Dennis; Shaw, Raymond A.; Yang, Fan] Michigan Technol Univ, Dept Phys, Houghton, MI 49931 USA. [Chandrakar, Kamal Kant; Cantrell, Will; Chang, Kelken; Ciochetto, David; Niedermeier, Dennis; Shaw, Raymond A.; Yang, Fan] Michigan Technol Univ, Atmospher Sci Program, Houghton, MI 49931 USA. [Niedermeier, Dennis] Leibniz Inst Tropospher Res, D-04318 Leipzig, Germany. [Ovchinnikov, Mikhail] Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. RP Shaw, RA (reprint author), Michigan Technol Univ, Dept Phys, Houghton, MI 49931 USA.; Shaw, RA (reprint author), Michigan Technol Univ, Atmospher Sci Program, Houghton, MI 49931 USA. EM rashaw@mtu.edu OI Chandrakar, Kamal Kant/0000-0003-2970-3458 FU National Science Foundation [AGS-1623429]; Alexander von Humboldt Foundation; US Department of Energy (DOE) Office of Science, under the Atmospheric System Research Program; US DOE [DE-AC06-76RLO1830] FX We thank G. Feingold and two anonymous reviewers for helpful comments. This work was supported by National Science Foundation Grant AGS-1623429. D.N. thanks the Alexander von Humboldt Foundation for fellowship support. M.O. was supported, in part, by the US Department of Energy (DOE) Office of Science, under the Atmospheric System Research Program. The Pacific Northwest National Laboratory is operated by Battelle for the US DOE, under Contract DE-AC06-76RLO1830. Portage and Superior, high-performance computing clusters at Michigan Technological University, were used for the LES runs. NR 42 TC 0 Z9 0 U1 2 U2 2 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 13 PY 2016 VL 113 IS 50 BP 14243 EP 14248 DI 10.1073/pnas.1612686113 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6CQ UT WOS:000389696700042 PM 27911802 ER PT J AU McAndrew, RP Sathitsuksanoh, N Mbughuni, MM Heins, RA Pereira, JH George, A Sale, KL Fox, BG Simmons, BA Adams, PD AF McAndrew, Ryan P. Sathitsuksanoh, Noppadon Mbughuni, Michael M. Heins, Richard A. Pereira, Jose H. George, Anthe Sale, Kenneth L. Fox, Brian G. Simmons, Blake A. Adams, Paul D. TI Structure and mechanism of NOV1, a resveratrol-cleaving dioxygenase SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE stilbene; dioxygenase; structure; carotenoid ID PSEUDOMONAS-PAUCIMOBILIS TMY1009; STRUCTURE REFINEMENT; CAROTENOID CLEAVAGE; PROTEIN-STRUCTURE; CRYSTAL-STRUCTURE; ENZYME; OXYGENASE; MEMBRANE; MODEL; BACTERIA AB Stilbenes are diphenyl ethene compounds produced naturally in a wide variety of plant species and some bacteria. Stilbenes are also derived from lignin during kraft pulping. Stilbene cleavage oxygenases (SCOs) cleave the central double bond of stilbenes, forming two phenolic aldehydes. Here, we report the structure of an SCO. The X-ray structure of NOV1 from Novosphingobium aromaticivorans was determined in complex with its substrate resveratrol (1.89 angstrom), its product vanillin (1.75 angstrom), and without any bound ligand (1.61 angstrom). The enzyme is a seven-bladed beta-propeller with an iron cofactor coordinated by four histidines. In all three structures, dioxygen is observed bound to the iron in a side-on fashion. These structures, along with EPR analysis, allow us to propose a mechanism in which a ferric-superoxide reacts with substrate activated by deprotonation of a phenol group at position 4 of the substrate, which allows movement of electron density toward the central double bond and thus facilitates reaction with the ferric superoxide electrophile. Correspondingly, NOV1 cleaves a wide range of other stilbene-like compounds with a 4'-OH group, offering potential in processing some solubilized fragments of lignin into monomer aromatic compounds. C1 [McAndrew, Ryan P.; Sathitsuksanoh, Noppadon; Heins, Richard A.; Pereira, Jose H.; George, Anthe; Sale, Kenneth L.; Simmons, Blake A.; Adams, Paul D.] Joint BioEnergy Inst, Emeryville, CA 94608 USA. [McAndrew, Ryan P.; Sathitsuksanoh, Noppadon; Pereira, Jose H.; Adams, Paul D.] Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Bioimaging Div, Berkeley, CA 94720 USA. [Sathitsuksanoh, Noppadon] Univ Louisville, Dept Chem Engn, Louisville, KY 40292 USA. [Sathitsuksanoh, Noppadon] Univ Louisville, Conn Ctr Renewable Energy Res, Louisville, KY 40292 USA. [Mbughuni, Michael M.; Fox, Brian G.] Univ Wisconsin, Coll Agr & Life Sci, Dept Biochem, Madison, WI 53706 USA. [Mbughuni, Michael M.; Fox, Brian G.] Univ Wisconsin, Great Lakes Bioenergy Res Ctr, Madison, WI 53706 USA. [Heins, Richard A.; George, Anthe; Sale, Kenneth L.] Sandia Natl Labs, Biol & Engn Sci Ctr, Livermore, CA 94551 USA. [Simmons, Blake A.] Lawrence Berkeley Natl Lab, Biol Syst & Engn Div, Berkeley, CA 94720 USA. [Adams, Paul D.] Univ Calif Berkeley, Dept Bioengn, Berkeley, CA 94720 USA. RP McAndrew, RP; Adams, PD (reprint author), Joint BioEnergy Inst, Emeryville, CA 94608 USA.; McAndrew, RP; Adams, PD (reprint author), Lawrence Berkeley Natl Lab, Mol Biophys & Integrated Bioimaging Div, Berkeley, CA 94720 USA.; Adams, PD (reprint author), Univ Calif Berkeley, Dept Bioengn, Berkeley, CA 94720 USA. EM rpmcandrew@lbl.gov; PDAdams@lbl.gov FU US Department of Energy, Office of Science, Office of Biological and Environmental Research [DE-AC02-05CH11231, DE-FG02-07ER64495]; National Institutes of Health, National Institute of General Medical Sciences; US Department of Energy [DE-AC02-05CH11231]; National Science Foundation [1355438] FX We thank the staff of the Berkeley Center for Structural Biology at the Advanced Light Source of Lawrence Berkeley National Laboratory. This work was performed as a collaboration between the Joint BioEnergy Institute (https://www.jbei.org/) and the Great Lakes Bioenergy Research Center (https://www.glbrc.org/). The Joint BioEnergy Institute is supported by the US Department of Energy, Office of Science, Office of Biological and Environmental Research, through contract DE-AC02-05CH11231 between Lawrence Berkeley National Laboratory and the US Department of Energy. The Great Lakes Bioenergy Research Center is supported by the US Department of Energy, Office of Science, Office of Biological and Environmental Research, through Grant DE-FG02-07ER64495. The Berkeley Center for Structural Biology is supported in part by the National Institutes of Health, National Institute of General Medical Sciences. The Advanced Light Source is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the US Department of Energy under Contract DE-AC02-05CH11231. A part of this work was supported by the National Science Foundation under Cooperative Agreement 1355438. NR 42 TC 0 Z9 0 U1 10 U2 10 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 13 PY 2016 VL 113 IS 50 BP 14324 EP 14329 DI 10.1073/pnas.1608917113 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6CQ UT WOS:000389696700056 PM 27911781 ER PT J AU Hoch, LB Szymanski, P Ghuman, KK He, L Liao, K Qiao, Q Reyes, LM Zhu, YM El-Sayed, MA Singh, CV Ozin, GA AF Hoch, Laura B. Szymanski, Paul Ghuman, Kulbir Kaur He, Le Liao, Kristine Qiao, Qiao Reyes, Laura M. Zhu, Yimei El-Sayed, Mostafa A. Singh, Chandra Veer Ozin, Geoffrey A. TI Carrier dynamics and the role of surface defects: Designing a photocatalyst for gas-phase CO2 reduction SO PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA LA English DT Article DE indium oxide; solar fuels; CO2 hydrogenation; transient absorption; surface defects ID TRANSIENT ABSORPTION-SPECTROSCOPY; NANOCRYSTALLINE TIO2 FILMS; ARTIFICIAL PHOTOSYNTHESIS; CARBON-DIOXIDE; THIN-FILMS; FUELS; NANOPARTICLES; ELECTRON; ENERGY; IN2O3-X(OH)(Y) AB In2O3-x(OH)(y) nanoparticles have been shown to function as an effective gas-phase photocatalyst for the reduction of CO2 to CO via the reverse water-gas shift reaction. Their photocatalytic activity is strongly correlated to the number of oxygen vacancy and hydroxide defects present in the system. To better understand how such defects interact with photogenerated electrons and holes in these materials, we have studied the relaxation dynamics of In2O3-x(OH)(y) nanoparticles with varying concentration of defects using two different excitation energies corresponding to above-band-gap (318-nm) and near-band-gap (405-nm) excitations. Our results demonstrate that defects play a significant role in the excited-state, charge relaxation pathways. Higher defect concentrations result in longer excited-state lifetimes, which are attributed to improved charge separation. This correlates well with the observed trends in the photocatalytic activity. These results are further supported by density-functional theory calculations, which confirm the positions of oxygen vacancy and hydroxide defect states within the optical band gap of indium oxide. This enhanced understanding of the role these defects play in determining the optoelectronic properties and charge carrier dynamics can provide valuable insight toward the rational development of more efficient photocatalytic materials for CO2 reduction. C1 [Hoch, Laura B.; He, Le; Liao, Kristine; Reyes, Laura M.; Ozin, Geoffrey A.] Univ Toronto, Dept Chem, Toronto, ON M5S 3H6, Canada. [Szymanski, Paul; El-Sayed, Mostafa A.] Georgia Inst Technol, Sch Chem & Biochem, Laser Dynam Lab, Atlanta, GA 30332 USA. [Ghuman, Kulbir Kaur; Singh, Chandra Veer] Univ Toronto, Dept Mat Sci & Engn, Toronto, ON M5S 3E4, Canada. [Qiao, Qiao; Zhu, Yimei] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Qiao, Qiao] Temple Univ, Dept Phys, Philadelphia, PA 19122 USA. [Singh, Chandra Veer] Univ Toronto, Dept Mech & Ind Engn, Toronto, ON M5S 3G8, Canada. RP Ozin, GA (reprint author), Univ Toronto, Dept Chem, Toronto, ON M5S 3H6, Canada.; Singh, CV (reprint author), Univ Toronto, Dept Mat Sci & Engn, Toronto, ON M5S 3E4, Canada.; Singh, CV (reprint author), Univ Toronto, Dept Mech & Ind Engn, Toronto, ON M5S 3G8, Canada. EM chandraveer.singh@utoronto.ca; gozin@chem.utoronto.ca RI He, Le/D-7167-2011 OI He, Le/0000-0002-4520-0482 FU Ontario Ministry of Research Innovation; Ministry of Economic Development, Employment and Infrastructure; Ministry of the Environment and Climate Change; Connaught Innovation Fund; Connaught Global Challenge Fund; Natural Sciences and Engineering Research Council of Canada; US National Science Foundation, Division of Chemistry [1608801]; Center for the Computational Design of Functional Layered Materials (CCDM), an Energy Frontier Research Center (EFRC) - US Department of Energy - Basic Energy Sciences (US DOE-BES) [DE-SC0012575]; DOE-BES, Materials Science and Engineering Division [DE-SC0012704] FX C.V.S. gratefully acknowledges SciNet (58) and Calcul Quebec consortia under the auspices of Compute Canada for computational resources. G.A.O. is a Government of Canada Research Chair in Materials Chemistry and Nanochemistry. Financial support for this work was provided by the Ontario Ministry of Research Innovation; Ministry of Economic Development, Employment and Infrastructure; Ministry of the Environment and Climate Change; Connaught Innovation Fund; Connaught Global Challenge Fund; and the Natural Sciences and Engineering Research Council of Canada. P.S. and M.A.E.-S. acknowledge the funding from the US National Science Foundation, Division of Chemistry (Grant 1608801). Q.Q. was supported by the Center for the Computational Design of Functional Layered Materials (CCDM), an Energy Frontier Research Center (EFRC) funded by the US Department of Energy - Basic Energy Sciences (US DOE-BES) (DE-SC0012575) for her TEM work, and Y.Z. was supported by DOE-BES, Materials Science and Engineering Division (DE-SC0012704). NR 58 TC 0 Z9 0 U1 31 U2 31 PU NATL ACAD SCIENCES PI WASHINGTON PA 2101 CONSTITUTION AVE NW, WASHINGTON, DC 20418 USA SN 0027-8424 J9 P NATL ACAD SCI USA JI Proc. Natl. Acad. Sci. U. S. A. PD DEC 13 PY 2016 VL 113 IS 50 BP E8011 EP E8020 DI 10.1073/pnas.1609374113 PG 10 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6CQ UT WOS:000389696700003 PM 27911785 ER PT J AU Hu, ML Zhang, HM Liu, Q Hao, Q AF Hu, Menglong Zhang, Hongmin Liu, Qun Hao, Quan TI Structural Basis for Human PECAM-1-Mediated Trans-homophilic Cell Adhesion SO SCIENTIFIC REPORTS LA English DT Article ID TRANSENDOTHELIAL MIGRATION; HEMOPHILIC BINDING; COUNTER-RECEPTOR; PECAM-1; PLATELET; MOLECULE; CD31; ROLES; PERMEABILITY; INFLAMMATION AB Cell adhesion involved in signal transduction, tissue integrity and pathogen infection is mainly mediated by cell adhesion molecules (CAM). One CAM member, platelet-endothelial-cell adhesion molecule-1 (PECAM-1), plays an important role in tight junction among endothelia cells, leukocyte trafficking, and immune response through its homophilic and heterophilic binding patterns. Both kinds of interactions, which lead to endogenous and exogenous signal transmission, are derived from extracellular immunoglobulin-like (IgL) domains and cytoplasmic immunoreceptor tyrosinebased inhibitory motifs (ITIMs) of PECAM-1. To date, the mechanism of trans-homophilic interaction of PECAM-1 remains unclear. Here, we present the crystal structure of PECAM-1 IgL1-2 trans-homo dimer. Both IgL 1 and 2 adopt the classical Ig domain conformation comprised of two layers of beta-sheets possessing antiparallel beta-strands with each being anchored by a pair of cysteines forming a disulfide bond. The dimer interface includes hydrophobic and hydrophilic interactions. The Small-Angle X-ray Scattering (SAXS) envelope of PECAM-1 IgL1-6 supported such a dimer formation in solution. Cell adhesion assays on wildtype and mutant PECAM-1 further characterized the structural determinants in cell junction and communication. C1 [Hu, Menglong; Hao, Quan] Univ Hong Kong, Sch Biomed Sci, Lab Block,21 Sassoon Rd, Pokfulam, Hong Kong, Peoples R China. [Zhang, Hongmin] Southern Univ Sci & Technol, Dept Biol, Shenzhen 518055, Peoples R China. [Zhang, Hongmin] Southern Univ Sci & Technol, Shenzhen Key Lab Cell Microenvironm, Shenzhen 518055, Peoples R China. [Liu, Qun] Brookhaven Natl Lab, Dept Biol, Upton, NY 11973 USA. RP Hao, Q (reprint author), Univ Hong Kong, Sch Biomed Sci, Lab Block,21 Sassoon Rd, Pokfulam, Hong Kong, Peoples R China. EM qhao@hku.hk FU HK-RGC [766412] FX The work was support by HK-RGC grant 766412. The X-ray diffraction and SAXS data were collected at the Shanghai Synchrotron Radiation Facility beamlines 17U and 19U2. NR 35 TC 0 Z9 0 U1 2 U2 2 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 13 PY 2016 VL 6 AR 38655 DI 10.1038/srep38655 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE5VO UT WOS:000389676100001 PM 27958302 ER PT J AU Larsson, DH Vagberg, W Yaroshenko, A Yildirim, AO Hertz, HM AF Larsson, Daniel H. Vagberg, William Yaroshenko, Andre Yildirim, Ali Oender Hertz, Hans M. TI High-resolution short- exposure small-animal laboratory x-ray phase-contrast tomography SO SCIENTIFIC REPORTS LA English DT Article ID FUTURE-PROSPECTS; MICRO-CT; ANGIOGRAPHY; HISTOLOGY; IMPACT AB X-ray computed tomography of small animals and their organs is an essential tool in basic and preclinical biomedical research. In both phase-contrast and absorption tomography high spatial resolution and short exposure times are of key importance. However, the observable spatial resolutions and achievable exposure times are presently limited by system parameters rather than more fundamental constraints like, e.g., dose. Here we demonstrate laboratory tomography with few-ten mu m spatial resolution and few-minute exposure time at an acceptable dose for small-animal imaging, both with absorption contrast and phase contrast. The method relies on a magnifying imaging scheme in combination with a high-power small-spot liquid-metal-jet electron-impact source. The tomographic imaging is demonstrated on intact mouse, phantoms and excised lungs, both healthy and with pulmonary emphysema. C1 [Larsson, Daniel H.; Vagberg, William; Hertz, Hans M.] KTH Royal Inst Technol Albanova, Dept Appl Phys, S-10691 Stockholm, Sweden. [Yaroshenko, Andre] Tech Univ Munich, Phys Dept, Garching, Germany. [Yaroshenko, Andre] Tech Univ Munich, Inst Medizintech, Garching, Germany. [Yildirim, Ali Oender] Helmholtz Zentrum Munchen, Inst Lung Biol & Dis, German Ctr Lung Res DZL, Neuherberg, Germany. [Larsson, Daniel H.] Stanford Univ, SLAC, Photon Sci, Stanford, CA 94305 USA. RP Hertz, HM (reprint author), KTH Royal Inst Technol Albanova, Dept Appl Phys, S-10691 Stockholm, Sweden. EM hertz@biox.kth.se FU Swedish Research Council; Wallenberg Foundation FX The authors thank the Excillum team for prototype source design and support, Marie Arsenian Henriksson for supplying the mouse, Carmen Vogt for preparing the mouse, Ulf Lundstrom for fruitful discussions, and Franz Pfeiffer for initial support. This work was financed by the Swedish Research Council and the Wallenberg Foundation. NR 37 TC 0 Z9 0 U1 9 U2 9 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 13 PY 2016 VL 6 AR 39074 DI 10.1038/srep39074 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE5FS UT WOS:000389631500001 PM 27958376 ER PT J AU Hong, F Yue, BB Hirao, N Ren, GH Chen, B Mao, HK AF Hong, Fang Yue, Binbin Hirao, Naohisa Ren, Guohao Chen, Bin Mao, Ho-Kwang TI Pressure-induced isostructural transition in a distorted perovskite via octahedron reconfiguration SO APPLIED PHYSICS LETTERS LA English DT Article ID RARE-EARTH ORTHOFERRITES; PHASE-TRANSITION; VOLUME COLLAPSE; YALO3; STISHOVITE; METEORITE; CRYSTALS AB Perovskite material studies encompass many fields such as energy harvesting, superconductivity, magnetism, and beyond. Thus, it is very important to investigate their structural varieties in external environments. Here, the pressure-induced structure change of a distorted perovskite, Y0.7Lu0.3AlO3, was examined by synchrotron x-ray diffraction. Upon compression, it underwent an isostructural transition near 22 GPa. The quenchable high-pressure phase had a much higher bulk modulus than the low-pressure phase. This work shows the flexibility of perovskite distortion and will help to understand the property anomalies in prevailing perovskite ABO(3) systems and design more functional materials. Published by AIP Publishing. C1 [Hong, Fang; Yue, Binbin; Chen, Bin; Mao, Ho-Kwang] Ctr High Pressure Sci & Technol Adv Res, 1690 Cailun Rd Pudong, Shanghai 201203, Peoples R China. [Hong, Fang; Yue, Binbin] Lawrence Berkeley Natl Lab, Adv Light Source, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Hirao, Naohisa] SPring 8 JASRI, 1-1-1 Kouto, Sayo, Hyogo 6795198, Japan. [Ren, Guohao] Chinese Acad Sci, Shanghai Inst Ceram, 215 Chengbei Rd, Shanghai 201800, Peoples R China. [Mao, Ho-Kwang] Carnegie Inst Sci, Geophys Lab, 5251 Broad Branch Rd NW, Washington, DC 20015 USA. RP Yue, BB; Chen, B (reprint author), Ctr High Pressure Sci & Technol Adv Res, 1690 Cailun Rd Pudong, Shanghai 201203, Peoples R China.; Yue, BB (reprint author), Lawrence Berkeley Natl Lab, Adv Light Source, 1 Cyclotron Rd, Berkeley, CA 94720 USA. EM yuebb@hpstar.ac.cn; chenbin@hpstar.ac.cn RI Yue, Binbin/K-2399-2016; HONG, Fang/C-6070-2014 OI Yue, Binbin/0000-0002-7784-2850; HONG, Fang/0000-0003-0060-2063 FU NSAF [U1530402] FX The authors acknowledge support from the NSAF (Grant No. U1530402). F.H. and B.B.Y. acknowledge the usage of beam time at Beamline 10XU in Spring-8 (PN: 2014B1254). All authors thank Freyja O'Toole for her careful revision of the manuscript. NR 43 TC 0 Z9 0 U1 4 U2 4 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0003-6951 EI 1077-3118 J9 APPL PHYS LETT JI Appl. Phys. Lett. PD DEC 12 PY 2016 VL 109 IS 24 AR 241904 DI 10.1063/1.4972303 PG 4 WC Physics, Applied SC Physics GA EH0MF UT WOS:000391457500013 ER PT J AU Kline, JL Yi, SA Simakov, AN Olson, RE Wilson, DC Kyrala, GA Perry, TS Batha, SH Dewald, EL Ralph, JE Strozzi, DJ MacPhee, AG Callahan, DA Hinkel, D Hurricane, OA Leeper, RJ Zylstra, AB Peterson, RR Haines, BM Yin, L Bradley, PA Shah, RC Braun, T Biener, J Kozioziemski, BJ Sater, JD Biener, MM Hamza, AV Nikroo, A Hopkins, LFB Ho, D LePape, S Meezan, NB Montgomery, DS Daughton, WS Merritt, EC Cardenas, T Dodd, ES AF Kline, J. L. Yi, S. A. Simakov, A. N. Olson, R. E. Wilson, D. C. Kyrala, G. A. Perry, T. S. Batha, S. H. Dewald, E. L. Ralph, J. E. Strozzi, D. J. MacPhee, A. G. Callahan, D. A. Hinkel, D. Hurricane, O. A. Leeper, R. J. Zylstra, A. B. Peterson, R. R. Haines, B. M. Yin, L. Bradley, P. A. Shah, R. C. Braun, T. Biener, J. Kozioziemski, B. J. Sater, J. D. Biener, M. M. Hamza, A. V. Nikroo, A. Hopkins, L. F. Berzak Ho, D. LePape, S. Meezan, N. B. Montgomery, D. S. Daughton, W. S. Merritt, E. C. Cardenas, T. Dodd, E. S. TI Developing one-dimensional implosions for inertial confinement fusion science SO HIGH POWER LASER SCIENCE AND ENGINEERING LA English DT Article DE beryllium capsules; double shells; inertial confinement fusion; liquid layers ID NATIONAL IGNITION FACILITY; CAPSULES AB Experiments on the National Ignition Facility show that multi-dimensional effects currently dominate the implosion performance. Low mode implosion symmetry and hydrodynamic instabilities seeded by capsule mounting features appear to be two key limiting factors for implosion performance. One reason these factors have a large impact on the performance of inertial confinement fusion implosions is the high convergence required to achieve high fusion gains. To tackle these problems, a predictable implosion platform is needed meaning experiments must trade-off high gain for performance. LANL has adopted three main approaches to develop a one-dimensional (1D) implosion platform where 1D means measured yield over the 1D clean calculation. A high adiabat, low convergence platform is being developed using beryllium capsules enabling larger case-to-capsule ratios to improve symmetry. The second approach is liquid fuel layers using wetted foam targets. With liquid fuel layers, the implosion convergence can be controlled via the initial vapor pressure set by the target fielding temperature. The last method is double shell targets. For double shells, the smaller inner shell houses the DT fuel and the convergence of this cavity is relatively small compared to hot spot ignition. However, double shell targets have a different set of trade-off versus advantages. Details for each of these approaches are described. C1 [Kline, J. L.; Yi, S. A.; Simakov, A. N.; Olson, R. E.; Wilson, D. C.; Kyrala, G. A.; Perry, T. S.; Batha, S. H.; Leeper, R. J.; Zylstra, A. B.; Peterson, R. R.; Haines, B. M.; Yin, L.; Bradley, P. A.; Shah, R. C.; Montgomery, D. S.; Daughton, W. S.; Merritt, E. C.; Cardenas, T.; Dodd, E. S.] Los Alamos Natl Lab, Los Alamos, NM USA. [Dewald, E. L.; Ralph, J. E.; Strozzi, D. J.; MacPhee, A. G.; Callahan, D. A.; Hinkel, D.; Hurricane, O. A.; Braun, T.; Biener, J.; Kozioziemski, B. J.; Sater, J. D.; Biener, M. M.; Hamza, A. V.; Nikroo, A.; Hopkins, L. F. Berzak; Ho, D.; LePape, S.; Meezan, N. B.] Lawrence Livermore Natl Lab, Livermore, CA USA. RP Kline, JL (reprint author), MS E526,POB 1663, Los Alamos, NM 87545 USA. EM jkline@lanl.gov FU US Department of Energy by LANL [DE-AC52-06NA25396]; US Department of Energy by LLNL [DE-AC5 2-07NA27344] FX The authors wish to thank the General Atomics and LLNL target fabrication for their development of the beryllium capsules currently being used. They also wish to thank the NIF cryogenics team and target fabrication for development of the liquid layer capsules and efforts to field the first target experiment. This work was performed under the auspices of the US Department of Energy by LANL under Contract DE-AC52-06NA25396 and by LLNL under Contract DE-AC5 2-07NA27344. NR 31 TC 0 Z9 0 U1 5 U2 5 PU CAMBRIDGE UNIV PRESS PI CAMBRIDGE PA EDINBURGH BLDG, SHAFTESBURY RD, CB2 8RU CAMBRIDGE, ENGLAND SN 2095-4719 EI 2052-3289 J9 HIGH POWER LASER SCI JI High Power Laser Sci. Eng. PD DEC 12 PY 2016 VL 4 AR e44 DI 10.1017/hpl.2016.43 PG 7 WC Optics SC Optics GA EG5UP UT WOS:000391110400001 ER PT J AU Saunois, M Bousquet, P Poulter, B Peregon, A Ciais, P Canadell, JG Dlugokencky, EJ Etiope, G Bastviken, D Houweling, S Janssens-Maenhout, G Tubiello, FN Castaldi, S Jackson, RB Alexe, M Arora, VK Beerling, DJ Bergamaschi, P Blake, DR Brailsford, G Brovkin, V Bruhwiler, L Crevoisier, C Crill, P Covey, K Curry, C Frankenberg, C Gedney, N Hoglund-Isaksson, L Ishizawa, M Ito, A Joos, F Kim, HS Kleinen, T Krummel, P Lamarque, JF Langenfelds, R Locatelli, R Machida, T Maksyutov, S McDonald, KC Marshall, J Melton, JR Morino, I Naik, V O'Doherty, S Parmentier, FJW Patra, PK Peng, CH Peng, SS Peters, GP Pison, I Prigent, C Prinn, R Ramonet, M Riley, WJ Saito, M Santini, M Schroeder, R Simpson, IJ Spahni, R Steele, P Takizawa, A Thornton, BF Tian, HQ Tohjima, Y Viovy, N Voulgarakis, A van Weele, M van der Werf, GR Weiss, R Wiedinmyer, C Wilton, DJ Wiltshire, A Worthy, D Wunch, D Xu, XY Yoshida, Y Zhang, B Zhang, Z Zhu, Q AF Saunois, Marielle Bousquet, Philippe Poulter, Ben Peregon, Anna Ciais, Philippe Canadell, Josep G. Dlugokencky, Edward J. Etiope, Giuseppe Bastviken, David Houweling, Sander Janssens-Maenhout, Greet Tubiello, Francesco N. Castaldi, Simona Jackson, Robert B. Alexe, Mihai Arora, Vivek K. Beerling, David J. Bergamaschi, Peter Blake, Donald R. Brailsford, Gordon Brovkin, Victor Bruhwiler, Lori Crevoisier, Cyril Crill, Patrick Covey, Kristofer Curry, Charles Frankenberg, Christian Gedney, Nicola Hoeglund-Isaksson, Lena Ishizawa, Misa Ito, Akihiko Joos, Fortunat Kim, Heon-Sook Kleinen, Thomas Krummel, Paul Lamarque, Jean-Francois Langenfelds, Ray Locatelli, Robin Machida, Toshinobu Maksyutov, Shamil McDonald, Kyle C. Marshall, Julia Melton, Joe R. Morino, Isamu Naik, Vaishali O'Doherty, Simon Parmentier, Frans-Jan W. Patra, Prabir K. Peng, Changhui Peng, Shushi Peters, Glen P. Pison, Isabelle Prigent, Catherine Prinn, Ronald Ramonet, Michel Riley, William J. Saito, Makoto Santini, Monia Schroeder, Ronny Simpson, Isobel J. Spahni, Renato Steele, Paul Takizawa, Atsushi Thornton, Brett F. Tian, Hanqin Tohjima, Yasunori Viovy, Nicolas Voulgarakis, Apostolos van Weele, Michiel van der Werf, Guido R. Weiss, Ray Wiedinmyer, Christine Wilton, David J. Wiltshire, Andy Worthy, Doug Wunch, Debra Xu, Xiyan Yoshida, Yukio Zhang, Bowen Zhang, Zhen Zhu, Qiuan TI The global methane budget 2000-2012 SO EARTH SYSTEM SCIENCE DATA LA English DT Article ID PROCESS-BASED MODEL; INTERCOMPARISON PROJECT ACCMIP; ATMOSPHERIC HYDROXYL RADICALS; BIOMASS BURNING EMISSIONS; GREENHOUSE-GAS EMISSIONS; PAST 2 DECADES; NATURAL-GAS; TRACE GASES; TROPOSPHERIC METHANE; ISOTOPIC COMPOSITION AB The global methane (CH4) budget is becoming an increasingly important component for managing realistic pathways to mitigate climate change. This relevance, due to a shorter atmospheric lifetime and a stronger warming potential than carbon dioxide, is challenged by the still unexplained changes of atmospheric CH4 over the past decade. Emissions and concentrations of CH4 are continuing to increase, making CH4 the second most important human-induced greenhouse gas after carbon dioxide. Two major difficulties in reducing uncertainties come from the large variety of diffusive CH4 sources that overlap geographically, and from the destruction of CH4 by the very short-lived hydroxyl radical (OH). To address these difficulties, we have established a consortium of multi-disciplinary scientists under the umbrella of the Global Carbon Project to synthesize and stimulate research on the methane cycle, and producing regular (similar to biennial) updates of the global methane budget. This consortium includes atmospheric physicists and chemists, biogeochemists of surface and marine emissions, and socio-economists who study anthropogenic emissions. Following Kirschke et al. (2013), we propose here the first version of a living review paper that integrates results of top-down studies (exploiting atmospheric observations within an atmospheric inverse-modelling framework) and bottom-up models, inventories and data-driven approaches (including process-based models for estimating land surface emissions and atmospheric chemistry, and inventories for anthropogenic emissions, data-driven extrapolations). For the 2003-2012 decade, global methane emissions are estimated by top-down inversions at 558 TgCH(4) yr(-1), range 540-568. About 60% of global emissions are anthropogenic (range 50-65 %). Since 2010, the bottom-up global emission inventories have been closer to methane emissions in the most carbon-intensive Representative Concentrations Pathway (RCP8.5) and higher than all other RCP scenarios. Bottom-up approaches suggest larger global emissions (736 TgCH(4) yr(-1), range 596-884) mostly because of larger natural emissions from individual sources such as inland waters, natural wetlands and geological sources. Considering the atmospheric constraints on the top-down budget, it is likely that some of the individual emissions reported by the bottom-up approaches are overestimated, leading to too large global emissions. Latitudinal data from top-down emissions indicate a predominance of tropical emissions (similar to 64% of the global budget, <30 degrees N) as compared to mid (similar to 32 %, 30-60 degrees N) and high northern latitudes (similar to 4 %, 60-90 degrees N). Top-down inversions consistently infer lower emissions in China (similar to 58 TgCH(4) yr(-1), range 51-72, -14 %) and higher emissions in Africa (86 TgCH(4) yr(-1), range 73-108, + 19 %) than bottom-up values used as prior estimates. Overall, uncertainties for anthropogenic emissions appear smaller than those from natural sources, and the uncertainties on source categories appear larger for top-down inversions than for bottom-up inventories and models. The most important source of uncertainty on the methane budget is attributable to emissions from wetland and other inland waters. We show that the wetland extent could contribute 30-40% on the estimated range for wetland emissions. Other priorities for improving the methane budget include the following: (i) the development of process-based models for inland-water emissions, (ii) the intensification of methane observations at local scale (flux measurements) to constrain bottom-up land surface models, and at regional scale (surface networks and satellites) to constrain top-down inversions, (iii) improvements in the estimation of atmospheric loss by OH, and (iv) improvements of the transport models integrated in top-down inversions. The data presented here can be downloaded from the Carbon Dioxide Information Analysis Center (http://doi.org/10.3334/CDIAC/GLOBAL_METHANE_BUDGET_2016_V1.1) and the Global Carbon Project. C1 [Saunois, Marielle; Bousquet, Philippe; Peregon, Anna; Ciais, Philippe; Locatelli, Robin; Peng, Shushi; Pison, Isabelle; Ramonet, Michel; Viovy, Nicolas] Univ Paris Saclay, LSCE IPSL CEA CNRS UVSQ, Lab Sci Climat & Environm, F-91191 Gif Sur Yvette, France. [Poulter, Ben; Zhang, Zhen] NASA, Goddard Space Flight Ctr, Biospher Sci Lab, Greenbelt, MD 20771 USA. [Canadell, Josep G.] CSIRO Oceans & Atmosphere, Global Carbon Project, Canberra, ACT 2601, Australia. [Dlugokencky, Edward J.; Bruhwiler, Lori] NOAA ESRL, 325 Broadway, Boulder, CO 80305 USA. [Etiope, Giuseppe] Ist Nazl Geofis & Vulcanol, Sez Roma 2, Via V Murata 605, I-00143 Rome, Italy. [Bastviken, David] Linkoping Univ, Dept Themat Studies Environm Change, S-58183 Linkoping, Sweden. [Houweling, Sander] SRON, Netherlands Inst Space Res, Sorbonnelaan 2, NL-3584 CA Utrecht, Netherlands. [Houweling, Sander] Inst Marine & Atmospher Res, Sorbonnelaan 2, NL-3584 CA Utrecht, Netherlands. [Janssens-Maenhout, Greet; Alexe, Mihai; Bergamaschi, Peter] European Commiss Joint Res Ctr, Ispra, VA, Italy. [Tubiello, Francesco N.] Food & Agr Org United Nations FAO, Stat Div, Viale Terme Caracalla, I-00153 Rome, Italy. [Castaldi, Simona] Seconda Univ Napoli, Dipartimento Sci Ambientali Biol & Farmaceut, Via Vivaldi 43, I-81100 Caserta, Italy. [Castaldi, Simona] FEFU, Vladivostok, Russky Island, Russia. [Castaldi, Simona; Santini, Monia] Euromediterranean Ctr Climate Change, Via Augusto Imperatore 16, I-73100 Lecce, Italy. [Jackson, Robert B.] Stanford Univ, Sch Earth Energy & Environm Sci, Stanford, CA 94305 USA. [Arora, Vivek K.] Environm & Climate Change Canada, Div Climate Res, Canadian Ctr Climate Modelling & Anal, Victoria, BC V8W 2Y2, Canada. [Beerling, David J.; Wilton, David J.] Univ Sheffield, Dept Anim & Plant Sci, Sheffield S10 2TN, S Yorkshire, England. [Blake, Donald R.; Simpson, Isobel J.] Univ Calif Irvine, Dept Chem, 570 Rowland Hall, Irvine, CA 92697 USA. [Brailsford, Gordon] Natl Inst Water & Atmospher Res, 301 Evans Bay Parade, Wellington, New Zealand. [Brovkin, Victor; Kleinen, Thomas] Max Planck Inst Meteorol, Bundesstr 53, D-20146 Hamburg, Germany. [Crevoisier, Cyril] Ecole Polytech, LMD IPSL, Meteorol Dynam Lab, F-91120 Palaiseau, France. Dept Geol Sci, Svante Arrhenius Vag 8, S-10691 Stockholm, Sweden. [Crill, Patrick; Thornton, Brett F.] Bolin Ctr Climate Res, Svante Arrhenius Vag 8, S-10691 Stockholm, Sweden. [Covey, Kristofer] Yale Univ, Sch Forestry & Environm Studies, New Haven, CT 06511 USA. [Curry, Charles] Univ Victoria, Sch Earth & Ocean Sci, POB 1700 STN CSC, Victoria, BC V8W 2Y2, Canada. [Frankenberg, Christian] Jet Prop Lab, M-S 183-601,4800 Oak Grove Dr, Pasadena, CA 91109 USA. [Gedney, Nicola; Morino, Isamu] Joint Ctr Hydrometeorol Res, Met Off Hadley Ctr, Maclean Bldg, Wallingford OX10 8BB, Oxon, England. [Hoeglund-Isaksson, Lena] Int Inst Appl Syst Anal, Air Qual & Greenhouse Gases Program AIR, A-2361 Laxenburg, Austria. Natl Inst Environm Studies, Ctr Global Environm Res, Onogawa 16-2, Tsukuba, Ibaraki 3058506, Japan. [Joos, Fortunat; Spahni, Renato] Univ Bern, Inst Phys, Climate & Environm Phys, Sidlerstr 5, CH-3012 Bern, Switzerland. [Joos, Fortunat; Spahni, Renato] Univ Bern, Oeschger Ctr Climate Change Res, Sidlerstr 5, CH-3012 Bern, Switzerland. [Krummel, Paul; Langenfelds, Ray; Steele, Paul] CSIRO, Oceans & Atmosphere, Aspendale, Vic 3195, Australia. [Lamarque, Jean-Francois; Wiedinmyer, Christine] NCAR, POB 3000, Boulder, CO 80307 USA. [McDonald, Kyle C.; Schroeder, Ronny] CUNY, Dept Earth & Atmospher Sci, New York, NY 10031 USA. [Marshall, Julia] Max Planck Inst Biogeochem, Hans Knoll Str 10, D-07745 Jena, Germany. [Melton, Joe R.] Environm & Climate Change Canada, Div Climate Res, Victoria, BC V8W 2Y2, Canada. [Naik, Vaishali] NOAA, GFDL, 201 Forrestal Rd, Princeton, NJ 08540 USA. [O'Doherty, Simon] Univ Bristol, Sch Chem, Cantocks Close, Bristol BS8 1TS, Avon, England. [Parmentier, Frans-Jan W.] Lund Univ, Dept Phys Geog & Ecosyst Sci, Solvegatan 12, S-22362 Lund, Sweden. [Patra, Prabir K.] JAMSTEC, Dept Environm Geochem Cycle Res, Kanazawa Ku, 3173-25 Showa Machi, Yokohama, Kanagawa 2360001, Japan. [Peng, Changhui] Univ Quebec, Inst Environm Sci, Dept Biol Sci, Montreal, PQ H3C 3P8, Canada. [Peters, Glen P.] CICERO, Pb 1129 Blindern, N-0318 Oslo, Norway. [Prigent, Catherine] Observ Paris, CNRS, LERMA, 61 Ave Observ, F-75014 Paris, France. [Prinn, Ronald] MIT, Dept Earth Atmospher & Planetary Sci, Bldg 54-1312, Cambridge, MA 02139 USA. [Riley, William J.; Xu, Xiyan] Lawrence Berkeley Natl Lab, Div Earth Sci, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Schroeder, Ronny] Univ Hohenheim, Inst Bot, D-70593 Stuttgart, Germany. [Takizawa, Atsushi] JMA, Chiyoda Ku, 1-3-4 Otemachi, Tokyo 1008122, Japan. [Tian, Hanqin; Zhang, Bowen] Auburn Univ, Sch Forestry & Wildlife Sci, Int Ctr Climate & Global Change Res, 602 Duncan Dr, Auburn, AL 36849 USA. [Voulgarakis, Apostolos] Imperial Coll London, Blackett Lab, Space & Atmospher Phys, London SW7 2AZ, England. [van Weele, Michiel] KNMI, POB 201, NL-3730 AE De Bilt, Netherlands. [van der Werf, Guido R.] Vrije Univ Amsterdam, Earth & Climate Cluster, Fac Earth & Life Sci, Amsterdam, Netherlands. [Weiss, Ray] Univ Calif San Diego, Scripps Inst Oceanog, La Jolla, CA 92093 USA. [Wiltshire, Andy] Met Off Hadley Ctr, FitzRoy Rd, Exeter EX1 3PB, Devon, England. [Worthy, Doug] Environm Canada, 4905 Rue Dufferin, Toronto, ON, Canada. [Wunch, Debra] Univ Toronto, Dept Phys, 60 St George St, Toronto, ON, Canada. [Zhang, Zhen] Swiss Fed Res Inst WSL, CH-8059 Birmensdorf, Switzerland. [Zhu, Qiuan] Northwest A&F Univ, State Key Lab Soil Eros & Dryland Farming Loess P, Yangling 712100, Shaanxi, Peoples R China. RP Saunois, M (reprint author), Univ Paris Saclay, LSCE IPSL CEA CNRS UVSQ, Lab Sci Climat & Environm, F-91191 Gif Sur Yvette, France. EM marielle.saunois@lsce.ipsl.fr RI Parmentier, Frans-Jan/D-9022-2013; Canadell, Josep/E-9419-2010; Brovkin, Victor/C-2803-2016; Frankenberg, Christian/A-2944-2013; Morino, Isamu/K-1033-2014; Langenfelds, Raymond/B-5381-2012; Peng, Shushi/J-4779-2014; Patra, Prabir/B-5206-2009; Maksyutov, Shamil/G-6494-2011; OI Parmentier, Frans-Jan/0000-0003-2952-7706; Canadell, Josep/0000-0002-8788-3218; Brovkin, Victor/0000-0001-6420-3198; Frankenberg, Christian/0000-0002-0546-5857; Morino, Isamu/0000-0003-2720-1569; Peng, Shushi/0000-0001-5098-726X; Patra, Prabir/0000-0001-5700-9389; Maksyutov, Shamil/0000-0002-1200-9577; Marshall, Julia/0000-0003-2648-128X FU Swiss National Science Foundation; NASA [NNX14AF93G, NNX14AO73G]; National Environmental Science Program - Earth Systems and Climate Change Hub; European Commission [283576, 633080]; ESA Climate Change Initiative Greenhouse Gases Phase 2 project; US Department of Energy, BER [DE-AC02-05CH11231]; FAO member countries; Environment Research and Technology Development Fund of the Ministry of the Environment, Japan [2-1502]; ERC [322998]; NERC [NE/J00748X/1]; Swedish Research Council VR; Research Council of Norway [244074]; NSF [1243232, 1243220]; National Science and Engineering Research Council of Canada (NSERC); China's QianRen Program; CSIRO Australia; Australian Bureau of Meteorology; Australian Institute of Marine Science; Australian Antarctic Division; NOAA USA; Meteorological Service of Canada; National Aeronautic and Space Administration (NASA) [NAG5-12669, NNX07AE89G, NNX11AF17G, NNX07AE87G, NNX07AF09G, NNX11AF15G, NNX11AF16G]; Department of Energy and Climate Change (DECC, UK) [GA01081]; Commonwealth Scientific and Industrial Research Organization (CSIRO Australia); Bureau of Meteorology (Australia); Joint DECC/Defra Met Office Hadley Centre Climate Programme [GA01101] FX This collaborative international effort is part of the Global Carbon Project activity to establish and track greenhouse gas budgets and their trends. Fortunat Joos and Renato Spahni acknowledge support by the Swiss National Science Foundation. Heon-Sook Kim and Shamil Maksyutov acknowledge use of the GOSAT Research Computation Facility. Donald R. Blake and Isobel J. Simpson (UCI) acknowledge funding support from NASA. Josep G. Canadell thanks the support from the National Environmental Science Program - Earth Systems and Climate Change Hub. Marielle Saunois and Philippe Bousquet acknowledge the Global Carbon Project for the scientific advice and the computing power of LSCE for data analyses. Peter Bergamaschi and Mihai Alexe acknowledge the support by the European Commission Seventh Framework Programme (FP7/2007-2013) project MACC-II under grant agreement 283576, by the European Commission Horizon2020 Programme project MACC-III under grant agreement 633080, and by the ESA Climate Change Initiative Greenhouse Gases Phase 2 project. William J. Riley and Xiyan Xu acknowledge support by the US Department of Energy, BER, under contract no. DE-AC02-05CH11231. The FAOSTAT database is supported by regular programme funding from all FAO member countries. Prabir K. Patra is supported by the Environment Research and Technology Development Fund (2-1502) of the Ministry of the Environment, Japan. David J. Beerling acknowledges support from an ERC Advanced grant (CDREG, 322998) and NERC (NE/J00748X/1). David Bastviken and Patrick Crill acknowledge support from the Swedish Research Council VR. Glen P. Peters acknowledges the support of the Research Council of Norway project 244074. Hanqin Tian and Bowen Zhang acknowledge funding support from NASA (NNX14AF93G; NNX14AO73G) and NSF (1243232; 1243220). Changhui Peng acknowledges the support by National Science and Engineering Research Council of Canada (NSERC) discovery grant and China's QianRen Program. The CSIRO and the Australian Government Bureau of Meteorology are thanked for their ongoing long-term support of the Cape Grim station and the Cape Grim science programme. The CSIRO flask network is supported by CSIRO Australia, Australian Bureau of Meteorology, Australian Institute of Marine Science, Australian Antarctic Division, NOAA USA, and the Meteorological Service of Canada. The operation of the AGAGE instruments at Mace Head, Trinidad Head, Cape Matatula, Ragged Point, and Cape Grim is supported by the National Aeronautic and Space Administration (NASA) (grants NAG5-12669, NNX07AE89G, and NNX11AF17G to MIT and grants NNX07AE87G, NNX07AF09G, NNX11AF15G, and NNX11AF16G to SIO), the Department of Energy and Climate Change (DECC, UK) contract GA01081 to theUniversity of Bristol, and the Commonwealth Scientific and Industrial Research Organization (CSIRO Australia), and Bureau of Meteorology (Australia). Nicola Gedney and Andy Wiltshire acknowledge support by the Joint DECC/Defra Met Office Hadley Centre Climate Programme (GA01101). NR 360 TC 4 Z9 4 U1 83 U2 83 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1866-3508 EI 1866-3516 J9 EARTH SYST SCI DATA JI Earth Syst. Sci. Data PD DEC 12 PY 2016 VL 8 IS 2 BP 697 EP 751 DI 10.5194/essd-8-697-2016 PG 55 WC Geosciences, Multidisciplinary; Meteorology & Atmospheric Sciences SC Geology; Meteorology & Atmospheric Sciences GA EF2HL UT WOS:000390145300001 ER PT J AU Ho, PJ Knight, C Tegze, M Faigel, G Bostedt, C Young, L AF Ho, Phay J. Knight, Chris Tegze, Miklos Faigel, Gyula Bostedt, C. Young, L. TI Atomistic three-dimensional coherent x-ray imaging of nonbiological systems SO PHYSICAL REVIEW A LA English DT Article ID FREE-ELECTRON-LASER; DIFFRACTION PATTERNS; SINGLE PARTICLES; FEMTOSECOND; DYNAMICS; PULSES; SCATTERING; INTENSITY; CLUSTERS; BIOMOLECULES AB We computationally study the resolution limits for three-dimensional coherent x-ray diffractive imaging of heavy, nonbiological systems using Ar clusters as a prototype. We treat electronic and nuclear dynamics on an equal footing and remove the frozen-lattice approximation often used in electronic damage studies. We explore the achievable resolution as a function of pulse parameters (fluence level, pulse duration, and photon energy) and particle size. The contribution of combined lattice and electron dynamics is not negligible even for 2 fs pulses, and the Compton scattering is less deleterious than in biological systems for atomic-scale imaging. Although free-electron scattering represents a significant background, we find that recovery of the original structure is in principle possible with 3 angstrom resolution for particles of 11 nm diameter. C1 [Ho, Phay J.; Bostedt, C.; Young, L.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Knight, Chris] Argonne Natl Lab, Leadership Comp Facil, 9700 S Cass Ave, Argonne, IL 60439 USA. [Tegze, Miklos; Faigel, Gyula] Hungarian Acad Sci, Inst Solid State Phys & Opt, Wigner Res Ctr Phys, POB 49, H-1525 Budapest, Hungary. [Bostedt, C.] Northwestern Univ, Dept Phys, Evanston, IL 60208 USA. [Young, L.] Univ Chicago, Dept Phys, Chicago, IL 60637 USA. [Young, L.] Univ Chicago, James Franck Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA. RP Ho, PJ (reprint author), Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. EM pho@anl.gov FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division [DE-AC02-06CH11357]; Hungarian OTKA Grant of the National Research Development and Innovation Office NK-FIH [K115504]; DOE Office of Science User Facility [DE-AC02-06CH11357] FX This work was supported in part by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division under Contract No. DE-AC02-06CH11357. This work was supported in part by the Hungarian OTKA Grant No. K115504 of the National Research Development and Innovation Office NK-FIH. This research used resources of the Argonne Leadership Computing Facility, which is a DOE Office of Science User Facility supported under Contract No. DE-AC02-06CH11357. NR 83 TC 0 Z9 0 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9926 EI 2469-9934 J9 PHYS REV A JI Phys. Rev. A PD DEC 12 PY 2016 VL 94 IS 6 AR 063823 DI 10.1103/PhysRevA.94.063823 PG 14 WC Optics; Physics, Atomic, Molecular & Chemical SC Optics; Physics GA EF3GV UT WOS:000390213700012 ER PT J AU Arab, A Gray, AX Nemsak, S Evtushinsky, DV Schneider, CM Kim, DJ Fisk, Z Rosa, PFS Durakiewicz, T Riseborough, PS AF Arab, Arian Gray, A. X. Nemsak, S. Evtushinsky, D. V. Schneider, C. M. Kim, Dae-Jeong Fisk, Zachary Rosa, P. F. S. Durakiewicz, T. Riseborough, P. S. TI Effects of spin excitons on the surface states of SmB6: A photoemission study SO PHYSICAL REVIEW B LA English DT Article ID KONDO INSULATOR SMB6; ELECTRONIC-STRUCTURE; GAP AB We present the results of a high-resolution valence-band photoemission spectroscopic study of SmB6 which shows evidence for a V-shaped density of states of surface origin within the bulk gap. The spectroscopy data are interpreted in terms of the existence of heavy 4f surface states, which may be useful in resolving the controversy concerning the disparate surface Fermi-surface velocities observed in experiments. Most importantly, we find that the temperature dependence of the valence-band spectrum indicates that a small feature appears at a binding energy of about -9 meV at low temperatures. We attribute this feature to a resonance caused by the spin-exciton scattering in SmB6 which destroys the protection of surface states due to time-reversal invariance and spin-momentum locking. The existence of a low-energy spin exciton may be responsible for the scattering, which suppresses the formation of coherent surface quasiparticles and the appearance of the saturation of the resistivity to temperatures much lower than the coherence temperature associated with the opening of the bulk gap. C1 [Arab, Arian; Gray, A. X.; Riseborough, P. S.] Temple Univ, Dept Phys, Philadelphia, PA 19122 USA. [Arab, Arian; Gray, A. X.; Riseborough, P. S.] Temple Univ, Temple Mat Inst, Philadelphia, PA 19122 USA. [Nemsak, S.; Schneider, C. M.] Forschungszentrum Julich, Peter Grunberg Inst 6, D-52425 Julich, Germany. [Evtushinsky, D. V.] Helmholtz Zentrum Berlin Mat & Energie GmbH, Berlin, Germany. [Evtushinsky, D. V.] IFW Dresden, Helmholtzstr 20, D-01069 Dresden, Germany. [Kim, Dae-Jeong; Fisk, Zachary] Univ Calif Irvine, Dept Phys & Astron, Irvine, CA 92697 USA. [Rosa, P. F. S.; Durakiewicz, T.] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. [Durakiewicz, T.] Marie Curie Sklodowska Univ, Inst Phys, PL-20031 Lublin, Poland. RP Arab, A (reprint author), Temple Univ, Dept Phys, Philadelphia, PA 19122 USA.; Arab, A (reprint author), Temple Univ, Temple Mat Inst, Philadelphia, PA 19122 USA. RI Schneider, Claus/H-7453-2012; OI Schneider, Claus/0000-0002-3920-6255; Ferrari Silveira Rosa, Priscila/0000-0002-3437-548X FU U.S. Army Research Office [W911NF-15-1-0181]; Forschungszentrum Julich; NSF IR/D program; U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Science and Engineering; LANL LDRD program; US Department of Energy, Office of Basic Energy Sciences, Materials Science [DE-FG02-01ER45872] FX A.X.G. acknowledges support from the U.S. Army Research Office, under Grant No. W911NF-15-1-0181. S.N. was supported by Forschungszentrum Julich. T.D. acknowledges the NSF IR/D program. Work at Los Alamos National Laboratory was performed under the auspices of the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Science and Engineering. P.F.S.R. acknowledges a Director's Postdoctoral Fellowship through the LANL LDRD program. T.D. acknowledges the NSF IR/D program. P.S.R. would like to acknowledge support from the US Department of Energy, Office of Basic Energy Sciences, Materials Science through award DE-FG02-01ER45872. The authors would also like to thank S. Borisenko for technical assistance with the measurements and also thank E.D.L. Rienks and O. Rader for numerous discussions and their critical comments. NR 46 TC 0 Z9 0 U1 22 U2 22 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 12 PY 2016 VL 94 IS 23 AR 235125 DI 10.1103/PhysRevB.94.235125 PG 7 WC Physics, Condensed Matter SC Physics GA EF3VB UT WOS:000390251800001 ER PT J AU Li, S Kaushal, N Wang, Y Tang, Y Alvarez, G Nocera, A Maier, TA Dagotto, E Johnston, S AF Li, S. Kaushal, N. Wang, Y. Tang, Y. Alvarez, G. Nocera, A. Maier, T. A. Dagotto, E. Johnston, S. TI Nonlocal correlations in the orbital selective Mott phase of a one-dimensional multiorbital Hubbard model SO PHYSICAL REVIEW B LA English DT Article ID MEAN-FIELD THEORY; IRON PNICTIDES; CHALCOGENIDES; SUPERCONDUCTIVITY; TRANSITION; SYSTEMS AB We study nonlocal correlations in a three-orbital Hubbard model defined on an extended one-dimensional chain using determinant quantum Monte Carlo and density matrix renormalization group methods. We focus on a parameter regime with robust Hund's coupling, which produces an orbital selective Mott phase (OSMP) at intermediate values of the Hubbard U, as well as an orbitally ordered ferromagnetic insulating state at stronger coupling. An examination of the orbital-and spin-correlation functions indicates that the orbital ordering occurs before the onset of magnetic correlations in this parameter regime as a function of temperature. In the OSMP, we find that the self-energy for the itinerant electrons is momentum dependent, indicating a degree of nonlocal correlations while the localized electrons have largely momentum independent self-energies. These nonlocal correlations also produce relative shifts of the holelike and electronlike bands within our model. The overall momentum dependence of these quantities is strongly suppressed in the orbitally ordered insulating phase. C1 [Li, S.; Kaushal, N.; Wang, Y.; Dagotto, E.; Johnston, S.] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. [Tang, Y.] Virginia Tech, Dept Phys, Blacksburg, VA 24061 USA. [Alvarez, G.; Nocera, A.; Maier, T. A.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Alvarez, G.; Nocera, A.; Maier, T. A.] Oak Ridge Natl Lab, Comp Sci & Math Div, Oak Ridge, TN 37831 USA. [Dagotto, E.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. RP Li, S (reprint author), Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. FU University of Tennessee's Science Alliance Joint Directed Research and Development (JDRD) program; Oak Ridge National Laboratory; National Science Foundation (NSF) [DMR-1404375]; Laboratory Directed Research and Development Program of Oak Ridge National Laboratory; Scientic User Facilities Division (SUFD), Basic Energy Sciences (BES), DOE; UT-Battelle; Early Career Research program, SUFD, BES, DOE FX The authors thank G. Liu for useful discussions. S.L., Y.W., and S.J. are supported by the University of Tennessee's Science Alliance Joint Directed Research and Development (JDRD) program, a collaboration with Oak Ridge National Laboratory. N.K. and E.D. were supported by the National Science Foundation (NSF) under Grant No. DMR-1404375. Y.T. and T.A.M. acknowledge support by the Laboratory Directed Research and Development Program of Oak Ridge National Laboratory, managed by UT-Battelle, LLC, for the US Department of Energy (DOE). Part of this work was conducted at the Center for Nanophase Materials Science, sponsored by the Scientic User Facilities Division (SUFD), Basic Energy Sciences (BES), DOE, under contract with UT-Battelle. A.N. and G.A. acknowledge support by the Early Career Research program, SUFD, BES, DOE. CPU time was provided in part by resources supported by the University of Tennessee and Oak Ridge National Laboratory Joint Institute for Computational Sciences (http://www.jics.utk.edu). NR 64 TC 0 Z9 0 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 12 PY 2016 VL 94 IS 23 AR 235126 DI 10.1103/PhysRevB.94.235126 PG 12 WC Physics, Condensed Matter SC Physics GA EF3VB UT WOS:000390251800002 ER PT J AU Maschek, M Rosenkranz, S Hott, R Heid, R Merz, M Zocco, DA Said, AH Alatas, A Karapetrov, G Zhu, S van Wezel, J Weber, F AF Maschek, M. Rosenkranz, S. Hott, R. Heid, R. Merz, Michael Zocco, D. A. Said, A. H. Alatas, A. Karapetrov, G. Zhu, Shan van Wezel, Jasper Weber, F. TI Superconductivity and hybrid soft modes in TiSe2 SO PHYSICAL REVIEW B LA English DT Article ID CHARGE-DENSITY-WAVE; PHONON-DISPERSION; MGB2 AB The interplay between superconductivity and charge-density-wave (CDW) order plays a central role in the layered transition-metal dichalcogenides. 1T-TiSe2 forms a prime example, featuring superconducting domes on intercalation as well as under applied pressure. Here, we present high energy-resolution inelastic x-ray scattering measurements of the CDW soft phonon mode in intercalated CuxTiSe2 and pressurized 1T-TiSe2 along with detailed ab-initio calculations for the lattice dynamical properties and phonon-mediated superconductivity. We find that the intercalation-induced superconductivity can be explained by a solely phonon-mediated pairing mechanism, while this is not possible for the superconducting phase under pressure. We argue that a hybridization of phonon and exciton modes in the pairing mechanism is necessary to explain the full observed temperature-pressure-intercalation phase diagram. These results indicate that 1T-TiSe2 under pressure is close to the elusive state of the excitonic insulator. C1 [Maschek, M.; Hott, R.; Heid, R.; Merz, Michael; Zocco, D. A.; Weber, F.] Karlsruhe Inst Technol, Inst Solid State Phys, D-76131 Karlsruhe, Germany. [Rosenkranz, S.] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. [Said, A. H.; Alatas, A.] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA. [Karapetrov, G.] Drexel Univ, Dept Phys, 3141 Chestnut St, Philadelphia, PA 19104 USA. [Zhu, Shan; van Wezel, Jasper] Univ Amsterdam, Inst Theoret Phys, Inst Phys, NL-1090 GL Amsterdam, Netherlands. RP Weber, F (reprint author), Karlsruhe Inst Technol, Inst Solid State Phys, D-76131 Karlsruhe, Germany. EM frank.weber@kit.edu RI Rosenkranz, Stephan/E-4672-2011 OI Rosenkranz, Stephan/0000-0002-5659-0383 FU Helmholtz Association [VH-NG-840]; VIDI grant - Netherlands Organisation for Scientific Research (NWO); US Department of Energy, Office of Science, Materials Science and Engineering Division; National Science Foundation [ECCS-1408151]; Karlsruhe Nano-Micro Facility (KNMF); DOE Office of Science [DE-AC02-06CH11357] FX M. Maschek, D.A.Z., and F.W. were supported by the Helmholtz Association under contract VH-NG-840. S.Z. and J.v.W. acknowledge support from a VIDI grant financed by the Netherlands Organisation for Scientific Research (NWO). S.R. was supported by the US Department of Energy, Office of Science, Materials Science and Engineering Division. G.K. acknowledges support by National Science Foundation under Grant No. ECCS-1408151. M. Merz was supported by the Karlsruhe Nano-Micro Facility (KNMF). This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. NR 55 TC 0 Z9 0 U1 16 U2 16 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 12 PY 2016 VL 94 IS 21 AR 214507 DI 10.1103/PhysRevB.94.214507 PG 10 WC Physics, Condensed Matter SC Physics GA EF3TK UT WOS:000390247100006 ER PT J AU Carroll, RJ Hadinia, B Qi, C Joss, DT Page, RD Uusitalo, J Andgren, K Cederwall, B Darby, IG Eeckhaudt, S Grahn, T Gray-Jones, C Greenlees, PT Jones, PM Julin, R Juutinen, S Leino, M Leppanen, AP Nyman, M Pakarinen, J Rahkila, P Sandzelius, M Saren, J Scholey, C Seweryniak, D Simpson, J AF Carroll, R. J. Hadinia, B. Qi, C. Joss, D. T. Page, R. D. Uusitalo, J. Andgren, K. Cederwall, B. Darby, I. G. Eeckhaudt, S. Grahn, T. Gray-Jones, C. Greenlees, P. T. Jones, P. M. Julin, R. Juutinen, S. Leino, M. Leppanen, A. -P. Nyman, M. Pakarinen, J. Rahkila, P. Sandzelius, M. Saren, J. Scholey, C. Seweryniak, D. Simpson, J. TI Multiparticle configurations of excited states in Lu-155 SO PHYSICAL REVIEW C LA English DT Article ID NEUTRON-DEFICIENT ISOTOPES; TOTAL DATA READOUT; RECOIL SEPARATOR; YRAST STATES; SPECTROSCOPY; DECAY AB Excited states in the neutron-deficient N = 84 nuclide Lu-155 have been populated by using the Pd-102(Ni-58, alpha p) reaction. The Lu-155 nuclei were separated by using the gas-filled recoil ion transport unit (RITU) separator and implanted into the Si detectors of the gamma recoil electron alpha tagging (GREAT) spectrometer. Prompt gamma-ray emissions measured at the target position using the JUROGAM Ge detector array were assigned to Lu-155 through correlations with alpha decays measured in GREAT. Structures feeding the (11/2(-)) and (25/2(-)) alpha-decaying states have been revised and extended. Shell-model calculations have been performed and are found to reproduce the excitation energies of several of the low-lying states observed to within an average of 71 keV. In particular, the seniority inversion of the 25/2(-) and 27/2(-) states is reproduced. C1 [Carroll, R. J.; Joss, D. T.; Page, R. D.; Darby, I. G.] Univ Liverpool, Oliver Lodge Lab, Liverpool L69 7ZE, Merseyside, England. [Hadinia, B.; Qi, C.; Andgren, K.; Cederwall, B.; Sandzelius, M.] Royal Inst Technol, Dept Phys, Alba Nova Ctr, S-10691 Stockholm, Sweden. [Uusitalo, J.; Eeckhaudt, S.; Grahn, T.; Gray-Jones, C.; Greenlees, P. T.; Jones, P. M.; Julin, R.; Juutinen, S.; Leino, M.; Leppanen, A. -P.; Nyman, M.; Pakarinen, J.; Rahkila, P.; Sandzelius, M.; Saren, J.; Scholey, C.] Univ Jyvaskyla, Dept Phys, FI-40014 Jyvaskyla, Finland. [Seweryniak, D.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Simpson, J.] STFC Daresbury Lab, Warrington WA4 4AD, Cheshire, England. [Carroll, R. J.] Univ Surrey, Dept Phys, Guildford GU2 7XH, Surrey, England. [Hadinia, B.] Univ Guelph, Dept Phys, Guelph, ON N1G 2W1, Canada. [Darby, I. G.] IAEA, Dept Nucl Sci & Applicat, A-1400 Vienna, Austria. [Jones, P. M.] iThemba Lab Accelerator Based Sci, Dept Nucl Phys, POB 722, ZA-7129 Somerset West, South Africa. [Leppanen, A. -P.] STUK, Radiat & Nucl Safety Author, Helsinki, Finland. [Nyman, M.] IRMM, Retieseweg 111, B-2440 Geel, Belgium. RP Carroll, RJ (reprint author), Univ Liverpool, Oliver Lodge Lab, Liverpool L69 7ZE, Merseyside, England.; Carroll, RJ (reprint author), Univ Surrey, Dept Phys, Guildford GU2 7XH, Surrey, England. RI Scholey, Catherine/G-2720-2014 OI Scholey, Catherine/0000-0002-8743-6071 FU UK Science and Technology Facilities Council (STFC); Academy of Finland under the Finnish Centre of Excellence Programme (Nuclear and Accelerator Based Physics) [213503]; EURONS (European Commission) [RII3-CT-2004-506065]; U.S. Department of Energy, Office of Nuclear Physics [DEAC02-06CH11357]; Academy of Finland [131665, 111965, 209430] FX This work has been supported through the UK Science and Technology Facilities Council (STFC), the Academy of Finland under the Finnish Centre of Excellence Programme 2006-2011 (Nuclear and Accelerator Based Physics contract 213503), EURONS (European Commission contract No. RII3-CT-2004-506065) and the U.S. Department of Energy, Office of Nuclear Physics, under Contract No. DEAC02-06CH11357. The UK/France (STFC/IN2P3) Loan Pool and GAMMAPOOL network are acknowledged for the EUROGAM detectors of JUROGAM. T.G., P.T.G., and C.S. acknowledge the support of the Academy of Finland, Contracts No. 131665, No. 111965, and No. 209430, respectively. The authors gratefully acknowledge the efforts of the accelerator and technical staff. NR 27 TC 0 Z9 0 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 12 PY 2016 VL 94 IS 6 AR 064311 DI 10.1103/PhysRevC.94.064311 PG 7 WC Physics, Nuclear SC Physics GA EF3YZ UT WOS:000390262500001 ER PT J AU Jia, SY Pennington, MR AF Jia, Shaoyang Pennington, M. R. TI How gauge covariance of the fermion and boson propagators in QED constrain the effective fermion-boson vertex SO PHYSICAL REVIEW D LA English DT Article ID DYSON-SCHWINGER EQUATION; QUANTUM ELECTRODYNAMICS; MINKOWSKI SPACE; VECTOR VERTEX; IDENTITY; MASS AB We derive the gauge covariance requirement imposed on the QED fermion-photon three-point function within the framework of a spectral representation for fermion propagators. When satisfied, such requirement ensures solutions to the fermion propagator Schwinger-Dyson equation (SDE) in any covariant gauge with arbitrary numbers of spacetime dimensions to be consistent with the LandauKhalatnikov- Fradkin transformation (LKFT). The general result has been verified by the special cases of three and four dimensions. Additionally, we present the condition that ensures the vacuum polarization is independent of the gauge parameter. As an illustration, we show how the gauge technique dimensionally regularized in four dimensions does not satisfy the covariance requirement. C1 [Jia, Shaoyang; Pennington, M. R.] Coll William & Mary, Dept Phys, Williamsburg, VA 23187 USA. [Pennington, M. R.] Thomas Jefferson Natl Accelerator Facil, Ctr Theory, Newport News, VA 23606 USA. RP Jia, SY; Pennington, MR (reprint author), Coll William & Mary, Dept Phys, Williamsburg, VA 23187 USA.; Pennington, MR (reprint author), Thomas Jefferson Natl Accelerator Facil, Ctr Theory, Newport News, VA 23606 USA. EM sjia@email.wm.edu; michaelp@jlab.org FU U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC05-06OR23177] FX This material is based upon work supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics under Contract No. DE-AC05-06OR23177 that funds Jefferson Lab research. The authors would like to thank Professor Keith Ellis and other members of the Institute for Particle Physics Phenomenology (IPPP) of Durham University for kind hospitality during their visit when this article was finalized. NR 52 TC 1 Z9 1 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 12 PY 2016 VL 94 IS 11 AR 116004 DI 10.1103/PhysRevD.94.116004 PG 15 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF4CU UT WOS:000390273000007 ER PT J AU Isella, A Guidi, G Testi, L Liu, SF Li, H Li, ST Weaver, E Boehler, Y Carperter, JM De Gregorio-Monsalvo, I Manara, CF Natta, A Perez, LM Ricci, L Sargent, A Tazzari, M Turner, N AF Isella, Andrea Guidi, Greta Testi, Leonardo Liu, Shangfei Li, Hui Li, Shengtai Weaver, Erik Boehler, Yann Carperter, John M. De Gregorio-Monsalvo, Itziar Manara, Carlo F. Natta, Antonella Perez, Laura M. Ricci, Luca Sargent, Anneila Tazzari, Marco Turner, Neal TI Ringed Structures of the HD 163296 Protoplanetary Disk Revealed by ALMA SO PHYSICAL REVIEW LETTERS LA English DT Article ID HL TAU DISK; TRANSITIONAL DISKS; ACCRETION DISKS; PLANET; GAP; SIMULATIONS; INSTABILITY; IONIZATION; VORTICES; PREDICTIONS AB We present Atacama Large Millimeter and Submillimeter Array observations of the protoplanetary disk around the Herbig Ae star HD 163296 that trace the spatial distribution of millimeter-sized particles and cold molecular gas on spatial scales as small as 25 astronomical units (A. U.). The image of the disk recorded in the 1.3 mm continuum emission reveals three dark concentric rings that indicate the presence of dust depleted gaps at about 60, 100, and 160 A. U. from the central star. The maps of the (CO)-C-12, (CO)-C-13, and (CO)-O-18 J = 2 - 1 emission do not show such structures but reveal a change in the slope of the radial intensity profile across the positions of the dark rings in the continuum image. By comparing the observations with theoretical models for the disk emission, we find that the density of CO molecules is reduced inside the middle and outer dust gaps. However, in the inner ring there is no evidence of CO depletion. From the measurements of the dust and gas densities, we deduce that the gas-to-dust ratio varies across the disk and, in particular, it increases by at least a factor 5 within the inner dust gap compared to adjacent regions of the disk. The depletion of both dust and gas suggests that the middle and outer rings could be due to the gravitational torque exerted by two Saturn-mass planets orbiting at 100 and 160 A. U. from the star. On the other hand, the inner dust gap could result from dust accumulation at the edge of a magnetorotational instability dead zone, or from dust opacity variations at the edge of the CO frost line. Observations of the dust emission at higher angular resolution and of molecules that probe dense gas are required to establish more precisely the origins of the dark rings observed in the HD 163296 disk. C1 [Isella, Andrea; Liu, Shangfei; Weaver, Erik; Boehler, Yann] Rice Univ, Dept Phys & Astron, 6100 Main St,MS-108, Houston, TX 77005 USA. [Guidi, Greta; Testi, Leonardo; Natta, Antonella] Osserv Astrofis Arcetri, INAF, Largo E Fermi 5, I-50125 Florence, Italy. [Testi, Leonardo; Tazzari, Marco] ESO, Karl Schwarzschild Str 2, D-85748 Garching, Germany. [Liu, Shangfei; Li, Hui; Li, Shengtai] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. [Carperter, John M.; De Gregorio-Monsalvo, Itziar] Joint ALMA Observ, Alonso de Cordova 3107, Vitacura, Santiago De Chi, Chile. [Manara, Carlo F.] European Space Res & Technol Ctr ESA ESTEC, Directorate Sci, Sci Support Off, Keplerlaan 1, NL-2201 AZ Noordwijk, Netherlands. [Natta, Antonella] Dublin Inst Adv Studies, Sch Cosm Phys, 31 Fitzwilliams Pl, Dublin 2, Ireland. [Perez, Laura M.] Max Planck Inst Radioastron, Hgel 69, D-53121 Bonn, Germany. [Ricci, Luca] Harvard Smithsonian Ctr Astrophys, 60 Garden St, Cambridge, MA 02138 USA. [Sargent, Anneila] CALTECH, Div Phys Math & Astron, Pasadena, CA 91125 USA. [Turner, Neal] CALTECH, Jet Prop Lab, 4800 Oak Grove Dr, Pasadena, CA 91109 USA. RP Isella, A (reprint author), Rice Univ, Dept Phys & Astron, 6100 Main St,MS-108, Houston, TX 77005 USA. EM isella@rice.edu OI Tazzari, Marco/0000-0003-3590-5814 FU NSF [AST-1535809]; National Aeronautics and Space Administration [NNX15AB06G]; NRAO Student Observing Support Grant [AST-0836064]; Laboratory Directed Research and Development program at Los Alamos National Laboratory FX We thank Munetake Momose, Misato Fukagawa, and Giovanni Rosotti for the helpful conversation. This paper makes use of the following Atacama Large Millimeter and Submillimeter Array (ALMA) data: ADS/JAO. ALMA#2013.1.00601. S. ALMA is a partnership of European Southern Observatory (ESO) (representing its member states), National Science Foundation (USA), and National Institutes of Natural Sciences (Japan), together with National Research Council (Canada), National Science Council and Academia Sinica Institute of Astronomy and Astrophysics (Taiwan), and Korea Astronomy and Space Science Institute (Korea), in cooperation with Chile. The Joint ALMA Observatory is operated by ESO, Associated Universities, Inc/National Radio Astronomy Observatory (NRAO), and National Astronomical Observatory of Japan. The National Radio Astronomy Observatory is a facility of the National Science Foundation operated under cooperative agreement by Associated Universities, Inc. A. I. and Y.B. acknowledge support from the NSF Grant No. AST-1535809 and the National Aeronautics and Space Administration Grant No. NNX15AB06G. E.W. acknowledge support from the NRAO Student Observing Support Grant No. AST-0836064. H.L. and S.L. acknowledge the support from the Laboratory Directed Research and Development program at Los Alamos National Laboratory. C.F.M. gratefully acknowledges an European Space Agency Research Fellowship. Part of this research was carried out at the Jet Propulsion Laboratory, California Institute of Technology, under a contract with the National Aeronautics and Space Administration. NR 45 TC 2 Z9 2 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 12 PY 2016 VL 117 IS 25 AR 251101 DI 10.1103/PhysRevLett.117.251101 PG 8 WC Physics, Multidisciplinary SC Physics GA EF3JO UT WOS:000390220900001 PM 28036197 ER PT J AU Bai, LC Wang, X Chen, Q Ye, YF Zheng, HQ Guo, JH Yin, YD Gao, CB AF Bai, Licheng Wang, Xin Chen, Qiang Ye, Yifan Zheng, Haoquan Guo, Jinghua Yin, Yadong Gao, Chuanbo TI Explaining the Size Dependence in Platinum-Nanoparticle-Catalyzed Hydrogenation Reactions SO ANGEWANDTE CHEMIE-INTERNATIONAL EDITION LA English DT Article DE d-band electron structure; heterogeneous catalysis; hydrogenation reactions; platinum nanoparticles; size effects ID RESORCINOL-FORMALDEHYDE RESIN; MESOPOROUS SILICA; OXYGEN REDUCTION; CHEMOSELECTIVE HYDROGENATION; PYRROLE HYDROGENATION; PARTICLE-SIZE; STRUCTURE SENSITIVITY; GOLD NANOPARTICLES; MILD CONDITIONS; LOW ATOMICITY AB Hydrogenation reactions are industrially important reactions that typically require unfavorably high H-2 pressure and temperature for many functional groups. Herein we reveal surprisingly strong size-dependent activity of Pt nanoparticles (PtNPs) in catalyzing this reaction. Based on unambiguous spectral analyses, the size effect has been rationalized by the size-dependent d-band electron structure of the PtNPs. This understanding enables production of a catalyst with size of 1.2 nm, which shows a sixfold increase in turnover frequency and 28-fold increase in mass activity in the regioselective hydrogenation of quinoline, compared with PtNPs of 5.3 nm, allowing the reaction to proceed under ambient conditions with unprecedentedly high reaction rates. The size effect and the synthesis strategy developed herein may provide a general methodology in the design of metal-nanoparticle-based catalysts for a broad range of organic syntheses. C1 [Bai, Licheng; Wang, Xin; Gao, Chuanbo] Xi An Jiao Tong Univ, Frontier Inst Sci & Technol, Xian 710054, Shaanxi, Peoples R China. [Bai, Licheng; Wang, Xin; Gao, Chuanbo] Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710054, Shaanxi, Peoples R China. [Chen, Qiang] Xi An Jiao Tong Univ, Sch Chem Engn & Technol, Xian 710049, Shaanxi, Peoples R China. [Wang, Xin; Yin, Yadong] Univ Calif Riverside, Dept Chem, Riverside, CA 92521 USA. [Ye, Yifan; Guo, Jinghua] Lawrence Berkeley Natl Lab, Adv Light Source Div, Berkeley, CA 94720 USA. [Zheng, Haoquan] Stockholm Univ, Dept Mat & Environm Chem, S-10691 Stockholm, Sweden. RP Gao, CB (reprint author), Xi An Jiao Tong Univ, Frontier Inst Sci & Technol, Xian 710054, Shaanxi, Peoples R China.; Gao, CB (reprint author), Xi An Jiao Tong Univ, State Key Lab Mech Behav Mat, Xian 710054, Shaanxi, Peoples R China.; Chen, Q (reprint author), Xi An Jiao Tong Univ, Sch Chem Engn & Technol, Xian 710049, Shaanxi, Peoples R China.; Yin, YD (reprint author), Univ Calif Riverside, Dept Chem, Riverside, CA 92521 USA. EM chenqiang2204@mail.xjtu.edu.cn; yadong.yin@ucr.edu; gaochuanbo@mail.xjtu.edu.cn RI Gao, Chuanbo/D-6121-2011; Zheng, Haoquan/K-1395-2013; OI Gao, Chuanbo/0000-0003-3429-3473; Yin, Yadong/0000-0003-0218-3042 FU National Natural Science Foundation of China [21301138, 21671156]; China Postdoctoral Science Foundation [2015M582634]; U.S. Department of Energy [DE-SC0002247, DE-AC02-05CH11231]; ALS Doctoral Fellowship FX C.G. thanks the support from the National Natural Science Foundation of China (21301138, 21671156). Q.C. acknowledges support from the China Postdoctoral Science Foundation (2015M582634). Y.Y. (Yin) acknowledges the support from U.S. Department of Energy (DE-SC0002247). J.G. acknowledges the technical support from Matthew Marcus on BL10.3.2 at the Advanced Light Source (ALS). The ALS is supported by the U.S. Department of Energy (DE-AC02-05CH11231). Y.Y. (Ye) thanks the support of an ALS Doctoral Fellowship. We thank K. Ren at the Research Institute of Petroleum Processing for assistance with DFT calculations. NR 59 TC 2 Z9 2 U1 66 U2 66 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1433-7851 EI 1521-3773 J9 ANGEW CHEM INT EDIT JI Angew. Chem.-Int. Edit. PD DEC 12 PY 2016 VL 55 IS 50 BP 15656 EP 15661 DI 10.1002/anie.201609663 PG 6 WC Chemistry, Multidisciplinary SC Chemistry GA EE0EK UT WOS:000389246400036 PM 27860131 ER PT J AU Ding, J Cheng, YQ Sheng, H Asta, M Ritchie, RO Ma, E AF Ding, Jun Cheng, Yong-Qiang Sheng, Howard Asta, Mark Ritchie, Robert O. Ma, Evan TI Universal structural parameter to quantitatively predict metallic glass properties SO NATURE COMMUNICATIONS LA English DT Article ID FREE-VOLUME; MECHANICAL-BEHAVIOR; ELASTIC PROPERTIES; AMORPHOUS-ALLOYS; FORMING LIQUIDS; LOCAL ORDER; FRAGILITY; DYNAMICS; DEFORMATION; TEMPERATURE AB Quantitatively correlating the amorphous structure in metallic glasses (MGs) with their physical properties has been a long-sought goal. Here we introduce 'flexibility volume' as a universal indicator, to bridge the structural state the MG is in with its properties, on both atomic and macroscopic levels. The flexibility volume combines static atomic volume with dynamics information via atomic vibrations that probe local configurational space and interaction between neighbouring atoms. We demonstrate that flexibility volume is a physically appropriate parameter that can quantitatively predict the shear modulus, which is at the heart of many key properties of MGs. Moreover, the new parameter correlates strongly with atomic packing topology, and also with the activation energy for thermally activated relaxation and the propensity for stress-driven shear transformations. These correlations are expected to be robust across a very wide range of MG compositions, processing conditions and length scales. C1 [Ding, Jun; Asta, Mark; Ritchie, Robert O.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Ding, Jun; Ma, Evan] Johns Hopkins Univ, Dept Mat Sci & Engn, Baltimore, MD 21218 USA. [Cheng, Yong-Qiang] Oak Ridge Natl Lab, Chem & Engn Mat Div, Oak Ridge, TN 37831 USA. [Sheng, Howard] George Mason Univ, Dept Phys & Astron, Fairfax, VA 22030 USA. [Asta, Mark; Ritchie, Robert O.] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. RP Ma, E (reprint author), Johns Hopkins Univ, Dept Mat Sci & Engn, Baltimore, MD 21218 USA. EM ema@jhu.edu RI Ritchie, Robert/A-8066-2008; Ma, En/A-3232-2010; Ding, Jun/K-1989-2012 OI Ritchie, Robert/0000-0002-0501-6998; Ding, Jun/0000-0002-4091-8663 FU U.S. Department of Energy, Office of Basic Energy Sciences, Materials Sciences and Engineering Division, through the Mechanical Behavior of Materials Program (KC13) [DE-AC02-05CH11231]; U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering [DE-FG02-13ER46056]; Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy; NSF [DMR-1611064]; Office of Basic Energy Sciences of the U.S. Department of Energy [DE-AC02-05CH11231] FX The work at the Lawrence Berkeley National Laboratory was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Materials Sciences and Engineering Division, through the Mechanical Behavior of Materials Program (KC13) under Contract No. DE-AC02-05CH11231. The work at JHU was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Division of Materials Sciences and Engineering, under Contract No. DE-FG02-13ER46056. Y.Q.C was supported by the Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy. H.S. was supported by the NSF under grant No. DMR-1611064. This work made use of resources of the National Energy Research Scientific Computing Center, supported by the Office of Basic Energy Sciences of the U.S. Department of Energy, under Contract No. DE-AC02-05CH11231. We also thank Bin Xu for developing the codes of ART nouveau. NR 61 TC 0 Z9 0 U1 24 U2 24 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 12 PY 2016 VL 7 AR 13733 DI 10.1038/ncomms13733 PG 10 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4PK UT WOS:000389585800001 PM 27941922 ER PT J AU Ziatdinov, M Banerjee, A Maksov, A Berlijn, T Zhou, W Cao, HB Yan, JQ Bridges, CA Mandrus, DG Nagler, SE Baddorf, AP Kalinin, SV AF Ziatdinov, M. Banerjee, A. Maksov, A. Berlijn, T. Zhou, W. Cao, H. B. Yan, J. -Q. Bridges, C. A. Mandrus, D. G. Nagler, S. E. Baddorf, A. P. Kalinin, S. V. TI Atomic-scale observation of structural and electronic orders in the layered compound alpha-RuCl3 SO NATURE COMMUNICATIONS LA English DT Article ID AUGMENTED-WAVE METHOD; SPIN; BEHAVIOR; PHASES AB A pseudospin-1/2 Mott phase on a honeycomb lattice is proposed to host the celebrated two-dimensional Kitaev model which has an elusive quantum spin liquid ground state, and fascinating physics relevant to the development of future templates towards topological quantum bits. Here we report a comprehensive, atomically resolved real-space study by scanning transmission electron and scanning tunnelling microscopies on a novel layered material displaying Kitaev physics, alpha-RuCl3. Our local crystallography analysis reveals considerable variations in the geometry of the ligand sublattice in thin films of alpha-RuCl3 that opens a way to realization of a spatially inhomogeneous magnetic ground state at the nanometre length scale. Using scanning tunnelling techniques, we observe the electronic energy gap of approximate to 0.25 eV and intra-unit cell symmetry breaking of charge distribution in individual alpha-RuCl3 surface layer. The corresponding charge-ordered pattern has a fine structure associated with two different types of charge disproportionation at Cl-terminated surface. C1 [Ziatdinov, M.; Maksov, A.; Berlijn, T.; Baddorf, A. P.; Kalinin, S. V.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Ziatdinov, M.; Baddorf, A. P.; Kalinin, S. V.] Oak Ridge Natl Lab, Inst Funct Imaging Mat, Oak Ridge, TN 37831 USA. [Banerjee, A.; Cao, H. B.; Nagler, S. E.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Maksov, A.; Nagler, S. E.; Kalinin, S. V.] Univ Tennessee, Bredesen Ctr Interdisciplinary Res, Knoxville, TN 37996 USA. [Berlijn, T.] Oak Ridge Natl Lab, Comp Sci & Math Div, Oak Ridge, TN 37831 USA. [Zhou, W.; Yan, J. -Q.; Mandrus, D. G.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Yan, J. -Q.; Mandrus, D. G.] Univ Tennessee, Dept Mat Sci & Engn, Knoxville, TN 37996 USA. [Bridges, C. A.] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. RP Ziatdinov, M; Kalinin, SV (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA.; Ziatdinov, M; Kalinin, SV (reprint author), Oak Ridge Natl Lab, Inst Funct Imaging Mat, Oak Ridge, TN 37831 USA.; Banerjee, A (reprint author), Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA.; Kalinin, SV (reprint author), Univ Tennessee, Bredesen Ctr Interdisciplinary Res, Knoxville, TN 37996 USA. EM ziatdinovma@ornl.gov; banerjeea@ornl.gov; sergei2@ornl.gov RI Zhou, Wu/D-8526-2011 OI Zhou, Wu/0000-0002-6803-1095 FU Division of Materials Sciences and Engineering, Basic Energy Sciences, Department of Energy; Scientific User Facilities Division, Office of Science, Basic Energy Sciences, U.S. Department of Energy; Gordon and Betty Moore Foundation's EPiQS Initiative [GBMF4416]; Office of Science of the U.S. DOE [DE-AC02-05CH11231]; UT/ORNL Bredesen Center for Interdisciplinary Research and Graduate Education; Center for Nanophase Materials Sciences FX This research was sponsored by the Division of Materials Sciences and Engineering, Basic Energy Sciences, Department of Energy (M.Z., S.V.K., W.Z., J-Q.Y., C.B.). Research was conducted at the Center for Nanophase Materials Sciences, which also provided support (A.M., A.P.B., T.B.) and which is a DOE Office of Science User Facility. The work at ORNL High Flux Isotope Reactor was sponsored by the Scientific User Facilities Division, Office of Science, Basic Energy Sciences, U.S. Department of Energy, which supported A.B., H.C., and S.E.N. D.G.M. was supported by the Gordon and Betty Moore Foundation's EPiQS Initiative through Grant GBMF4416. This research used resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. DOE under Contract No. DE-AC02-05CH11231. A.M. acknowledges fellowship support from the UT/ORNL Bredesen Center for Interdisciplinary Research and Graduate Education. We acknowledge Adam Aczel for the discussion during the neutron diffraction experiment and Ling Li for her help on the crystal growth. We also acknowledge useful discussions with George Jackeli and Bryan Chakoumakos. NR 49 TC 0 Z9 0 U1 44 U2 44 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 12 PY 2016 VL 7 AR 13774 DI 10.1038/ncomms13774 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4PV UT WOS:000389587200001 PM 27941761 ER PT J AU Pax, PH Khitrov, VV Drachenberg, DR Allen, GS Ward, B Dubinskii, M Messerly, MJ Dawson, JW AF Pax, Paul H. Khitrov, Victor V. Drachenberg, Derrek R. Allen, Graham S. Ward, Benjamin Dubinskii, Mark Messerly, Michael J. Dawson, Jay W. TI Scalable waveguide design for three-level operation in Neodymium doped fiber laser SO OPTICS EXPRESS LA English DT Article ID PHOTONIC BANDGAP FIBERS; LARGE-MODE-AREA; HYBRID MICROSTRUCTURED FIBER; HOLLOW-CORE FIBERS; SINGLE-MODE; CRYSTAL FIBERS; ND; NM; AMPLIFICATION; POWER AB We have constructed a double clad neodymium doped fiber laser operating on the three-level F-4(3/2)-> I-4(9/2) transition. The laser has produced 11.5 W at 925 nm with 55% slope efficiency when pumped at 808 nm, comparable to the best previous results for a double-clad fiber configuration on this transition. Higher power pumping with both 808 nm and 880 nm sources resulted in an output of 27 W, albeit at lower slope efficiency. In both cases, output power was limited by available pump, indicating the potential for further power scaling. To suppress the stronger four-level 4F(3/2)-> I-4(11/2) transition we developed a waveguide that provides spectral filtering distributed along the length of the fiber, based on an all-solid micro-structured optical fiber design, with resonant inclusions creating a leakage path to the cladding. The waveguide supports large mode areas and provides strong suppression at selectable wavelength bands, thus easing the restrictions on core and cladding sizes that limited power scaling of previous approaches. (C) 2016 Optical Society of America C1 [Pax, Paul H.; Khitrov, Victor V.; Drachenberg, Derrek R.; Allen, Graham S.; Messerly, Michael J.; Dawson, Jay W.] Lawrence Livermore Natl Lab, 7000 East Ave,POB 808, Livermore, CA 94551 USA. [Ward, Benjamin] US Air Force Acad, Dept Phys, 2354 Fairchild Dr Ste 2A31, Colorado Springs, CO 80840 USA. [Dubinskii, Mark] US Army Res Lab, 2800 Powder Mill Rd, Adelphi, MD 20783 USA. RP Pax, PH (reprint author), Lawrence Livermore Natl Lab, 7000 East Ave,POB 808, Livermore, CA 94551 USA. EM pax2@llnl.gov FU Department of Energy's Lawrence Livermore National Laboratory under a Laboratory Directed Research and Development grant [14-ERD-078] FX This work was funded by Department of Energy's Lawrence Livermore National Laboratory under a Laboratory Directed Research and Development grant (14-ERD-078). NR 42 TC 0 Z9 0 U1 7 U2 7 PU OPTICAL SOC AMER PI WASHINGTON PA 2010 MASSACHUSETTS AVE NW, WASHINGTON, DC 20036 USA SN 1094-4087 J9 OPT EXPRESS JI Opt. Express PD DEC 12 PY 2016 VL 24 IS 25 BP 28633 EP 28647 DI 10.1364/OE.24.028633 PG 15 WC Optics SC Optics GA EE6ZJ UT WOS:000389763000044 PM 27958507 ER PT J AU Dawson, JW Pax, PH Allen, GS Drachenberg, DR Khitrov, VV Schenkel, N Messerly, MJ AF Dawson, Jay W. Pax, Paul H. Allen, Graham S. Drachenberg, Derrek R. Khitrov, Victor V. Schenkel, Nick Messerly, Michael J. TI 1.2W laser amplification at 1427nm on the F-4(3/2) to I-4(13/2) spectral line in an Nd3+ doped fused silica optical fiber SO OPTICS EXPRESS LA English DT Article ID EXCITED-STATE-ABSORPTION; MU-M; AMPLIFIERS; BAND; GLASSES; NM AB A 9.3dB improvement in optical gain and a 100x improvement in total optical power over prior published experimental results from the F-4(3/2) to I-4(13/2) transition in an Nd3+ doped fused silica optical fiber is demonstrated. This is enabled via an optical fiber waveguide design that creates high spectral attenuation in the 1050-1120nm-wavelength range, a continuous spectral filter for the primary F-4(3/2) to I-4(11/2) optical transition. A maximum output power at 1427nm of 1.2W was attained for 43mW coupled seed laser power and 22.2W of coupled pump diode laser power at 880nm a net optical gain of 14.5dB. Reducing the coupled seed laser power to 2.5mW enabled the system to attain 19.3dB of gain for 16.5W of coupled pump power. Four issues limited results; non-optimal seed laser wavelength, amplified spontaneous emission on the F-4(3/2) to I-4(9/2) optical transition, low absorption of pump light from the cladding and high spectral attenuation in the 1350-1450nm range. Future fibers that mitigate these issues should lead to significant improvements in the efficiency of the laser amplifier, though the shorter wavelength region of the transition from 1310nm to > 1350nm is still expected to be limited by excited state absorption. (C) 2016 Optical Society of America C1 [Dawson, Jay W.; Pax, Paul H.; Allen, Graham S.; Drachenberg, Derrek R.; Khitrov, Victor V.; Schenkel, Nick; Messerly, Michael J.] Lawrence Livermore Natl Lab, L-479,POB 808, Livermore, CA 94550 USA. RP Dawson, JW (reprint author), Lawrence Livermore Natl Lab, L-479,POB 808, Livermore, CA 94550 USA. EM dawson17@llnl.gov FU Laboratory Directed Research and Development grant from the LLNL Innovation Development Fund [14-ERD-078] FX The fiber reported here was fabricated under a Laboratory Directed Research and Development grant 14-ERD-078 but the specific testing reported here was funded under a grant from the LLNL Innovation Development Fund. NR 32 TC 0 Z9 0 U1 2 U2 2 PU OPTICAL SOC AMER PI WASHINGTON PA 2010 MASSACHUSETTS AVE NW, WASHINGTON, DC 20036 USA SN 1094-4087 J9 OPT EXPRESS JI Opt. Express PD DEC 12 PY 2016 VL 24 IS 25 BP 29139 EP 29153 DI 10.1364/OE.24.029138 PG 15 WC Optics SC Optics GA EE6ZJ UT WOS:000389763000090 PM 27958576 ER PT J AU Dell'Angela, M Hieke, F Malvestuto, M Sturari, L Bajt, S Kozhevnikov, IV Ratanapreechachai, J Caretta, A Casarin, B Glerean, F Kalashnikova, AM Pisarev, RV Chuang, YD Manzoni, G Cilento, F Mincigrucci, R Simoncig, A Principi, E Masciovecchio, C Raimondi, L Mahne, N Svetina, C Zangrando, M Passuello, R Gaio, G Prica, M Scarcia, M Kourousias, G Borghes, R Giannessi, L Wurth, W Parmigiani, F AF Dell'Angela, M. Hieke, F. Malvestuto, M. Sturari, L. Bajt, S. Kozhevnikov, I. V. Ratanapreechachai, J. Caretta, A. Casarin, B. Glerean, F. Kalashnikova, A. M. Pisarev, R. V. Chuang, Y. -D. Manzoni, G. Cilento, F. Mincigrucci, R. Simoncig, A. Principi, E. Masciovecchio, C. Raimondi, L. Mahne, N. Svetina, C. Zangrando, M. Passuello, R. Gaio, G. Prica, M. Scarcia, M. Kourousias, G. Borghes, R. Giannessi, L. Wurth, W. Parmigiani, F. TI Extreme ultraviolet resonant inelastic X-ray scattering (RIXS) at a seeded free-electron laser SO SCIENTIFIC REPORTS LA English DT Article ID MULTILAYER MIRRORS; EXCITATIONS; DESIGN; KCOF3 AB In the past few years, we have been witnessing an increased interest for studying materials properties under non-equilibrium conditions. Several well established spectroscopies for experiments in the energy domain have been successfully adapted to the time domain with sub-picosecond time resolution. Here we show the realization of high resolution resonant inelastic X-ray scattering (RIXS) with a stable ultrashort X-ray source such as an externally seeded free electron laser (FEL). We have designed and constructed a RIXS experimental endstation that allowed us to successfully measure the d-d excitations in KCoF3 single crystals at the cobalt M-2,M-3-edge at FERMI FEL (Elettra-Sincrotrone Trieste, Italy). The FEL-RIXS spectra show an excellent agreement with the ones obtained from the same samples at the MERIXS endstation of the MERLIN beamline at the Advanced Light Source storage ring (Berkeley, USA). We established experimental protocols for performing time resolved RIXS experiments at a FEL source to avoid X ray-induced sample damage, while retaining comparable acquisition time to the synchrotron based measurements. Finally, we measured and modelled the influence of the FEL mixed electromagnetic modes, also present in externally seeded FELs, and the beam transport with similar to 120 meV experimental resolution achieved in the presented RIXS setup. C1 [Dell'Angela, M.; Malvestuto, M.; Sturari, L.; Casarin, B.; Cilento, F.; Mincigrucci, R.; Simoncig, A.; Principi, E.; Masciovecchio, C.; Raimondi, L.; Mahne, N.; Svetina, C.; Zangrando, M.; Passuello, R.; Gaio, G.; Prica, M.; Scarcia, M.; Kourousias, G.; Borghes, R.; Giannessi, L.; Parmigiani, F.] Elettra Sincrotrone Trieste SCpA, Str Statale 14 Km 163-5, I-34149 Trieste, Italy. [Dell'Angela, M.] CNR IOM, Str Statale 14 Km 163-5, I-34149 Trieste, Italy. [Hieke, F.; Wurth, W.] Univ Hamburg, Dept Phys, D-22607 Hamburg, Germany. [Hieke, F.; Wurth, W.] Univ Hamburg, Ctr Free Electron Laser Sci, D-22607 Hamburg, Germany. [Bajt, S.; Wurth, W.] DESY, Photon Sci, Notkestr 85, D-22607 Hamburg, Germany. [Kozhevnikov, I. V.] Russian Acad Sci, Shubnikov Inst Crystallog, Leninsky Pr 59, Moscow 119333, Russia. [Ratanapreechachai, J.] Univ Cambridge, Cavendish Lab, JJ Thomson Ave, Cambridge CB3 0HE, England. [Caretta, A.; Glerean, F.; Manzoni, G.; Parmigiani, F.] Univ Trieste, Dept Phys, Via Valerio 2, I-34127 Trieste, Italy. [Kalashnikova, A. M.; Pisarev, R. V.] Ioffe Phys Tech Inst, Politekhn Skaya 26, St Petersburg 194021, Russia. [Chuang, Y. -D.] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Parmigiani, F.] Univ Cologne, Int Fac, D-50937 Cologne, Germany. RP Dell'Angela, M; Malvestuto, M (reprint author), Elettra Sincrotrone Trieste SCpA, Str Statale 14 Km 163-5, I-34149 Trieste, Italy.; Dell'Angela, M (reprint author), CNR IOM, Str Statale 14 Km 163-5, I-34149 Trieste, Italy. EM dellangela@iom.cnr.it; marco.malvestuto@elettra.eu RI Zangrando, Marco/E-1326-2015; OI Zangrando, Marco/0000-0001-8860-3962; CASARIN, Barbara/0000-0002-7386-8375 FU Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231]; EU [GA 317764]; SIR grant SUNDYN of the Italian Ministry of Education Universities and Research MIUR [RBSI14G7TL]; collaborative research centre "Light induced dynamics and control of correlated quantum systems" [SFB 925]; Helmholtz Association FX The authors gratefully acknowledge the FERMI team for the support provided during the experiments presented in this article. The Advanced Light Source is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. This work was supported by EU within FP7 project PASTRY [GA 317764]. M.D.A. acknowledges support from the SIR grant SUNDYN [Nr. RBSI14G7TL] of the Italian Ministry of Education Universities and Research MIUR. F.H. and W.W. acknowledge support by the collaborative research centre SFB 925 "Light induced dynamics and control of correlated quantum systems". Part of this research (S.B.) was supported by the Helmholtz Association through program-oriented funds. NR 27 TC 0 Z9 0 U1 6 U2 6 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 12 PY 2016 VL 6 AR 38796 DI 10.1038/srep38796 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE7QP UT WOS:000389818400001 PM 27941842 ER PT J AU Loach, JC Cooley, J Cox, GA Li, Z Nguyen, KD Poon, AWP AF Loach, J. C. Cooley, J. Cox, G. A. Li, Z. Nguyen, K. D. Poon, A. W. P. TI A database for storing the results of material radiopurity measurements SO NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS SPECTROMETERS DETECTORS AND ASSOCIATED EQUIPMENT LA English DT Article DE Database; Radiation; Neutrinoless double-beta decay; WIMP dark matter; Radiopurity; Materials AB Searches for rare nuclear processes, such as neutrinoless double beta-decay and the interactions of WIMP dark matter, are motivating experiments with ever-decreasing levels of radioactive backgrounds. These background reductions are achieved using various techniques, but amongst the most important is minimizing radioactive contamination in the materials from which the experiment is constructed. To this end there have been decades of advances in material sourcing, manufacture and certification, during which researchers have accumulated many thousands of measurements of material radiopurity. Some of these assays are described in publications, others are in databases, but many are still communicated informally. Until this work, there has been no standard format for encoding assay results and no effective, central location for storing them. The aim of this work is to address these long-standing problems by creating a concise and flexible material assay data format and powerful software application to manipulate it. A public installation of this software, available at http://www.radiopurity.org, is the largest database of assay results ever compiled and is intended as a long-term repository for the community's data. (C) 2016 Elsevier B.V. All rights reserved. C1 [Loach, J. C.; Li, Z.] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. [Loach, J. C.; Nguyen, K. D.; Poon, A. W. P.] Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA 94720 USA. [Cooley, J.] Southern Methodist Univ, Dept Phys, Dallas, TX 75275 USA. [Cox, G. A.] Karlsruhe Inst Technol, Inst Nucl Phys, D-76131 Karlsruhe, Germany. RP Loach, JC (reprint author), Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. FU U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC02-05CH11231]; Shanghai Key Lab for Particle Physics and Cosmology (SKLPPC) [11DZ2260700]; Helmholtz Alliance for Astroparticle Physics (HAP) - Initiative and Networking Fund of the Helmholtz Association; National Science Foundation [PHY 124260] FX This work was supported by: the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under Contract No. DE-AC02-05CH11231; by the Shanghai Key Lab for Particle Physics and Cosmology (SKLPPC), Grant No. 11DZ2260700; by the Helmholtz Alliance for Astroparticle Physics (HAP) funded by the Initiative and Networking Fund of the Helmholtz Association; and by the National Science Foundation under Grant No. PHY 124260 awarded to the AARM (Assay and Acquisition of Radiopure Materials) collaboration. We acknowledge the support of IBM Cloudant in hosting an early version of our community database and to SNOLAB for their ongoing hosting and management of the site. We acknowledge support and guidance from colleagues in the underground science community, including from the AARM, ILIAS, EXO, XENON100, SuperCDMS and MAJORANA collaborations. NR 15 TC 0 Z9 0 U1 5 U2 5 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0168-9002 EI 1872-9576 J9 NUCL INSTRUM METH A JI Nucl. Instrum. Methods Phys. Res. Sect. A-Accel. Spectrom. Dect. Assoc. Equip. PD DEC 11 PY 2016 VL 839 BP 6 EP 11 DI 10.1016/j.nima.2016.09.036 PG 6 WC Instruments & Instrumentation; Nuclear Science & Technology; Physics, Nuclear; Physics, Particles & Fields SC Instruments & Instrumentation; Nuclear Science & Technology; Physics GA EA6ZL UT WOS:000386777600002 ER PT J AU Miller, K Huggins, P Labov, S Nelson, K Dubrawski, A AF Miller, Kyle Huggins, Peter Labov, Simon Nelson, Karl Dubrawski, Artur TI Evaluation of coded aperture radiation detectors using a Bayesian approach SO NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS SPECTROMETERS DETECTORS AND ASSOCIATED EQUIPMENT LA English DT Article DE Coded aperture; Wide area nuclear detection; Distributed sensor networks ID MOBILE SPECTROSCOPY; IMAGING-SYSTEMS; LARGE-AREA; ARRAYS AB We investigate tradeoffs arising from the use of coded aperture gamma-ray spectrometry to detect and localize sources of harmful radiation in the presence of noisy background. Using an example application scenario of area monitoring and search, we empirically evaluate weakly supervised spectral, spatial, and hybrid spatio-spectral algorithms for scoring individual observations, and two alternative methods of fusing evidence obtained from multiple observations. Results of our experiments confirm the intuition that directional information provided by spectrometers masked with coded aperture enables gains in source localization accuracy, but at the expense of reduced probability of detection. Losses in detection performance can however be to a substantial extent reclaimed by using our new spatial and spatio-spectral scoring methods which rely on realistic assumptions regarding masking and its impact on measured photon distributions. (C) 2016 Elsevier B.V. All rights reserved. C1 [Miller, Kyle; Huggins, Peter; Dubrawski, Artur] Carnegie Mellon Univ, Inst Robot, Auton Lab, 5000 Forbes Ave, Pittsburgh, PA 15213 USA. [Labov, Simon; Nelson, Karl] Lawrence Livermore Natl Lab, Livermore, CA USA. RP Miller, K (reprint author), Carnegie Mellon Univ, Inst Robot, Auton Lab, 5000 Forbes Ave, Pittsburgh, PA 15213 USA. EM mille856@andrew.cmu.edu FU U.S. Department of Energy [DE-NA0001736]; National Science Foundation [1320347]; U.S. Department of Energy, National Nuclear Security Administration [DE-AC52-07NA27344] FX This work has been partially supported by the U.S. Department of Energy under grant DE-NA0001736 and by the National Science Foundation under award 1320347. Lawrence Livermore National Laboratory is operated by Lawrence Livermore National Security, LLC, for the U.S. Department of Energy, National Nuclear Security Administration under Contract DE-AC52-07NA27344. NR 28 TC 0 Z9 0 U1 4 U2 4 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0168-9002 EI 1872-9576 J9 NUCL INSTRUM METH A JI Nucl. Instrum. Methods Phys. Res. Sect. A-Accel. Spectrom. Dect. Assoc. Equip. PD DEC 11 PY 2016 VL 839 BP 29 EP 38 DI 10.1016/j.nima.2016.09.027 PG 10 WC Instruments & Instrumentation; Nuclear Science & Technology; Physics, Nuclear; Physics, Particles & Fields SC Instruments & Instrumentation; Nuclear Science & Technology; Physics GA EA6ZL UT WOS:000386777600005 ER PT J AU Kazakevich, G Lebedev, V Yakovlev, V Pavlov, V AF Kazakevich, G. Lebedev, V. Yakovlev, V. Pavlov, V. TI An efficient magnetron transmitter for superconducting accelerators SO NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS SPECTROMETERS DETECTORS AND ASSOCIATED EQUIPMENT LA English DT Article DE Magnetron; Transmitter; Superconducting accelerator; Drift equation; Pre-excited magnetron; Threshold of self-excitation AB A concept of a highly-efficient high-power magnetron transmitter allowing wide-band phase and the mid-frequency power control at the frequency of the locking signal is proposed. The proposal is aimed for powering Superconducting RF (SRF) cavities of intensity-frontier accelerators. The transmitter is intended to operate with phase and amplitude control feedback loops allowing suppression of micro phonics and beam loading in the SRF cavities. The concept utilizes injection-locked magnetrons controlled in phase by the locking signal supplied by a feedback system. The injection-locking signal pre-excites the magnetron and allows its operation below the critical voltage in free run. This realizes control of the magnetron power in an extended range (up to 10 dB) by control of the magnetron current. Experimental studies were carried out with 2.45 GHz, 1 kW, CW magnetrons. They demonstrated stable operation of the magnetrons and the required range of power control at a low noise level. An analysis of the kinetics of the drifting charge within the framework of the presented model of phase focusing in magnetrons substantiates the concept and the experimental results. (C) 2016 Elsevier B.V. All rights reserved. C1 [Kazakevich, G.] Muons Inc, Batavia, IL 60510 USA. [Lebedev, V.; Yakovlev, V.] Fermilab Natl Accelerator Lab, Batavia, IL 60510 USA. [Pavlov, V.] BINP, Novosibirsk 630090, Russia. RP Kazakevich, G (reprint author), Muons Inc, Batavia, IL 60510 USA. EM gkazakevitch@yahoo.com FU Fermi Research Alliance, LLC [De-AC02- 07CH11359]; United States Department of Energy (US DOE) FX This work was supported by Fermi Research Alliance, LLC under Contract No. De-AC02- 07CH11359 with the United States Department of Energy (US DOE). NR 9 TC 0 Z9 0 U1 3 U2 3 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0168-9002 EI 1872-9576 J9 NUCL INSTRUM METH A JI Nucl. Instrum. Methods Phys. Res. Sect. A-Accel. Spectrom. Dect. Assoc. Equip. PD DEC 11 PY 2016 VL 839 BP 43 EP 51 DI 10.1016/j.nima.2016.09.044 PG 9 WC Instruments & Instrumentation; Nuclear Science & Technology; Physics, Nuclear; Physics, Particles & Fields SC Instruments & Instrumentation; Nuclear Science & Technology; Physics GA EA6ZL UT WOS:000386777600007 ER PT J AU Shi, T Nattress, J Mayer, M Lin, MW Jovanovic, I AF Shi, T. Nattress, J. Mayer, M. Lin, M-W. Jovanovic, I. TI Neutron spectroscopy by thermalization light yield measurement in a composite heterogeneous scintillator SO NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS SPECTROMETERS DETECTORS AND ASSOCIATED EQUIPMENT LA English DT Article DE Capture-gated detection; Fast neutron spectroscopy; Li-6-doped scintillator; EJ-290 scintillator; Light yield measurement ID COINCIDENCE SPECTROMETER; PLASTIC SCINTILLATORS; ORGANIC SCINTILLATORS; LIQUID SCINTILLATOR; DETECTOR; CALIBRATION; RESOLUTION; DOSIMETRY AB An exothermic neutron capture reaction can be used to uniquely identify neutrons in particle detectors. With the use of a capture-gated coincidence technique, the sequence of scatter events that lead to neutron thermalization prior to the neutron capture can also be used to measure neutron energy. We report on the measurement of thermalization light yield via a time-of-flight technique in a polyvinyl toluene-based scintillator EJ-290 within a heterogeneous composite detector that also includes Li-6-doped glass scintillator. The thermalization light output exhibits a strong correlation with neutron energy because of the preference for near-complete energy deposition prior to the Li-6(n,t)He-4 neutron capture reaction. The nonproportionality of the light yield from nuclear recoils contributes to the observed broadening of the distribution of thermalization light output. The nonproportional dependence of the scintillation light output in the EJ-290 scintillator as a function of proton recoil energy has been characterized in the range of 0.3-14.1 MeV via the Birks parametrization through a combination of time-of-flight measurement and previously conducted measurements with monoenergetic neutron sources. C1 [Shi, T.; Mayer, M.; Lin, M-W.; Jovanovic, I.] Penn State Univ, Dept Mech & Nucl Engn, University Pk, PA 16802 USA. [Nattress, J.; Jovanovic, I.] Univ Michigan, Dept Nucl Engn & Radiol Sci, Ann Arbor, MI 48109 USA. [Mayer, M.] Pacific Northwest Natl Lab, Richland, WA 99354 USA. RP Shi, T (reprint author), Penn State Univ, Dept Mech & Nucl Engn, University Pk, PA 16802 USA. EM tan.shi0122@gmail.com FU National Science Foundation [ECCS-1348366]; U.S. Department of Homeland Security [2014-DN-077-ARI078-02, 2015-DN-077-ARI096] FX This research was supported by the National Science Foundation under Grant no. ECCS-1348366 and by the U.S. Department of Homeland Security under Grant Award nos. 2014-DN-077-ARI078-02 and 2015-DN-077-ARI096. NR 32 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0168-9002 EI 1872-9576 J9 NUCL INSTRUM METH A JI Nucl. Instrum. Methods Phys. Res. Sect. A-Accel. Spectrom. Dect. Assoc. Equip. PD DEC 11 PY 2016 VL 839 BP 86 EP 91 DI 10.1016/j.nima.2016.09.041 PG 6 WC Instruments & Instrumentation; Nuclear Science & Technology; Physics, Nuclear; Physics, Particles & Fields SC Instruments & Instrumentation; Nuclear Science & Technology; Physics GA EA6ZL UT WOS:000386777600009 ER PT J AU Abelof, G Boughezal, R Liu, XH Petriello, F AF Abelof, Gabriel Boughezal, Radja Liu, Xiaohui Petriello, Frank TI Single-inclusive jet production in electron-nucleon collisions through next-to-next-to-leading order in perturbative QCD SO PHYSICS LETTERS B LA English DT Article ID ENERGY AB We compute the O(alpha(2)alpha(2)(s)) perturbative corrections to inclusive jet production in electron-nucleon collisions. This process is of particular interest to the physics program of a future Electron Ion Collider (EIC). We include all relevant partonic processes, including deep-inelastic scattering contributions, photon-initiated corrections, and parton-parton scattering terms that first appear at this order. Upon integration over the final-state hadronic phase space we validate our results for the deep-inelastic corrections against the known next-to-next-to-leading order (NNLO) structure functions. Our calculation uses the N-jettiness subtraction scheme for performing higher-order computations, and allows for a completely differential description of the deep-inelastic scattering process. We describe the application of this method to inclusive jet production in detail, and present phenomenological results for the proposed EIC. The NNLO corrections have a non-trivial dependence on the jet kinematics and arise from an intricate interplay between all contributing partonic channels. (C) 2016 The Authors. Published by Elsevier B.V. C1 [Abelof, Gabriel; Boughezal, Radja; Petriello, Frank] Argonne Natl Lab, Div High Energy Phys, Argonne, IL 60439 USA. [Abelof, Gabriel; Petriello, Frank] Northwestern Univ, Dept Phys & Astron, Evanston, IL 60208 USA. [Liu, Xiaohui] Univ Maryland, Maryland Ctr Fundamental Phys, College Pk, MD 20742 USA. RP Petriello, F (reprint author), Argonne Natl Lab, Div High Energy Phys, Argonne, IL 60439 USA.; Petriello, F (reprint author), Northwestern Univ, Dept Phys & Astron, Evanston, IL 60208 USA. EM gabelof@anl.gov; rboughezal@anl.gov; xhliu@umd.edu; f-petriello@northwestern.edu FU NSF [PHY-1520916, NSF PHY11-25915]; DOE [DE-AC02-06CH11357, DE-FG02-93ER-40762, DE-FG02-91ER40684]; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231]; DOE Office of Science User Facility [DE-AC02-06CH11357] FX G. A. is supported by the NSF grant PHY-1520916. R. B. is supported by the DOE contract DE-AC02-06CH11357. X. L. is supported by the DOE grant DE-FG02-93ER-40762. F. P. is supported by the DOE grants DE-FG02-91ER40684 and DE-AC02-06CH11357. This research used resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. It also used resources of the Argonne Leadership Computing Facility, which is a DOE Office of Science User Facility supported under Contract DE-AC02-06CH11357. This research was supported in part by the NSF under Grant No. NSF PHY11-25915 to the Kavli Institute of Theoretical Physics in Santa Barbara, which we thank for hospitality during the completion of this manuscript. NR 36 TC 1 Z9 1 U1 0 U2 0 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 52 EP 59 DI 10.1016/j.physletb.2016.10.022 PG 8 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600008 ER PT J AU Crider, BP Prokop, CJ Liddick, SN Al-Shudifat, M Ayangeakaa, AD Carpenter, MP Carroll, JJ Chen, J Chiara, CJ David, HM Dombos, AC Go, S Grzywacz, R Harker, J Janssens, RVF Larson, N Lauritsen, T Lewis, R Quinn, SJ Recchia, F Spyrou, A Suchyt, S Walters, WB Zhu, S AF Crider, B. P. Prokop, C. J. Liddick, S. N. Al-Shudifat, M. Ayangeakaa, A. D. Carpenter, M. P. Carroll, J. J. Chen, J. Chiara, C. J. David, H. M. Dombos, A. C. Go, S. Grzywacz, R. Harker, J. Janssens, R. V. F. Larson, N. Lauritsen, T. Lewis, R. Quinn, S. J. Recchia, F. Spyrou, A. Suchyt, S. Walters, W. B. Zhu, S. TI Shape coexistence from lifetime and branching-ratio measurements in Ni-68,Ni-70 SO PHYSICS LETTERS B LA English DT Article ID NUCLEI; STATES; ISOTOPES; SPECTROSCOPY; DECAY; ODD AB Shape coexistence near closed-shell nuclei, whereby states associated with deformed shapes appear at relatively low excitation energy alongside spherical ones, is indicative of the rapid change in structure that can occur with the addition or removal of a few protons or neutrons. Near Ni-68 (Z = 28, N = 40), the identification of shape coexistence hinges on hitherto undetermined transition rates to and from low-energy 0(+) states. In Ni-68,Ni-70, new lifetimes and branching ratios have been measured. These data enable quantitative descriptions of the 0(+) states through the deduced transition rates and serve as sensitive probes for characterizing their nuclear wave functions. The results are compared to, and consistent with, large-scale shell-model calculations which predict shape coexistence. With the firm identification of this phenomenon near Ni-68, shape coexistence is now observed in all currently accessible regions of the nuclear chart with closed proton shells and mid-shell neutrons. (C) 2016 The Author(s). Published by Elsevier B.V. C1 [Crider, B. P.; Prokop, C. J.; Liddick, S. N.; Chen, J.; Dombos, A. C.; Larson, N.; Lewis, R.; Quinn, S. J.; Spyrou, A.] Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA. [Prokop, C. J.; Liddick, S. N.; Larson, N.; Lewis, R.] Michigan State Univ, Dept Chem, E Lansing, MI 48824 USA. [Al-Shudifat, M.; Go, S.; Grzywacz, R.] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. [Ayangeakaa, A. D.; Carpenter, M. P.; David, H. M.; Harker, J.; Janssens, R. V. F.; Lauritsen, T.; Zhu, S.] Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. [Carroll, J. J.] US Army Res Lab, Adelphi, MD 20783 USA. [Chiara, C. J.] US Army Res Lab, Oak Ridge Associated Univ Fellowship Program, Adelphi, MD 20783 USA. [Dombos, A. C.; Quinn, S. J.; Spyrou, A.] Michigan State Univ, Dept Phys, E Lansing, MI 48824 USA. [Grzywacz, R.] Oak Ridge Natl Lab, Div Phys, Oak Ridge, TN 37830 USA. [Harker, J.; Walters, W. B.] Univ Maryland, Dept Chem & Biochem, College Pk, MD 20742 USA. [Recchia, F.] Univ Padua, Dipartimento Fis & Astron, I-35131 Padua, Italy. [Suchyt, S.] Univ Calif Berkeley, Dept Nucl Engn, Berkeley, CA 94720 USA. [David, H. M.] GSI Helmholtzzentrum Schwerionenforsch GmbH, D-64291 Darmstadt, Germany. RP Crider, BP (reprint author), Michigan State Univ, Natl Superconducting Cyclotron Lab, E Lansing, MI 48824 USA. EM crider@nscl.msu.edu FU National Science Foundation (NSF) [PHY-1102511, PHY-1350234]; Department of Energy National Nuclear Security Administration (NNSA) [DE-NA0002132, DE-NA0003221]; Department of Energy National Nuclear Security Administration (NNSA) through the Nuclear Science and Security Consortium [DE-NA0000979, DE-NA0003180]; U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC-06CH11357, DE-FG02-94ER40834, DE-FG02-96ER40983]; U.S. Army Research Laboratory [W911NF-12-2-0019] FX This work was supported in part by the National Science Foundation (NSF) under Contract No. PHY-1102511 (NSCL) and Grant No. PHY-1350234 (CAREER), by the Department of Energy National Nuclear Security Administration (NNSA) under Grant No. DE-NA0002132 and Award No. DE-NA0003221 and through the Nuclear Science and Security Consortium under Award No's. DE-NA0000979 and DE-NA0003180, by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under Contract No. DE-AC-06CH11357 (ANL) and Grant No's. DE-FG02-94ER40834 (Maryland) and DE-FG02-96ER40983 (UT), and by the U.S. Army Research Laboratory under Cooperative Agreement W911NF-12-2-0019. NR 50 TC 0 Z9 0 U1 0 U2 0 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 108 EP 113 DI 10.1016/j.physletb.2016.10.020 PG 6 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600016 ER PT J AU Aaboud, M Aad, G Abbott, B Abdallah, J Abdinov, O Abeloos, B Aben, R Abou Zeid, OS Abraham, NL Abramowicz, H Abreu, H Abreu, R Abulaiti, Y Acharya, BS Adachi, S Adamczyk, L Adams, DL Adelman, J Adomeit, S Adye, T Affolder, AA Agatonovic-Jovin, T Aguilar-Saavedra, JA Ahlen, SP Ahmadov, F Aielli, G Akerstedt, H Akesson, TPA Akimov, AV Alberghi, GL Albert, J Albrand, S Verzini, MJA Aleksa, M Aleksandrov, IN Alexa, C Alexander, G Alexopoulos, T Alhroob, M Ali, B Aliev, M Alimonti, G Alison, J Alkire, SP Allbrooke, BMM Allen, BW Allport, PP Aloisio, A Alonso, A Alonso, F Alpigiani, C Alshehri, AA Alstaty, M Gonzalez, BA Piqueras, DA Alviggi, MG Amadio, BT Amako, K Coutinho, YA Amelung, C Amidei, D Dos Santos, SPA Amorim, A Amoroso, S Amundsen, G Anastopoulos, C Ancu, LS Andari, N Andeen, T Anders, CF Anders, G Anders, JK Anderson, KJ Andreazza, A Andrei, V Angelidakis, S Angelozzi, I Angerami, A Anghinolfi, F Anisenkov, AV Anjos, N Annovi, A Antel, C Antonelli, M Antonov, A Anulli, F Aoki, M Bella, LA Arabidze, G Arai, Y Araque, JP Arce, ATH Arduh, FA Arguin, JF Argyropoulos, S Arik, M Armbruster, AJ Armitage, LJ Arnaez, O Arnold, H Arratia, M Arslan, O Artamonov, A Artoni, G Artz, S Asai, S Asbah, N Ashkenazi, A Asman, B Asquith, L Assamagan, K Astalos, R Atkinson, M Atlay, NB Augsten, K Avolio, G Axen, B Ayoub, MK Azuelos, G Baak, MA Baas, AE Baca, MJ Bachacou, H Bachas, K Backes, M Backhaus, M Bagiacchi, P Bagnaia, P Bai, Y Baines, JT Baker, OK Baldin, EM Balek, P Balestri, T Balli, F Balunas, WK Banas, E Banerjee, S Bannoura, AAE Barak, L Barberio, EL Barberis, D Barbero, M Barillari, T Barisits, MS Barklow, T Barlow, N Barnes, SL Barnett, BM Barnett, RM Barnovska-Blenessy, Z Baroncelli, A Barone, G Barr, AJ Navarro, LB Barreiro, F da 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A Hassani, S Haug, S Hauser, R Hauswald, L Havranek, M Hawkes, CM Hawkings, RJ Hayakawa, D Hayden, D Hays, P Hays, M Hayward, HS Haywood, SJ Head, SJ Heck, T Hedberg, V Heelan, L Heim, S Heim, T Heinemann, B Heinrich, JJ Heinrich, L Heinz, C Hejbal, J Helary, L Hellman, S Helsens, C Henderson, J Henderson, RCW Heng, Y Henkelmann, S Correia, AMH Henrot-Versille, S Herbert, GH Herde, H Herget, V Jimenez, YH Herten, G Hertenberger, R Hervas, L Hesketh, GG Hessey, NP Hetherly, JW Hickling, R Higon-Rodriguez, E Hill, E Hill, JC Hiller, KH Hillier, SJ Hinchliffe, I Hines, E Hinman, RR Hirose, M Hirschbuehl, D Hobbs, J Hod, N Hodgkinson, MC Hodgson, P Hoecker, A Hoeferkamp, MR Hoenig, F Hohn, D Holmes, TR Homann, M Honda, T Hong, TM Hooberman, BH Hopkins, WH Horii, Y Horton, AJ Hostachy, JY Hou, S Hoummada, A Howarth, J Hoya, J Hrabovsky, M Hristova, I Hrivnac, J Hryn'ova, T Hrynevich, A Hsuc, C Hsu, PJ Hsu, SC Hu, Q Hu, S Huang, Y Hubacek, Z Hubaut, F Huegging, F Huffman, TB Hughes, EW 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Zhang, X. Zhang, Z. Zhao, X. Zhao, Y. Zhao, Z. Zhemchugov, A. Zhong, J. Zhou, B. Zhou, C. Zhou, L. Zhou, L. Zhou, M. Zhou, N. Zhu, C. G. Zhu, H. Zhu, J. Zhu, Y. Zhuang, X. Zhukov, K. Zibell, A. Zieminska, D. Zimine, N. I. Zimmermann, C. Zimmermann, S. Zinonos, Z. Zinser, M. Ziolkowski, M. Zivkovic, L. Zobernig, G. Zoccoli, A. zur Nedden, M. Zwalinski, L. CA ATLAS Collaboration TI Measurement of W+W- production in association with one jet in proton-proton collisions at root s=8 TeV with the ATLAS detector SO PHYSICS LETTERS B LA English DT Article ID MONTE-CARLO; PLUS PLUS; PHYSICS; QCD AB The production of W boson pairs in association with one jet in pp collisions at root s = 8 TeV is studied using data corresponding to an integrated luminosity of 20.3 fb(-1) collected by the ATLAS detector during 2012 at the CERN Large Hadron Collider. The cross section is measured in a fiducial phase-space region defined by the presence of exactly one electron and one muon, missing transverse momentum and exactly one jet with a transverse momentum above 25 GeV and a pseudorapidity of vertical bar eta vertical bar < 4.5. The leptons are required to have opposite electric charge and to pass transverse momentum and pseudorapidity requirements. The fiducial cross section is found to be sigma(fid,1-jet)(WW) = 136 +/- 6 (stat) +/- 14 (syst) +/- 3 (lumi) fb. In combination with a previous measurement restricted to leptonic final states with no associated jets, the fiducial cross section of WW production with zero or one jet is measured to be sigma(fid,<1-jet)(WW) = 511 +/- 9 (stat) +/- 26 (syst) +/- 10 (lumi) fb. The ratio of fiducial cross sections in final states with one and zero jets is determined to be 0.36 +/- 0.05. 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[Alexa, C.; Caprini, I.; Caprini, M.; Chitan, A.; Ciubancan, M.; Constantinescu, S.; Dita, P.; Dita, S.; Dobre, M.; Jinaru, A.; Martoiu, V. S.; Maurer, J.; Olariu, A.; Pantea, D.; Rotaru, M.; Stoicea, G.; Tudorache, A.; Tudorache, V.] Natl Inst Phys & Nucl Engn, Bucharest, Romania. [Popeneciuc, G. A.] Natl Inst Res & Dev Isotop & Mol Technol, Dept Phys, Cluj Napoca, Romania. Univ Politehn Bucuresti, Bucharest, Romania. [Gravila, P. M.] West Univ Timisoara, Timisoara, Romania. [Sola, J. D. Bossio; Marceca, G.; Otero y Garzon, G.; Piegaia, R.; Sacerdoti, S.] Univ Buenos Aires, Dept Fis, Buenos Aires, DF, Argentina. [Arratia, M.; Barlow, N.; Batley, J. R.; Brochu, F. M.; Brunt, B. H.; Carter, J. R.; Chapman, J. D.; Cottin, G.; Gillam, T. P. S.; Hill, J. C.; Kaneti, S.; Lester, C. G.; Malone, C.; Mueller, T.; Parker, M. A.; Potter, C. J.; Robinson, D.; Rosten, J. H. N.; Ward, C. P.; Yusuff, I.] Univ Cambridge, Cavendish Lab, Cambridge, England. [Bellerive, A.; Cree, G.; Di Valentino, D.; Gillberg, D.; Koffas, T.; Lacey, J.; Leight, W. A.; Nomidis, I.; Oakham, F. G.; Pasztor, G.; Ruiz-Martinez, A.; Vincter, M. G.; Weber, S. A.] Carleton Univ, Dept Phys, Ottawa, ON, Canada. [Aleksa, M.; Gonzalez, B. Alvarez; Amoroso, S.; Anders, G.; Anghinolfi, F.; Arnaez, O.; Avolio, G.; Baak, M. A.; Backhaus, M.; Barak, L.; Barisits, M-S; Beermann, T. A.; Beltramello, O.; Bianco, M.; Bogaerts, J. A.; Bortfeldt, J.; Boveia, A.; Boyd, J.; Burckhart, H.; Camarda, S.; Campana, S.; Garrido, M. D. M. Capeans; Carli, T.; Carrillo-Montoya, G. D.; Catinaccio, A.; Cattai, A.; Cerv, M.; Chisholm, A. S.; Chromek-Burckhart, D.; Conti, G.; Cortes-Gonzalez, A.; Dell'Acqua, A.; Deviveiros, P. O.; Di Girolamo, A.; Di Girolamo, B.; Di Nardo, R.; Dittus, F.; Dobos, D.; Dudarev, A.; Duhrssen, M.; Eifert, T.; Ellis, N.; Elsing, M.; Faltova, J.; Farthouat, P.; Fassnacht, P.; Feng, E. J.; Francis, D.; Fressard-Batraneanu, S. M.; Froidevaux, D.; Gadatsch, S.; Goossens, L.; Gorini, B.; Gray, H. M.; Gumpert, C.; Hawkings, R. J.; Helary, L.; Helsens, C.; Correia, A. M. Henriques; Hervas, L.; Hoecker, A.; Huhtinen, M.; Iengo, P.; Jakobsen, S.; Klioutchnikova, T.; Krasznahorkay, A.; Lapoire, C.; Lassnig, M.; Miotto, G. Lehmann; Lenzi, B.; Lichard, P.; Malyukov, S.; Manousos, A.; Mapelli, L.; Marzin, A.; Berlingen, J. Montejo; Morgenstern, S.; Mornacchi, G.; Nairz, A. M.; Nessi, M.; Nordberg, M.; Palestini, S.; Pauly, T.; Pernegger, H.; Petersen, B. A.; Pommes, K.; Poppleton, A.; Poulard, G.; Poveda, J.; Astigarraga, M. E. Pozo; Rammensee, M.; Raymond, M.; Rembser, C.; Ritsch, E.; Roe, S.; Ruthmann, N.; Salzburger, A.; Schaefer, D.; Schlenker, S.; Schmieden, K.; Sforza, F.; Sanchez, C. A. Solans; Spigo, G.; Starz, S.; Stelzer, H. J.; Teischinger, F. A.; Ten Kate, H.; Unal, G.; Vandelli, W.; Voss, R.; Vuillermet, R.; Wells, P. S.; Wengler, T.; Wenig, S.; Werner, P.; Wilkens, H. G.; Wotschack, J.; Young, C. J. S.; Zwalinski, L.] CERN, Geneva, Switzerland. [Alison, J.; Anderson, K. J.; Bryant, P.; Toro, R. Camacho; Cheng, Y.; Dandoy, J. R.; Facini, G.; Gardner, R. W.; Kapliy, A.; Kim, Y. K.; Krizka, K.; Li, H. L.; Merritt, F. S.; Miller, D. W.; Oreglia, M. J.; Pilcher, J. E.; Saxon, J.; Shochet, M. J.; Stark, G. H.; Swiatlowski, M.; Vukotic, I.; Wu, M.] Univ Chicago, Enrico Fermi Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA. [Blunier, S.; Diaz, M. A.; Ochoa-Ricoux, J. P.] Pontificia Univ Catolica Chile, Dept Fis, Santiago, Chile. [Aloisio, A.; Brooksb, W. K.; Carquin, E.; Kuleshov, S.; Lopez, J. A.; Pezoa, R.; Prokoshin, F.; Loyola, J. E. Salazar; Araya, S. Tapia; Vasquez, G. A.; White, R.] Univ Tecn Federico Santa Maria, Dept Fis, Valparaiso, Chile. [Bai, Y.; da Costa, J. Barreiro Guimaraes; Cheng, H. J.; Fang, Y.; Jina, S.; Li, Q.; Liang, Z.; Merino, J. Llorente; Lou, X.; Mansour, J. D.; Ouyang, Q.; Peng, C.; Ren, H.; Shan, L. Y.; Sun, X.; Xu, D.; Zhu, H.; Zhuang, X.] Chinese Acad Sci, Inst High Energy Phys, Beijing, Peoples R China. [Chen, S.; Wangb, C.; Zhangb, H.] Nanjing Univ, Dept Phys, Nanjing, Jiangsu, Peoples R China. [Chen, X.; Zhou, N.] Tsinghua Univ, Dept Phys, Beijing 100084, Peoples R China. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Ganguly, S.; Gris, Ph.; Madar, R.; Pallin, D.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] Clermont Univ, Phys Corpusculaire Lab, Clermont Ferrand, France. [Aloisio, A.; Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Ganguly, S.; Gris, Ph.; Madar, R.; Pallin, D.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] Univ Blaise Pascal, Clermont Ferrand, France. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Ganguly, S.; Gris, Ph.; Madar, R.; Pallin, D.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] CNRS IN2P3, Clermont Ferrand, France. [Alkire, S. P.; Angerami, A.; Brooijmans, G.; Carbone, R. M.; Clark, M. R.; Cole, B.; Hughes, E. W.; Iordanidou, K.; Klein, M. H.; Mohapatra, S.; Ochoa, I.; Parsons, J. A.; Smith, M. N. K.; Smith, R. W.; Tuts, P. M.; Wang, T.; Zhou, L.] Columbia Univ, Nevis Lab, Irvington, NY USA. [Alonso, A.; Besjes, G. J.; Dam, M.; Galster, G.; Hansen, J. B.; Hansen, J. D.; Hansen, P. H.; Monk, J.; Mortensen, S. S.; Pedersen, L. E.; Petersen, T. C.; Pingel, A.; Wiglesworth, C.; Xella, S.] Univ Copenhagen, Niels Bohr Inst, Copenhagen, Denmark. [Cairo, V. M.; Callea, G.; Capua, M.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Palazzo, S.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Ist Nazl Fis Nucl, Grp Collegato Cosenza, Lab Nazl Frascati, Arcavacata Di Rende, Italy. [Aloisio, A.; Cairo, V. M.; Callea, G.; Capua, M.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Palazzo, S.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Univ Calabria, Dipartimento Fis, Arcavacata Di Rende, Italy. [Adamczyk, L.; Bold, T.; Dabrowski, W.; Gach, G. P.; Grabowska-Bold, I.; Kisielewskaa, D.; Koperny, S.; Kowalski, T. Z.; Mindur, B.; Przybycien, M.; Zemla, A.] AGH Univ Sci & Technol, Fac Phys & Appl Comp Sci, Krakow, Poland. [Palka, M.; Richterwas, E.] Jagiellonian Univ, Marian Smoluchowski Inst Phys, Krakow, Poland. [Aloisio, A.; Alonso, A.; Banas, E.; de Renstrom, P. A. Bruckman; Burka, K.; Chwastowski, J. J.; Derendarz, D.; Godlewski, J.; Gornicki, E.; Hajduk, Z.; Kaczmarska, A.; Knapik, J.; Korcyl, K.; Kowalewska, A. B.; Malecki, Pa.; Olszewski, A.; Olszowska, J.; Stanecka, E.; Staszewski, R.; Trzebinski, M.; Trzupek, A.; Wolter, M. W.; Wosiek, B. K.; Wozniak, K. W.; Zabinski, B.] Polish Acad Sci, Inst Nucl Phys, Krakow, Poland. [Aloisio, A.; Cao, T.; Firan, A.; Gupta, R.; Hetherly, J. W.; Kama, S.; Kehoe, R.; Sekula, S. J.; Stroynowski, R.; Varol, T.; Wang, H.; Ye, J.; Zhao, X.; Zhou, L.] So Methodist Univ, Dept Phys, Dallas, TX 75275 USA. [Izen, J. M.; Leyton, M.; Meirose, B.; Reeves, K.] Univ Texas Dallas, Dept Phys, Richardson, TX 75083 USA. [Aloisio, A.; Alonso, A.; Amorim, A.; Andreazza, A.; Asbah, N.; Behr, J. K.; Bertsche, C.; Bessner, M.; Bloch, I.; Britzger, D.; Deterre, C.; Cornell, S. Diez; Dutta, B.; Dyndal, M.; Eckardt, C.; Ferrando, J.; Filipuzzi, M.; Flaschel, N.; Bravo, A. Gascon; Gasnikova, K.; Glazov, A.; Gregor, I. M.; Haleem, M.; Hamnett, P. G.; Hiller, K. H.; Howarth, J.; Huang, Y.; Katzy, J.; Keller, J. S.; Kondrashova, N.; Kuhl, T.; Lobodzinska, E. M.; Lohwasser, K.; Madsen, A.; Medinnis, M.; Monig, K.; Garcia, R. F. Naranjo; Naumann, T.; O'Rourke, A. A.; Peschke, R.; Peters, K.; Pirumov, H.; Poley, A.; Rauch, D. M.; Robinson, J. E. M.; Schaefer, R.; Schmitt, S.; South, D.; Stanescu-Bellu, M.; Stanitzki, M. M.; Styles, N. A.; Tackmann, K.; Trofymov, A.; Wang, J.; Zakharchuk, N.] DESY, Hamburg, Germany. [Aloisio, A.; Alonso, A.; Amorim, A.; Andreazza, A.; Angerami, A.; Asbah, N.; Behr, J. K.; Bertsche, C.; Bessner, M.; Bloch, I.; Britzger, D.; Deterre, C.; Cornell, S. Diez; Dutta, B.; Dyndal, M.; Eckardt, C.; Ferrando, J.; Filipuzzi, M.; Flaschel, N.; Bravo, A. Gascon; Gasnikova, K.; Glazov, A.; Gregor, I. M.; Haleem, M.; Hamnett, P. G.; Hiller, K. H.; Howarth, J.; Huang, Y.; Katzy, J.; Keller, J. S.; Kondrashova, N.; Kuhl, T.; Lobodzinska, E. M.; Lohwasser, K.; Madsen, A.; Medinnis, M.; Monig, K.; Garcia, R. F. Naranjo; Naumann, T.; O'Rourke, A. A.; Peschke, R.; Peters, K.; Pirumov, H.; Poley, A.; Rauch, D. M.; Robinson, J. E. M.; Schaefer, R.; Schmitt, S.; South, D.; Stanescu-Bellu, M.; Stanitzki, M. M.; Styles, N. A.; Tackmann, K.; Trofymov, A.; Wang, J.; Zakharchuk, N.] DESY, Zeuthen, Germany. [Burmeister, I.; Cinca, D.; Dette, K.; Erdmann, J.; Esch, H.; Gossling, C.; Homann, M.; Klingenberg, R.; Kroeninger, K.] Tech Univ Dortmund, Lehrstuhl Expt Phys 4, Dortmund, Germany. [Aloisio, A.; Duschinger, D.; Friedrich, F.; Gutschow, C.; Hauswald, L.; Kobel, M.; Mader, W. F.; Novgorodova, O.; Siegert, F.; Socher, F.; Straessner, A.; Vest, A.; Wahrmund, S.] Tech Univ Dresden, Inst Kern & Teilchenphys, Dresden, Germany. [Aloisio, A.; Alonso, A.; Arce, A. T. H.; Benjamin, D. P.; Bjergaard, D. M.; Bocci, A.; Goshaw, A. T.; Kajomovitz, E.; Kotwal, A.; Kruse, M. C.; Li, L.; Li, S.; Liu, M.; Oh, S. H.] Duke Univ, Dept Phys, Durham, NC 27706 USA. [Bristow, T. M.; Clark, P. J.; Dias, F. A.; Edwards, N. C.; Gao, Y.; Walls, F. M. Garay; Glaysher, P. C. F.; Harrington, R. D.; Leonidopoulos, C.; Martin, V. J.; Mijovic, L.; Mills, C.; Pino, S. A. Olivares; Washbrook, A.; Wynne, B. M.] Univ Edinburgh, SUPA Sch Phys & Astron, Edinburgh, Midlothian, Scotland. [Aloisio, A.; Antonelli, M.; Beretta, M.; Bilokon, H.; Chiarella, V.; Curatolo, M.; Esposito, B.; Gatti, C.; Laurelli, P.; Maccarrone, G.; Mancini, G.; Sansoni, A.; Testa, M.; Vilucchi, E.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Arnold, H.; Betancourt, C.; Boehler, M.; Bruneliere, R.; Buehrer, F.; Burgard, C. D.; Buscher, D.; Cardillo, F.; Coniavitis, E.; Consorti, V.; Dang, N. P.; Dao, V.; Di Simone, A.; Glatzer, J.; Gonella, G.; Herten, G.; Hirose, M.; Jakobs, K.; Javurek, T.; Jenni, P.; Kiss, F.; Koneke, K.; Kopp, A. K.; Kuehn, S.; Landgraf, U.; Luedtke, C.; Nagel, M.; Pagacova, M.; Parzefall, U.; Ronzani, M.; Rosbach, K.; Ruhr, F.; Rurikova, Z.; Sammel, D.; Schillo, C.; Schnoor, U.; Schumacher, M.; Sommer, P.; Sundermann, J. E.; Ta, D.; Temming, K. K.; Tornambe, P.; Tsiskaridze, V.; Weiser, C.; Werner, M.; Zhang, L.; Zimmermann, S.] Albert Ludwigs Univ, Fak Math & Phys, Freiburg, Germany. [Ancu, L. S.; De Mendizabal, J. Bilbao; Calace, N.; Chatterjee, A.; Clark, A.; Coccaro, A.; Delitzsch, C. M.; della Volpe, D.; Ferrere, D.; Golling, T.; Gonzalez-Sevilla, S.; Gramling, J.; Guescini, F.; Iacobucci, G.; Katre, A.; Khoo, T. J.; Lanfermann, M. C.; Lionti, A. E.; March, L.; Mermod, P.; Nackenhorst, O.; Paolozzi, L.; Ristic, B.; Schramm, S.; Sfyrla, A.; Wu, X.] Univ Geneva, Sect Phys, Geneva, Switzerland. [Aloisio, A.; Alonso, A.; Amorim, A.; Barberis, D.; Darbo, G.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Gemmea, C.; Guido, E.; Miglioranzi, S.; Morettini, P.; Oide, H.; Osculati, B.; Parodi, F.; Passaggio, S.; Rossi, L. P.; Sannino, M.; Schiavi, C.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Barberis, D.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Guido, E.; Miglioranzi, S.; Oide, H.; Osculati, B.; Parodi, F.; Sannino, M.; Schiavi, C.] Univ Genoa, Dipartimento Fis, Genoa, Italy. Iv Javakhishvili Tbilisi State Univ, E Andronikashvili Inst Phys, Tbilisi, Rep of Georgia. [Duren, M.; Heinz, C.; Kreutzfeldt, K.; Stenzel, H.] Justus Liebig Univ Giessen, Phys Inst 2, Giessen, Germany. [Alshehri, A. A.; Bates, R. L.; Blue, A.; Boutle, S. K.; Madden, W. D. Breaden; Britton, D.; Buckley, A. G.; Bussey, P.; Buttar, C. M.; Buzatu, A.; Crawley, S. J.; D'Auria, S.; Doyle, A. T.; Gul, U.; Knue, A.; Mullen, P.; O'Shea, V.; Owen, M.; Pollard, C. S.; Qin, G.; Quilty, D.; Ravenscroft, T.; Robson, A.; St Denis, R. D.; Stewart, G. A.; Thompson, A. S.] Univ Glasgow, SUPA Sch Phys & Astron, Glasgow, Lanark, Scotland. [Bindi, M.; Bisanz, T.; Blumenschein, U.; Brandt, G.; De Maria, A.; Drechsler, E.; Graber, L.; Grosse-Knetter, J.; Janus, M.; Kareem, M. J.; Kawamura, G.; Lai, S.; Lemmer, B.; Magradze, E.; Mantoani, M.; Mchedlidze, G.; Llacer, M. Moreno; Musheghyan, H.; Quadt, A.; Rieger, J.; Rosien, N. -A.; Rzehorz, G. F.; Shabalina, E.; Stolte, P.; Veatch, J.; Weingarten, J.; Zinonos, Z.] Georg August Univ, Phys Inst 2, Gottingen, Germany. [Albrand, S.; Berlendis, S.; Bethani, A.; Camincher, C.; Collot, J.; Crepe-Renaudin, S.; Delsart, P. A.; Gabaldon, C.; Genest, M. H.; Gradin, P. O. J.; Hostachy, J-Y.; Ledroit-Guillon, F.; Lleres, A.; Lucotte, A.; Malek, F.; Petit, E.; Stark, J.; Trocme, B.; Wu, M.] Univ Grenoble Alpes, CNRS IN2P3, Lab Phys Subatom & Cosmol, Grenoble, France. [Chan, S. K.; Clark, B. L.; Franklin, M.; Giromini, P.; Huth, J.; Ippolito, V.; Lazovich, T.; Mateos, D. Lopez; Morii, M.; Rogan, C. S.; Roloff, J.; Skottowe, H. P.; Sun, S.; Tolley, E.; Tong, B.; Tuna, A. N.; Zambito, S.] Harvard Univ, Lab Particle Phys & Cosmol, Cambridge, MA 02138 USA. [Barnovska-Blenessy, Z.; Gao, J.; Geng, C.; Guo, Y.; Han, L.; Hu, Q.; Jiang, Y.; Li, B.; Li, C.; Liu, J. B.; Liu, M.; Liu, Y. L.; Liu, Y.; Peng, H.; Song, H. Y.; Wang, W.; Zhang, G.; Zhang, R.; Zhao, Z.; Zhu, Y.] Univ Sci & Technol China, Dept Modern Phys, Chuzhou, Anhui, Peoples R China. [Andrei, V.; Antel, C.; Baas, A. E.; Brandt, O.; Djuvsland, J. I.; Dunford, M.; Geislera, M. P.; Hanke, P.; Jongmanns, J.; Kluge, E. -E.; Lang, V. S.; Meiera, K.; Zu Theenhausen, H. Meyer; Villar, D. I. Narrias; Sahinsoy, M.; Scharf, V.; Schultz-Coulon, H. -C.; Stamen, R.; Starovoitov, P.; Suchek, S.; Wessels, M.] Heidelberg Univ, Kirchhoff Inst Phys, Heidelberg, Germany. [Anders, C. F.; de Lima, D. E. Ferreira; Giulini, M.; Kolb, M.; Lisovyi, M.; Schaetzel, S.; Schoening, A.; Sosa, D.] Heidelberg Univ, Phys Inst, Heidelberg, Germany. [Kretz, M.; Kugel, A.] Heidelberg Univ, ZITI Inst Tech Informat, Mannheim, Germany. [Nagasaka, Y.] Hiroshima Inst Technol, Fac Appl Informat Sci, Hiroshima, Japan. [Bortolotto, V.; Chan, Y. L.; Castillo, L. R. Flores; Lu, H.; Salvucci, A.; Tsui, K. M.] Chinese Univ Hong Kong, Dept Phys, Shatin, Hong Kong, Peoples R China. [Bortolotto, V.; Orlando, N.; Prokofiev, K.; Salvucci, A.; Tu, Y.] Univ Hong Kong, Dept Phys, Clear Water Bay, Hong Kong, Hong Kong, Peoples R China. [Aloisio, A.; Alonso, A.; Calfayan, P.; Choi, K.; Evans, H.; Gagnon, P.; Kopeliansky, R.; Lammers, S.; Martinez, N. Lorenzo; Luehring, F.; Ogren, H.; Penwell, J.; Weinert, B.; Zieminska, D.] Indiana Univ, Dept Phys, Bloomington, IN 47405 USA. [Guenther, J.; Iwanski, W.; Jansky, R.; Kneringer, E.; Lukas, W.; Milic, A.] Leopold Franzens Univ, Inst Astro & Teilchenphys, Innsbruck, Austria. [Argyropoulos, S.; Benitez, J.; Mallik, U.; Zaidan, R.] Univ Iowa, Iowa City, IA USA. [Chen, C.; Cochran, J.; De Lorenzi, F.; Jiang, H.; Krumnack, N.; Pluth, D.; Prell, S.; Werner, M. D.; Yu, J.] Iowa State Univ, Dept Phys & Astron, Ames, IA USA. [Ahmadov, F.; Aleksandrov, I. N.; Bednyakov, V. A.; Boyko, I. R.; Budagov, I. A.; Chelkov, G. A.; Cheplakov, A.; Chizhov, M. V.; Dedovich, D. V.; Demichev, M.; Gongadze, A.; Gostkin, M. I.; Huseynov, N.; Javadov, N.; Karpov, S. N.; Karpov, Z. M.; Khramov, E.; Kruchonak, U.; Kukhtin, V.; Ladygin, E.; Lyubushkin, V.; Minashvili, I. A.; Mineev, M.; Peshekhonov, V. D.; Plotnikova, E.; Potrap, I. N.; Pozdnyakov, V.; Rusakovich, N. A.; Sadykov, R.; Sapronov, A.; Shiyakova, M.; Soloshenko, A.; Turchikhin, S.; Vinogradov, V. B.; Yeletskikh, I.; Zhemchugov, A.; Zimine, N. I.] JINR Dubna, Inst Nucl Res, Dubna, Russia. [Amako, K.; Aoki, M.; Arai, Y.; Hanagaki, K.; Honda, T.; Ikegami, Y.; Ikeno, M.; Iwasaki, H.; Kanzaki, J.; Kondo, T.; Kono, T.; Makida, Y.; Nagai, R.; Nagano, K.; Nakamura, K.; Nozaki, M.; Odaka, S.; Okuyama, T.; Sasaki, O.; Suzuki, S.; Takubo, Y.; Tanaka, S.; Terada, S.; Tokushuku, K.; Tsuno, S.; Unno, Y.; Usui, J.; Yamamoto, A.; Yasu, Y.] KEK, High Energy Accelerator Res Org, Tsukuba, Ibaraki, Japan. [Aloisio, A.; Chen, Y.; Hasegawa, M.; Kido, S.; Kurashige, H.; Maeda, J.; Ochi, A.; Shimizu, S.; Tanioka, R.; Yamazaki, Y.; Yuan, L.] Kobe Univ, Sch Sci, Kobe, Hyogo, Japan. [Kunigo, T.; Monden, R.; Sumida, T.; Tashiro, T.] Kyoto Univ, Fac Sci, Kyoto, Japan. [Takashima, R.] Kyoto Univ, Kyoto, Japan. [Kawagoe, K.; Oda, S.; Otono, H.; Shirabe, S.; Tojo, J.] Kyushu Univ, Dept Phys, Fukuoka, Japan. [Verzini, M. J. Alconada; Alonso, F.; Arduh, F. A.; Dova, M. T.; Hoya, J.; Monticelli, F.; Wahlberg, H.] Univ Nacl La Plata, Inst Fis La Plata, La Plata, Buenos Aires, Argentina. [Verzini, M. J. Alconada; Alonso, F.; Arduh, F. A.; Dova, M. T.; Hoya, J.; Monticelli, F.; Wahlberg, H.] Consejo Nacl Invest Cient & Tecn, La Plata, Buenos Aires, Argentina. [Barton, A. E.; Beattie, M. D.; Bertram, I. A.; Borissov, G.; Bouhova-Thacker, E. V.; Dearnaley, W. J.; Fox, H.; Grimm, K.; Henderson, R. C. W.; Hughes, G.; Jones, R. W. L.; Kartvelishvili, V.; Long, R. E.; Love, P. A.; Muenstermann, D.; Parker, A. J.; Skinner, M. B.; Smizanska, M.; Walder, J.; Wharton, A. M.] Univ Lancaster, Dept Phys, Lancaster, England. [Aliev, M.; Bachas, K.; Chiodini, G.; Gorini, E.; Longo, L.; Primavera, M.; Reale, M.; Spagnolo, S.; Ventura, A.] Ist Nazl Fis Nucl, Sez Lecce, Lecce, Italy. [Aliev, M.; Bachas, K.; Gorini, E.; Longo, L.; Reale, M.; Spagnolo, S.; Ventura, A.] Univ Salento, Dipartimento Matemat & Fis, Lecce, Italy. [Affolder, A. A.; Anders, J. K.; Burdin, S.; D'Onofrio, M.; Dervan, P.; Gwilliam, C. B.; Hayward, H. S.; Jones, T. J.; King, B. T.; Klein, M.; Klein, U.; Kretzschmar, J.; Laycock, P.; Lehan, A.; Maxfield, S. J.; Mehta, A.; Readioff, N. P.; Vossebeld, J. H.] Univ Liverpool, Oliver Lodge Lab, Liverpool, Merseyside, England. [Cindro, V.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Jozef Stefan Inst, Dept Phys, Ljubljana, Slovenia. [Cindro, V.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Univ Ljubljana, Ljubljana, Slovenia. [Armitage, L. J.; Bevan, A. J.; Bona, M.; Hays, M.; Hickling, R.; Landon, M. P. J.; Lewis, D.; Lloyd, S. L.; Morris, J. D.; Nooney, T.; Piccaro, E.; Rizvi, E.; Sandbach, R. L.] Queen Mary Univ London, Sch Phys & Astron, London, England. [Berry, T.; Boisvert, V.; Brooks, T.; Connelly, I. A.; Cowan, G.; Giannelli, M. Faucci; Gadomski, S.; George, S.; Gibson, S. M.; Kempster, J. J.; Kilby, C. R.; Vazquez, J. G. Panduro; Pastore, Fr.; Savage, G.; Sowden, B. C.; Spano, F.; Teixeira-Dias, P.; Thomas-Wilsker, J.] Royal Holloway Univ London, Dept Phys, Egham, Surrey, England. [Bell, A. S.; Butterworth, J. M.; Campanelli, M.; Christodoulou, V.; Cooper, B. D.; Davison, P.; Falla, R. J.; Freeborn, D.; Gregersen, K.; Grout, Z. J.; Ortiz, N. G. Gutierrez; Hesketh, G. G.; Jiggins, S.; Konstantinidis, N.; Korn, A.; Kucuk, H.; Leney, K. J. C.; Martyniuk, A. C.; McClymont, L. I.; Mcfayden, J. A.; Nurse, E.; Richter, S.; Scanlon, T.; Sherwood, P.; Simmons, B.; Wardrope, D. R.; Waugh, B. M.] UCL, Dept Phys & Astron, London, England. [Greenwood, Z. D.; Grossi, G. C.; Jana, D. K.; Sawyer, L.] Louisiana Tech Univ, Ruston, LA USA. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] UPMC, Lab Phys Nucl & Hautes Energies, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] Univ Paris Diderot, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] CNRS, IN2P3, Paris, France. [Akesson, T. P. A.; Bocchetta, S. S.; Bryngemark, L.; Doglioni, C.; Hedberg, V.; Jarlskog, G.; Lytken, E.; Mjornmark, J. U.; Smirnova, O.; Viazlo, O.] Lund Univ, Fys Inst, Lund, Sweden. [Barreiro, F.; Lopez, S. Calvente; Cueto, A.; Del Peso, J.; Glasman, C.; Terron, J.] Univ Autonoma Madrid, Dept Fis Teor C 15, Madrid, Spain. [Artz, S.; Becker, M.; Bertella, C.; Blum, W.; Buscher, V.; Cuth, J.; Dudder, A. Chr.; Endner, O. C.; Ertel, E.; Fiedler, F.; Torregrosa, E. Fullana; Geisen, M.; Groh, S.; Heck, T.; Jakobi, K. B.; Kaluza, A.; Karnevskiy, M.; Kleinknecht, K.; Kopke, L.; Lin, T. H.; Masetti, L.; Mattmann, J.; Meyer, C.; Moritz, S.; Pleskot, V.; Rave, S.; Reiss, A.; Schaeffer, J.; Schafer, U.; Schmitt, C.; Schmitz, S.; Schott, M.; Schuh, N.; Schulte, A.; Simioni, E.; Simon, M.; Tapprogge, S.; Urrejola, P.; Webb, S.; Yildirim, E.; Zimmermann, C.; Zinser, M.] Johannes Gutenberg Univ Mainz, Inst Phys, Mainz, Germany. [Barnes, S. L.; Bielski, R.; Cox, B. E.; Da Via, C.; Dann, N. S.; Forcolin, G. T.; Forti, A.; Ponce, J. M. Iturbe; Li, X.; Loebinger, F. K.; Marsden, S. P.; Masik, J.; Sanchez, F. J. Munoz; Neep, T. J.; Oh, A.; Ospanov, R.; Pater, J. R.; Peters, R. F. Y.; Pilkington, A. D.; Pin, A. W. J.; Price, D.; Qin, Y.; Queitsch-Maitland, M.; Raine, J. A.; Schweiger, H.; Shaw, S. M.; Tomlinson, L.; Watts, S.; Wilk, F.; Woudstra, M. J.; Wyatt, T. R.] Univ Manchester, Sch Phys & Astron, Manchester, Lancs, England. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.] Aix Marseille Univ, CPPM, Marseille, France. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.] CNRS, IN2P3, Marseille, France. [Bellomo, M.; Bernard, N. R.; Brau, B.; Dallapiccola, C.; Moyse, E. J. W.; Pais, P.; Pettersson, N. E.; Picazio, A.; Willocq, S.] Univ Massachusetts, Dept Phys, Amherst, MA 01003 USA. [Belanger-Champagne, C.; Chuinard, A. J.; Corriveau, F.; Keyes, R. A.; Lefebvre, B.; Mantifel, R.; Prince, S.; Robertson, S. H.; Robichaud-Veronneau, A.; Stockton, M. C.; Stoebe, M.; Vachon, B.; Schroeder, T. Vazquez; Wang, K.; Warburton, A.] McGill Univ, Dept Phys, Montreal, PQ, Canada. [Barberio, E. L.; Brennan, A. J.; Dawe, E.; Goldfarb, S.; Jennens, D.; Kubota, T.; Le, B.; McDonald, E. F.; Milesi, M.; Nuti, F.; Rados, P.; Scutti, F.; Spiller, L. A.; Tan, K. G.; Taylor, G. N.; Taylor, P. T. E.; Ungaro, F. C.; Urquijo, P.; Volpi, M.; Zanzi, D.] Univ Melbourne, Sch Phys, Melbourne, Vic 3010, Australia. [Amidei, D.; Chelstowska, M. A.; Cheng, H. C.; Dai, T.; Diehl, E. B.; Edgar, R. C.; Feng, H.; Ferretti, C.; Fleischmann, P.; Guan, L.; Levin, D.; Liu, H.; Lu, N.; Marley, D. E.; Mc Kee, S. P.; McCarn, A.; Neal, H. A.; Qian, J.; Schwarz, T. A.; Searcy, J.; Sekhon, K.; Wu, Y.; Yu, J. M.; Zhang, D.; Zhou, B.; Zhu, J.] Univ Michigan, Dept Phys, Ann Arbor, MI 48109 USA. [Arabidze, G.; Brock, R.; Chegwidden, A.; De la Torre, H.; Fisher, W. C.; Halladjian, G.; Hauser, R.; Hayden, D.; Huston, J.; Martin, B.; Mondragon, M. C.; Plucinski, P.; Pope, B. G.; Schoenrock, B. D.; Schwienhorst, R.; Willis, C.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Alimonti, G.; Andreazza, A.; Camplani, A.; Carminati, L.; Cavalli, D.; Citterio, M.; Costa, G.; Fanti, M.; Giugni, D.; Lari, T.; Lazzaroni, M.; Mandelli, L.; Manzoni, S.; Mazza, S. M.; Meroni, C.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Resconi, S.; Shojaii, S.; Stabilea, A.; Tartarelli, G. F.; Troncon, C.; Turra, R.; Perez, M. Villaplana] Ist Nazl Fis Nucl, Sez Milano, Milan, Italy. [Andreazza, A.; Camplani, A.; Carminati, L.; Fanti, M.; Lazzaroni, M.; Manzoni, S.; Mazza, S. M.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Shojaii, S.; Turra, R.; Perez, M. Villaplana] Univ Milan, Dipartimento Fis, Milan, Italy. [Harkusha, S.; Kulchitsky, Y.; Kurochkin, Y. A.; Tsiareshka, P. V.] Natl Acad Sci Belarus, BI Stepanov Inst Phys, Minsk, Byelarus. [Hrynevich, A.] Natl Sci & Educ Ctr Particle & High Energy Phys, Minsk, Byelarus. [Arguin, J-F.; Azuelos, G.; Billoud, T. R. V.; Dallaire, F.; Ducu, O. A.; Gagnon, L. G.; Gauthier, L.; Leroy, C.; Mochizuki, K.; Manh, T. Nguyen; Rezvani, R.; Saadi, D. Shoaleh] Univ Montreal, Grp Particle Phys, Montreal, PQ, Canada. [Akimov, A. V.; Gavrilenko, I. L.; Komar, A. A.; Mashinistov, R.; Nechaeva, P. Yu.; Shmeleva, A.; Snesarev, A. A.; Sulin, V. V.; Tikhomirov, V. O.; Zhukov, K.] Russian Acad Sci, PN Lebedev Phys Inst, Moscow, Russia. [Artamonov, A.; Gorbounov, P. A.; Khovanskiy, V.; Shatalov, P. B.; Tsukerman, I. I.] Inst Theoret & Expt Phys ITEP, Moscow, Russia. [Antonov, A.; Belotskiy, K.; Belyaev, N. L.; Bulekov, O.; Kantserov, V. A.; Krasnopevtsev, D.; Romaniouk, A.; Shulga, E.; Smirnov, S. Yu.; Smirnov, Y.; Soldatov, E. Yu.; Timoshenko, S.; Vorobev, K.] Natl Res Nucl Univ MEPhI, Moscow, Russia. [Gladilin, L. K.; Kramarenko, V. A.; Maevskiy, A.; Sivoklokov, S. Yu.; Smirnova, L. N.] Moscow MV Lomonosov State Univ, DV Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Adomeit, S.; Bender, M.; Biebel, O.; Bock, C.; Chow, B. K. B.; Duckeck, G.; Hartmann, N. M.; Heinrich, J. J.; Hertenberger, R.; Hoenig, F.; Legger, F.; Lorenz, J.; Losel, P. J.; Maier, T.; Mann, A.; Mehlhase, S.; Meineck, C.; Mitrevski, J.; Mueller, R. S. P.; Rauscher, F.; Ruschke, A.; Schachtner, B. M.; Schaile, D.; Unverdorben, C.; Valderanis, C.; Walker, R.; Wittkowski, J.] Ludwig Maximilians Univ Munchen, Fak Phys, Munich, Germany. [Barillari, T.; Bethke, S.; Compostella, G.; Cortiana, G.; Ecker, K. M.; Flowerdew, M. J.; Giuliani, C.; Ince, T.; Kiryunin, A. E.; Kluth, S.; Koehler, N. M.; Kortner, O.; Kortner, S.; Kroha, H.; La Rosa, A.; Macchiolo, A.; Maier, A. A.; McCarthy, T. G.; Menke, S.; Mueller, F.; Nisius, R.; Nowak, S.; Oberlack, H.; Richter, R.; Salihagic, D.; Savic, N.; Schacht, P.; Schmidt-Sommerfeld, K. R.; Spettel, F.; Stonjek, S.; von der Schmitt, H.; Wildauer, A.] Werner Heisenberg Inst, Max Planck Inst Physik, Munich, Germany. [Fusayasu, T.; Shimojima, M.] Nagasaki Inst Appl Sci, Nagasaki, Japan. [Horii, Y.; Kawade, K.; Nakahama, Y.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Grad Sch Sci, Nagoya, Aichi, Japan. 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[Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van DenWollenberg, W.; Van Der Deijl, P. C.; Van der Graaf, H.; van Vulpen, I.; van Woerden, M. C.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.; Wolf, T. M. H.] Nikhef Natl Inst Subat Phys, Amsterdam, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van DenWollenberg, W.; Van Der Deijl, P. C.; Van der Graaf, H.; van Vulpen, I.; van Woerden, M. C.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.; Wolf, T. M. H.] Univ Amsterdam, Amsterdam, Netherlands. [Adelman, J.; Aloisio, A.; Alonso, A.; Brost, E.; Burghgrave, B.; Chakraborty, D.; Klimek, P.; Saha, P.] Northern Univ Illinois, Dept Phys, De Kalb, IL USA. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Bogdanchikov, A. G.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Kharlamova, T.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] RAS, SB, Budker Inst Nucl Phys, Novosibirsk, Russia. [Becot, C.; Bernius, C.; Cranmer, K.; Haas, A.; Heinrich, L.; Kaplan, B.; Karthik, K.; Konoplich, R.; Mincer, A. 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M.; Torrence, E.; Wanotayaroj, C.; Whalen, K.; Winklmeier, F.] Univ Oregon, Ctr High Energy Phys, Eugene, OR 97403 USA. [Abeloos, B.; Ayoub, M. K.; Bassalat, A.; Binet, S.; Bourdarios, C.; De Regie, J. B. De Vivie; Delgove, D.; Duflot, L.; Escalier, M.; Fayard, L.; Fournier, D.; Gkougkousis, E. L.; Goudet, C. R.; Grivaz, J. -F.; Hariri, F.; Henrot-Versille, S.; Hrivnac, J.; Iconomidou-Fayard, L.; Kado, M.; Lounis, A.; Maiani, C.; Makovec, N.; Morange, N.; Nellist, C.; Petroff, P.; Poggioli, L.; Puzo, P.; Rousseau, D.; Rybkin, G.; Schaffer, A. C.; Serin, L.; Simion, S.; Tanaka, R.; Zerwas, D.; Zhang, Z.] Univ Paris Saclay, LAL, Univ Paris Sud, CNRS,IN2P3, Orsay, France. [Ishijima, N.; Nomachi, M.; Sugaya, Y.; Teoh, J. J.; Yamaguchi, Y.] Osaka Univ, Sch Sci, Osaka, Japan. [Bugge, M. K.; Cameron, D.; Catmore, J. R.; Feigl, S.; Franconi, L.; Garonne, V.; Gjelsten, B. K.; Gramstad, E.; Morisbak, V.; Nilsen, J. K.; Ould-Saada, F.; Pajchel, K.; Pedersen, M.; Raddum, S.; Read, A. L.; Rohne, O.; Sandaker, H.; Serfon, C.; Stapnes, S.; Strandlie, A.] Univ Oslo, Dept Phys, Oslo, Norway. [Artoni, G.; Backes, M.; Barr, A. J.; Becker, K.; Beresford, L.; Bortoletto, D.; Burr, J. T. P.; Cooper-Sarkar, A. M.; Ortuzar, M. Crispin; Fawcett, W. J.; Frost, J. A.; Gallas, E. J.; Giuli, F.; Gupta, S.; Gwenlan, C.; Hays, P.; Henderson, J.; Huffman, T. B.; Issever, C.; Kalderon, C. W.; Nagai, K.; Nickerson, R. B.; Norjoharuddeen, N.; Petrov, M.; Pickering, M. A.; Radescu, V.; Tseng, J. C-L.; Viehhauser, G. H. A.; Vigani, L.; Weidberg, A. R.; Zhong, J.] Univ Oxford, Dept Phys, Oxford, England. [Dondero, P.; Farina, E. M.; Ferrari, R.; Fraternali, M.; Gaudio, G.; Introzzi, G.; Kourkoumeli-Charalampidi, A.; Lanza, A.; Livan, M.; Negri, A.; Polesello, G.; Rebuzzi, D. M.; Rimoldi, A.; Vercesi, V.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Dondero, P.; Farina, E. M.; Fraternali, M.; Introzzi, G.; Kourkoumeli-Charalampidi, A.; Livan, M.; Negri, A.; Rebuzzi, D. M.; Rimoldi, A.] Univ Pavia, Dipartimento Fis, Pavia, Italy. [Balunas, W. K.; Brendlinger, K.; Di Clemente, W. K.; Fletcher, R. R. M.; Haney, B.; Heim, S.; Hines, E.; Jackson, B.; Kroll, J.; Lipeles, E.; Miguens, J. Machado; Meyer, C.; Mistry, K. P.; Reichert, J.; Schaefer, L.; Thomson, E.; Vanguri, R.; Williams, H. H.; Yoshihara, K.] Univ Penn, Dept Phys, Philadelphia, PA 19104 USA. [Basalaev, A.; Ezhilov, A.; Fedin, O. L.; Gratchev, V.; Levchenko, M.; Maleev, V. P.; Naryshkin, I.; Ryabov, Y. F.; Schegelsky, V. A.; Seliverstov, D. M.; Solovyev, V.] Natl Res Ctr, BP Konstantinov Petersburg Nucl Phys Inst, Kurchatov Inst, St Petersburg, Russia. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Univ Pisa, Dipartimento Fis E Fermi, Pisa, Italy. [Bianchi, R. M.; Boudreau, J.; Escobar, C.; Farina, C.; Hong, T. M.; Mueller, J.; Sapp, K.; Su, J.] Univ Pittsburgh, Dept Phys & Astron, Pittsburgh, PA 15260 USA. [Aguilar-Saavedra, J. A.; Dos Santos, S. P. Amor; Amorim, A.; Araque, J. P.; Carvalho, J.; Castro, N. F.; Muino, P. Conde; De Sousa, M. J. Da Cunha Sargedas; Fiolhais, M. C. N.; Galhardo, B.; Gomes, A.; Goncalo, R.; Jorge, P. M.; Maio, A.; Maneira, J.; Seabra, L. F. Oleiro; Onofre, A.; Pedro, R.; Santos, H.; Saraiva, J. G.; Silva, J.; Delgado, A. Tavares; Veloso, F.; Wolters, H.] LIP, Lab Instrumentacao & Fis Expt Particulas, Lisbon, Portugal. [Muino, P. Conde; De Sousa, M. J. Da Cunha Sargedas; Gomes, A.; Jorge, P. M.; Miguens, J. Machado; Maio, A.; Maneira, J.; Pedro, R.; Delgado, A. Tavares] Univ Lisbon, Fac Ciencias, Lisbon, Portugal. [Dos Santos, S. P. Amor; Carvalho, J.; Fiolhais, M. C. N.; Galhardo, B.; Veloso, F.; Wolters, H.] Univ Coimbra, Dept Phys, Coimbra, Portugal. [Gomes, A.; Maio, A.; Saraiva, J. G.; Silva, J.] Univ Lisbon, Ctr Fis Nucl, Lisbon, Portugal. [Onofre, A.] Univ Minho, Dept Fis, Braga, Portugal. [Aguilar-Saavedra, J. A.] Univ Granada, Dept Fis Teor & Cosmos, Granada, Spain. [Aguilar-Saavedra, J. A.] Univ Granada, CAFPE, Granada, Spain. Univ Nova Lisboa, Dept Fis, Fac Ciencias & Tecnol, Caparica, Portugal. Univ Nova Lisboa, CEFITEC, Fac Ciencias & Tecnol, Caparica, Portugal. [Chudoba, J.; Havranek, M.; Hejbal, J.; Jakoubek, T.; Kepka, O.; Kupco, A.; Kus, V.; Lokajicek, M.; Lysak, R.; Marcisovsky, M.; Mikestikova, M.; Nemecek, S.; Penc, O.; Sicho, P.; Staroba, P.; Svatos, M.; Tasevsky, M.; Vrba, V.] Acad Sci Czech Republic, Inst Phys, Prague, Czech Republic. [Ali, B.; Augsten, K.; Caforio, D.; Gallus, P.; Hubacek, Z.; Myska, M.; Pospisil, S.; Seifert, F.; Simak, V.; Slavicek, T.; Smolek, K.; Solar, M.; Sopczak, A.; Sopko, V.; Suk, M.; Turecek, D.; Vacek, V.; Vlasak, M.; Vokac, P.; Vykydal, Z.; Zeman, M.] Czech Tech Univ, Prague, Czech Republic. [Berta, P.; Carli, I.; Davidek, T.; Dolejsi, J.; Dolezal, Z.; Kodys, P.; Kosek, T.; Leitner, R.; Mlynarikova, M.; Reznicek, P.; Scheirich, D.; Slovak, R.; Spousta, M.; Sykora, T.; Tas, P.; Todorova-Nova, S.; Valkar, S.; Vorobel, V.] Charles Univ Prague, Fac Math & Phys, Prague, Czech Republic. [Borisov, A.; Cheremushkina, E.; Denisov, S. P.; Fakhrutdinov, R. M.; Fenyuk, A. B.; Golubkov, D.; Kamenshchikov, A.; Karyukhin, A. N.; Kozhin, A. S.; Minaenko, A. A.; Myagkov, A. G.; Nikolaenko, V.; Ryzhov, A.; Solodkov, A. A.; Solovyanov, O. V.; Starchenko, E. A.; Zaitsev, A. M.; Zenin, O.] NRC KI, State Res Ctr Inst High Energy Phys Protvino, Moscow, Russia. [Adye, T.; Baines, J. T.; Barnett, B. M.; Burke, S.; Dewhurst, A.; Dopke, J.; Emeliyanov, D.; Gallop, B. J.; Gee, C. N. P.; Haywood, S. J.; Kirk, J.; Martin-Haugh, S.; McMahon, S. J.; Middleton, R. P.; Murray, W. J.; Phillips, P. W.; Sankey, D. P. C.; Sawyer, C.; Tyndel, M.; Wickens, F. J.; Wielers, M.; Worm, S. D.] Rutherford Appleton Lab, Particle Phys Dept, Didcot, Oxon, England. [Anulli, F.; Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; De Pedis, D.; De Salvo, A.; Falciano, S.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Luminari, L.; Messina, A.; Nisati, A.; Pasqualucci, E.; Petrolo, E.; Pontecorvoa, L.; Rescigno, M.; Rosati, S.; Tehrani, F. Safai; Vanadia, M.; Vari, R.; Veneziano, S.; Verducci, M.; Zanello, L.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Messina, A.; Vanadia, M.; Verducci, M.; Zanello, L.] Sapienza Univ Roma, Dipartimento Fis, Rome, Italy. [Aielli, G.; Camarri, P.; Cardarelli, R.; Cerrito, L.; Di Ciaccio, A.; Liberti, B.; Salamon, A.; Santonico, R.] Ist Nazl Fis Nucl, Sez Roma Tor Vergata, Rome, Italy. [Aielli, G.; Camarri, P.; Cerrito, L.; Di Ciaccio, A.; Salamon, A.; Santonico, R.] Univ Roma Tor Vergata, Dipartimento Fis, Rome, Italy. [Baroncelli, A.; Biglietti, M.; Ceradini, F.; Di Micco, B.; Farilla, A.; Graziani, E.; Iodice, M.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Stanescu, C.; Taccini, C.] Ist Nazl Fis Nucl, Sez Roma Tre, Rome, Italy. [Ceradini, F.; Di Micco, B.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Taccini, C.] Univ Roma Tre, Dipartimento Matemat & Fis, Rome, Italy. [Benchekroun, D.; Chafaq, A.; Hoummada, A.] Univ Hassan 2, Reseau Univ Phys Hautes Energies, Fac Sci Ain Chock, Casablanca, Morocco. Ctr Natl Energie Sci Tech Nucl, Rabat, Morocco. [El Kacimi, M.; Goujdami, D.] Univ Cadi Ayyad, LPHEA Marrakech, Fac Sci Semlalia, Marrakech, Morocco. [Aaboud, M.; Derkaouid, J. E.; Ouchrif, M.] Univ Mohamed Premier, Fac Sci, Oujda, Morocco. [Aaboud, M.; Derkaouid, J. E.; Ouchrif, M.] LPTPM, Oujda, Morocco. [El Moursli, R. Cherkaoui; Ezzi, M.; Fassi, F.; Haddad, N.; Idrissi, Z.; Tayalati, Y.] Univ Mohammed 5, Fac Sci, Rabat, Morocco. [Bachacou, H.; Balli, F.; Bauer, F.; Besson, N.; Blanchard, J. -B.; Boonekamp, M.; Chevalier, L.; Hoffmann, M. Dano; Deliot, F.; Denysiuk, D.; Etienvre, A. I.; Formica, A.; Giraud, P. F.; Da Costa, J. Goncalves Pinto Firmino; Guyot, C.; Hanna, R.; Hassani, S.; Jeanneau, F.; Kivernyk, O.; Kozanecki, W.; Kukla, R.; Lancon, E.; Laporte, J. F.; Le Quilleuc, E. P.; Lesage, A. A. J.; Mansoulie, B.; Meyer, J-P.; Nicolaidou, R.; Ouraou, A.; Rodriguez, L. Pacheco; Perego, M. M.; Peyaud, A.; Saimpert, M.; Schoeffel, L.; Schune, Ph.; Schwemling, Ph.; Schwindling, J.] CEA Saclay, Commissariat Energie Atom & Energies Alternat, DSM IRFU Inst Rech Lois Fondament Univers, Gif Sur Yvette, France. [Zeid, O. S. Abou; Battaglia, M.; Debenedetti, C.; Grillo, A. A.; Hance, M.; Kuhl, A.; Law, A. T.; Litke, A. M.; Nielsen, J.; Reece, R.; Rose, P.; Sadrozinski, H. F-W.; Schier, S.; Schumm, B. A.; Seiden, A.] Univ Calif Santa Cruz, Santa Cruz Inst Particle Phys, Santa Cruz, CA 95064 USA. [Alpigiani, C.; Blackburn, D.; Goussiou, A. G.; Hsu, S. -C.; Johnson, W. J.; Lubatti, H. J.; Meehan, S.; Rompotis, N.; Rosten, R.; Rothberg, J.; Russell, H. L.; De Bruin, P. H. Sales; Pastor, E. Torro; Watts, G.; Whallon, N. L.] Univ Washington, Dept Phys, Seattle, WA 98195 USA. [Du, Y.; Feng, C.; Ma, L. L.; Ma, Y.; Wang, C.; Zhang, X.; Zhao, Y.; Zhu, C. G.] Shandong Univ, Sch Phys, Jinan, Shandong, Peoples R China. [Bret, M. Cano; Guo, J.; Hu, S.; Li, L.; Yang, H.] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai Key Lab Particle Phys & Cosmol, Shanghai, Peoples R China. [Anastopoulos, C.; Costanzo, D.; Donszelmann, T. Cuhadar; Dawson, I.; Fletcher, G. T.; Hamity, G. N.; Hodgkinson, M. C.; Hodgson, P.; Johansson, P.; Klinger, J. A.; Korolkova, E. V.; Kyriazopoulos, D.; Paredes, B. Lopez; Macdonald, C. M.; Miyagawa, P. S.; Parker, K. A.; Tovey, D. R.; Vickey, T.; Boeriu, O. E. Vickey] Univ Sheffield, Dept Phys & Astron, Sheffield, S Yorkshire, England. [Hasegawa, Y.; Takeshita, T.] Shinshu Univ, Dept Phys, Nagano, Japan. [Atlay, N. B.; Buchholz, P.; Campoverde, A.; Czirr, H.; Fleck, I.; Ghasemi, S.; Ibragimov, I.; Li, Y.; Walkowiak, W.; Ziolkowski, M.] Univ Siegen, Fachbereich Phys, Siegen, Germany. [Buat, Q.; Horton, A. J.; Mori, D.; O'Neil, D. C.; Pachal, K.; Stelzer, B.; Temple, D.; Torres, H.; Van Nieuwkoop, J.; Vetterli, M. C.] Simon Fraser Univ, Dept Phys, Burnaby, BC, Canada. [Armbruster, A. J.; Barklow, T.; Bartoldus, R.; Bawa, H. S.; Black, J. E.; Gao, Y. S.; Garelli, N.; Grenier, P.; Ilic, N.; Jiang, Z.; Kagan, M.; Kocian, M.; Koi, T.; Malone, C.; Moss, J.; Mount, R.; Nachman, B. P.; Piacquadio, G.; Rubbo, F.; Salnikov, A.; Schwartzman, A.; Su, D.; Tompkins, L.; Wittgen, M.; Young, C.; Zeng, Q.] SLAC Natl Accelerator Lab, Stanford, CA USA. [Astalos, R.; Bartos, P.; Blazek, T.; Bruncko, D.; Dado, T.; Kladiva, E.; Melo, M.; Plazak, L.; Smiesko, J.; Strizenec, P.; Sykora, I.; Tokar, S.; Urban, J.; Zenis, T.] Comenius Univ, Fac Math Phys & Informat, Bratislava, Slovakia. [Bruncko, D.; Kladiva, E.; Strizenec, P.; Urban, J.] Slovak Acad Sci, Inst Expt Phys, Dept Subnucl Phys, Kosice, Slovakia. [Castaneda-Miranda, E.; Hamilton, A.; Yacoob, S.] Univ Cape Town, Dept Phys, Cape Town, South Africa. [Connell, S. H.; Govender, N.] Univ Johannesburg, Dept Phys, Johannesburg, South Africa. [Hsuc, C.; Jivan, H.; Kar, D.; Garcia, B. R. Mellado; Reed, R. G.; Ruan, X.; Haddad, E. Sideras] Univ Witwatersrand, Sch Phys, Johannesburg, South Africa. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Bohm, C.; Carney, R. M. D.; Clement, C.; Cribbs, W. A.; Gellerstedt, K.; Hellman, S.; Jonand, K.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Silverstein, S. B.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Santurio, E. Valdes; Wallangen, V.] Stockholm Univ, Dept Phys, Stockholm, Sweden. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Carney, R. M. D.; Clement, C.; Cribbs, W. A.; Gellerstedt, K.; Hellman, S.; Jonand, K.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Santurio, E. Valdes; Wallangen, V.] Oskar Klein Ctr, Stockholm, Sweden. [Kastanas, A.; Lund-Jensen, B.; Sidebo, P. E.; Strandberg, J.] Royal Inst Technol, Dept Phys, Stockholm, Sweden. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; McCarthy, R. L.; Montalbano, A.; Morvaj, L.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; McCarthy, R. L.; Montalbano, A.; Morvaj, L.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA. [Abraham, N. L.; Allbrooke, B. M. M.; Asquith, L.; Cerri, A.; Barajas, C. A. Chavez; De Sanctis, U.; De Santo, A.; Lerner, G.; Miano, F.; Salvatore, F.; Castillo, I. Santoyo; Shehu, C. Y.; Suruliz, K.; Sutton, M. R.; Vivarelli, I.; Winston, O. J.] Univ Sussex, Dept Phys & Astron, Brighton, E Sussex, England. [Black, C. W.; Finelli, K. D.; Jeng, G. -Y.; Limosani, A.; Morley, A. K.; Saavedra, A. F.; Scarcella, M.; Varvell, K. E.; Wang, J.; Yabsley, B.] Univ Sydney, Sch Phys, Sydney, NSW, Australia. [Hou, S.; Hsu, P. J.; Lee, S. C.; Lin, S. C.; Liu, B.; Liu, D.; Lo Sterzo, F.; Mazini, R.; Shi, L.; Soh, D. A.; Teng, P. K.; Wang, S. M.; Yang, Y.] Acad Sinica, Inst Phys, Taipei, Taiwan. [Abreu, H.; Gabizon, O.; Gozani, E.; Rozen, Y.; Tarem, S.; van Eldik, N.] Technion Israel Inst Technol, Dept Phys, Haifa, Israel. [Abramowicz, H.; Alexander, G.; Ashkenazi, A.; Bella, G.; Benary, O.; Benhammou, Y.; Davies, M.; Duarte-Campderros, J.; Etzion, E.; Gershon, A.; Gueta, O.; Oren, Y.; Soffer, A.; Taiblum, N.] Tel Aviv Univ, Raymond & Beverly Sackler Sch Phys & Astron, Tel Aviv, Israel. [Gentsos, C.; Gkaitatzis, S.; Gkialas, I.; Iliadis, D.; Kimura, N.; Kordas, K.; Maznas, I.; Papageorgiou, K.; Petridou, C.; Sampsonidis, D.] Aristotle Univ Thessaloniki, Dept Phys, Thessaloniki, Greece. [Adachi, S.; Asai, S.; Chen, S.; Enari, Y.; Hanawa, K.; Ishino, M.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kishimoto, T.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Minegishi, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Okumura, Y.; Saito, T.; Sakamoto, H.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Int Ctr Elementary Particle Phys, Tokyo, Japan. [Adachi, S.; Asai, S.; Chen, S.; Enari, Y.; Hanawa, K.; Ishino, M.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kishimoto, T.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Minegishi, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Okumura, Y.; Saito, T.; Sakamoto, H.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Dept Phys, Tokyo, Japan. [Bratzler, U.; Fukunaga, C.] Tokyo Metropolitan Univ, Grad Sch Sci & Technol, Tokyo, Japan. [Hayakawa, D.; Ishitsuka, M.; Jinnouchi, O.; Kobayashi, D.; Kuze, M.; Motohashi, K.; Tanaka, M.; Todome, K.; Yamaguchi, D.] Tokyo Inst Technol, Dept Phys, Tokyo, Japan. [Vaniachine, A.] Tomsk State Univ, Tomsk, Russia. [Batista, S. J.; Chau, C. C.; Cormier, K. J. R.; DeMarco, D. A.; Di Sipio, R.; Diamond, M.; Keoshkerian, H.; Krieger, P.; Liblong, A.; Mc Goldrick, G.; Orr, R. S.; Pascuzzi, V. R.; Polifka, R.; Rudolph, M. S.; Savard, P.; Sinervo, P.; Taenzer, J.; Teuscher, R. J.; Trischuk, W.; Veloce, L. M.; Venturi, N.] Univ Toronto, Dept Phys, Toronto, ON, Canada. [Iuppa, R.] Ist Nazl Fis Nucl, TIFPA, Trento, Italy. [Iuppa, R.] Univ Trento, Trento, Italy. [Canepa, A.; Chekulaev, S. V.; Hod, N.; Jovicevic, J.; Codina, E. Perez; Schneider, B.; Stelzer-Chilton, O.; Tafirout, R.; Trigger, I. M.] TRIUMF, Vancouver, BC, Canada. [Ramos, J. Manjarres; Palacino, G.; Taylor, W.] York Univ, Dept Phys & Astron, Toronto, ON, Canada. [Hagihara, M.; Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Fac Pure & Appl Sci, Tsukuba, Ibaraki, Japan. [Hagihara, M.; Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Ctr Integrated Res Fundamental Sci & Engn, Tsukuba, Ibaraki, Japan. [Beauchemin, P. H.; Meoni, E.; Sliwa, K.; Son, H.; Wetter, J.] Tufts Univ, Dept Phys & Astron, Medford, MA 02155 USA. [Casper, D. W.; Colombo, T.; Frate, M.; Guest, D.; Lankford, A. J.; Mete, A. S.; Nelson, A.; Ntekas, K.; Scannicchio, D. A.; Schernau, M.; Shimmin, C. O.; Taffard, A.; Unel, G.; Whiteson, D.] Univ Calif Irvine, Dept Phys & Astron, Irvine, CA 92697 USA. [Acharya, B. S.; Boldyrev, A. S.; Cheatham, S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Quayle, W. B.; Serkin, L.; Shaw, K.; Soualah, R.; Truong, L.] Ist Nazl Fis Nucl, Grp Collegato Udine, Sez Trieste, Udine, Italy. [Acharya, B. S.; Quayle, W. B.; Serkin, L.; Shaw, K.] Abdus Salaam Int Ctr Theoret Phys, Trieste, Italy. [Boldyrev, A. S.; Cheatham, S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Soualah, R.; Truong, L.] Univ Udine, Dipartimento Chim Fis & Ambiente, Udine, Italy. [Kuutmann, E. Bergeaas; Brenner, R.; Ekelof, T.; Ellert, M.; Ferrari, A.; Maddocks, H. J.; Ohman, H.; Rangel-Smith, C.] Uppsala Univ, Dept Phys & Astron, Uppsala, Sweden. [Atkinson, M.; Armadans, R. Caminal; Cavaliere, V.; Chang, P.; Errede, S.; Hooberman, B. H.; Khader, M.; Lie, K.; Liss, T. M.; Liu, L.; Long, J. D.; Outschoorn, V. I. Martinez; Neubauer, M. S.; Rybar, M.; Shang, R.; Sickles, A. M.; Vichou, I.; Zeng, J. C.; Zhang, M.] Univ Illinois, Dept Phys, 1110 W Green St, Urbana, IL 61801 USA. [Piqueras, D. Alvarez; Navarro, L. Barranco; Urban, S. Cabrera; Gimenez, V. Castillo; Alberich, L. Cerda; Costa, M. J.; Martinez, P. Fernandez; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Navarro, J. E. Garcia; de la Hoz, S. Gonzalez; Jimenez, Y. Hernandez; Higon-Rodriguez, E.; Pena, J. Jimenez; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Lopez, S. Pedraza; Rodriguez, D. Rodriguez; Adam, E. Romero; Ros, E.; Salt, J.; Sanchez, J.; Martinez, V. Sanchez; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, Inst Fis Corpuscular IFIC, Valencia, Spain. [Piqueras, D. Alvarez; Navarro, L. Barranco; Urban, S. Cabrera; Gimenez, V. Castillo; Alberich, L. Cerda; Costa, M. J.; Martinez, P. Fernandez; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Navarro, J. E. Garcia; de la Hoz, S. Gonzalez; Jimenez, Y. Hernandez; Higon-Rodriguez, E.; Pena, J. Jimenez; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Lopez, S. Pedraza; Rodriguez, D. Rodriguez; Adam, E. Romero; Ros, E.; Salt, J.; Sanchez, J.; Martinez, V. Sanchez; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, Dept Fis Atom Mol & Nucl, Valencia, Spain. [Piqueras, D. Alvarez; Navarro, L. Barranco; Urban, S. Cabrera; Gimenez, V. Castillo; Alberich, L. Cerda; Costa, M. J.; Martinez, P. Fernandez; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Navarro, J. E. Garcia; de la Hoz, S. Gonzalez; Jimenez, Y. Hernandez; Higon-Rodriguez, E.; Pena, J. Jimenez; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Lopez, S. Pedraza; Rodriguez, D. Rodriguez; Adam, E. Romero; Ros, E.; Salt, J.; Sanchez, J.; Martinez, V. Sanchez; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, Dept Ingn Elect, Valencia, Spain. [Piqueras, D. Alvarez; Navarro, L. Barranco; Urban, S. Cabrera; Gimenez, V. Castillo; Alberich, L. Cerda; Costa, M. J.; Martinez, P. Fernandez; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Navarro, J. E. Garcia; de la Hoz, S. Gonzalez; Jimenez, Y. Hernandez; Higon-Rodriguez, E.; Pena, J. Jimenez; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Lopez, S. Pedraza; Rodriguez, D. Rodriguez; Adam, E. Romero; Ros, E.; Salt, J.; Sanchez, J.; Martinez, V. Sanchez; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, IMB, CNM, Valencia, Spain. [Piqueras, D. Alvarez; Navarro, L. Barranco; Urban, S. Cabrera; Gimenez, V. Castillo; Alberich, L. Cerda; Costa, M. J.; Martinez, P. Fernandez; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Navarro, J. E. Garcia; de la Hoz, S. Gonzalez; Jimenez, Y. Hernandez; Higon-Rodriguez, E.; Pena, J. Jimenez; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Lopez, S. Pedraza; Rodriguez, D. Rodriguez; Adam, E. Romero; Ros, E.; Salt, J.; Sanchez, J.; Martinez, V. Sanchez; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] CSIC, Valencia, Spain. [Danninger, M.; Fedorko, W.; Gay, C.; Gecse, Z.; Gignac, M.; Henkelmann, S.; Lister, A.] Univ British Columbia, Dept Phys, Vancouver, BC, Canada. [Albert, J.; David, C.; Elliot, A. A.; Fincke-Keeler, M.; Hamano, K.; Hill, E.; Keeler, R.; Kowalewski, R.; Kuwertz, E. S.; Kwan, T.; LeBlanc, M.; Lefebvre, M.; McPherson, R. A.; Pearce, J.; Seuster, R.; Sobie, R.; Trovatelli, M.; Venturi, M.] Univ Victoria, Dept Phys & Astron, Victoria, BC, Canada. [Beckingham, M.; Ennis, J. S.; Farrington, S. M.; Harrison, P. F.; Jeske, C.; Jones, G.; Martin, T. A.; Murray, W. J.; Pianori, E.; Spangenberg, M.] Univ Warwick, Dept Phys, Coventry, W Midlands, England. [Iizawa, T.; Kaji, T.; Mitani, T.; Sakurai, Y.; Yorita, K.] Waseda Univ, Tokyo, Japan. [Balek, P.; Bressler, S.; Citron, Z. H.; Duchovni, E.; Dumancic, M.; Gross, E.; Kohler, M. K.; Lellouch, D.; Levinson, L. J.; Mikenberg, G.; Milov, A.; Pitt, M.; Ravinovich, I.; Roth, I.; Schaarschmidt, J.; Smakhtin, V.; Turgeman, D.] Weizmann Inst Sci, Dept Particle Phys, Rehovot, Israel. [Banerjee, Sw.; Guan, W.; Hard, A. S.; Heng, Y.; Ji, H.; Ju, X.; Kaplan, L. S.; Kashif, L.; Ming, Y.; Wang, F.; Wiedenmann, W.; Wu, S. L.; Yang, H.; Zhang, F.; Zhou, C.; Zobernig, G.] Univ Wisconsin, Dept Phys, 1150 Univ Ave, Madison, WI 53706 USA. [Herget, V.; Kuger, F.; Redelbach, A.; Schreyer, M.; Sidiropoulou, O.; Siragusa, G.; Strohmer, R.; Trefzger, T.; Weber, S. 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[Rodina, Y.] Barcelona Inst Sci & Technol, Inst Fis Altes Energies, Barcelona, Spain. [Shi, L.] Sun Yat Sen Univ, Sch Phys & Engn, Guangzhou, Guangdong, Peoples R China. [Smirnova, L. N.] Bulgarian Acad Sci, Inst Nucl Res & Nucl Energy, Sofia, Bulgaria. Moscow MV Lomonosov State Univ, Fac Phys, Moscow, Russia. [Song, H. Y.; Zhang, G.] Acad Sinica, Inst Phys, Taipei, Taiwan. [Tikhomirov, V. O.] Natl Res Nucl Univ MEPhI, Moscow, Russia. [Tompkins, L.] Stanford Univ, Dept Phys, Stanford, CA 94305 USA. [Toth, J.] Wigner Res Ctr Phys, Inst Particle & Nucl Phys, Budapest, Hungary. [Vest, A.] Flensburg Univ Appl Sci, Flensburg, Germany. [Yusuff, I.] Univ Malaya, Dept Phys, Kuala Lumpur, Malaysia. [Zhang, R.] Aix Marseille Univ, CPPM, Marseille, France. [Zhang, R.] CNRS, IN2P3, Marseille, France. RP Aaboud, M (reprint author), Univ Mohamed Premier, Fac Sci, Oujda, Morocco.; Aaboud, M (reprint author), LPTPM, Oujda, Morocco. RI Carvalho, Joao/M-4060-2013; Tikhomirov, Vladimir/M-6194-2015; Livan, Michele/D-7531-2012; Prokoshin, Fedor/E-2795-2012; Doyle, Anthony/C-5889-2009; Warburton, Andreas/N-8028-2013; Vanyashin, Aleksandr/H-7796-2013; Gladilin, Leonid/B-5226-2011; Mitsou, Vasiliki/D-1967-2009; Camarri, Paolo/M-7979-2015 OI Veneziano, Stefano/0000-0002-2598-2659; Carvalho, Joao/0000-0002-3015-7821; Tikhomirov, Vladimir/0000-0002-9634-0581; Livan, Michele/0000-0002-5877-0062; Prokoshin, Fedor/0000-0001-6389-5399; Belanger-Champagne, Camille/0000-0003-2368-2617; Doyle, Anthony/0000-0001-6322-6195; Warburton, Andreas/0000-0002-2298-7315; Vanyashin, Aleksandr/0000-0002-0367-5666; Gladilin, Leonid/0000-0001-9422-8636; Mitsou, Vasiliki/0000-0002-1533-8886; Camarri, Paolo/0000-0002-5732-5645 FU ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW, Austria; FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq, Brazil; FAPESP, Brazil; NSERC, Canada; NRC, Canada; CFI, Canada; CERN; CONICYT, Chile; CAS, China; MOST, China; NSFC, China; COLCIENCIAS, Colombia; MSMT CR, Czech Republic; VSC CR, Czech Republic; DNRF, Denmark; DNSRC, Denmark; IN2P3-CNRS, CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, Germany; HGF, Germany; MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, Israel; I-CORE, Israel; Benoziyo Center, Israel; INFN, Italy; MEXT, Japan; JSPS, Japan; CNRST, Morocco; FOM, Netherlands; NWO, Netherlands; RCN, Norway; MNiSW, Poland; NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia; NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS, Slovenia; MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC, Sweden; Wallenberg Foundation, Sweden; SERI, Switzerland; SNSF, Switzerland; Canton of Bern, Switzerland; Canton of Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE, United States of America; NSF, United States of America; BCKDF, Canada; Canada Council, Canada; Canarie, Canada; CRC, Canada; Compute Canada, Canada; FQRNT, Canada; Ontario Innovation Trust, Canada; EPLANET, European Union; ERC, European Union; FP7, European Union; Horizon, European Union; Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex, France; Investissements d'Avenir Idex, France; ANR, France; Region Auvergne, France; Fondation Partager le Savoir, France; DFG, Germany; AvH Foundation, Germany; Herakleitos programme - EU-ESF; Thales programme - EU-ESF; Aristeia programme - EU-ESF; Greek NSRF; BSF, Israel; GIF, Israel; Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Generalitat Valenciana, Spain; Royal Society, United Kingdom; Leverhulme Trust, United Kingdom; MPO CR, Czech Republic FX We acknowledge the support of ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW and FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq and FAPESP, Brazil; NSERC, NRC and CFI, Canada; CERN; CONICYT, Chile; CAS, MOST and NSFC, China; COLCIENCIAS, Colombia; MSMT CR, MPO CR and VSC CR, Czech Republic; DNRF and DNSRC, Denmark; IN2P3-CNRS, CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, HGF, and MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, I-CORE and Benoziyo Center, Israel; INFN, Italy; MEXT and JSPS, Japan; CNRST, Morocco; FOM and NWO, Netherlands; RCN, Norway; MNiSW and NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia and NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS and MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC and Wallenberg Foundation, Sweden; SERI, SNSF and Cantons of Bern and Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE and NSF, United States of America. In addition, individual groups and members have received support from BCKDF, the Canada Council, Canarie, CRC, Compute Canada, FQRNT, and the Ontario Innovation Trust, Canada; EPLANET, ERC, FP7, Horizon 2020 and Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, ANR, Region Auvergne and Fondation Partager le Savoir, France; DFG and AvH Foundation, Germany; Herakleitos, Thales and Aristeia programmes co-financed by EU-ESF and the Greek NSRF; BSF, GIF and Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Generalitat Valenciana, Spain; the Royal Society and Leverhulme Trust, United Kingdom. NR 70 TC 0 Z9 0 U1 8 U2 8 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 114 EP 133 DI 10.1016/j.physletb.2016.10.014 PG 20 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600017 ER PT J AU Ferreira, PG Hill, CT Ross, GG AF Ferreira, Pedro G. Hill, Christopher T. Ross, Graham G. TI Scale-independent inflation and hierarchy generation SO PHYSICS LETTERS B LA English DT Article ID ULTRA-WEAK SECTOR; GRAVITATION; DILATON AB We discuss models involving two scalar fields coupled to classical gravity that satisfy the general criteria: (i) the theory has no mass input parameters, (ii) classical scale symmetry is broken only through -1/12 zeta phi R-2 couplings where zeta departs from the special conformal value of 1; (iii) the Planck mass is dynamically generated by the vacuum expectations values (VEVs) of the scalars (iv) there is a stage of viable inflation associated with slow roll in the two-scalar potential; (v) the final vacuum has a small to vanishing cosmological constant and an hierarchically small ratio of the VEVs and the ratio of the scalar masses to the Planck scale. This assumes the paradigm of classical scale symmetry as a custodial symmetry of large hierarchies. (C) 2016 The Authors. Published by Elsevier B.V. C1 [Ferreira, Pedro G.] Univ Oxford, Dept Phys, Astrophys, Keble Rd, Oxford OX1 3RH, England. [Hill, Christopher T.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Ross, Graham G.] Univ Oxford, Rudolf Peierls Ctr Theoret Phys, 1 Keble Rd, Oxford OX1 3NP, England. RP Ferreira, PG (reprint author), Univ Oxford, Dept Phys, Astrophys, Keble Rd, Oxford OX1 3RH, England. EM pedro.ferreira@physics.ox.ac.uk; hill@fnal.gov; g.ross1@physics.ox.ac.uk FU United States Department of Energy [DE-AC02-07CH11359]; STFC; Beecroft Trust; Higgs Centre in Edinburgh FX We thank W.A. Bardeen, C. Burrage, J. Dunkley, A. Lukas, J. Rubio, S. Sarkar, M. Shaposhnikov, D. Sloan, L. Stein, K. Yagi for discussions. Part of this work was done at Fermilab, operated by Fermi Research Alliance, LLC under Contract No. DE-AC02-07CH11359 with the United States Department of Energy. PGF acknowledges support from STFC, the Beecroft Trust and the Higgs Centre in Edinburgh. NR 43 TC 2 Z9 2 U1 0 U2 0 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 174 EP 178 DI 10.1016/j.physletb.2016.10.036 PG 5 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600026 ER PT J AU Mueller, AH Wu, B Xiao, BW Yuan, F AF Mueller, A. H. Wu, Bin Xiao, Bo-Wen Yuan, Fen TI Probing transverse momentum broadening in heavy ion collisions SO PHYSICS LETTERS B LA English DT Article ID RADIATIVE ENERGY-LOSS; QUARK-GLUON PLASMA; QCD; JET; MATTER AB We study the dijet azimuthal de-correlation in relativistic heavy ion collisions as an important probe of the transverse momentum broadening effects of a high energy jet traversing the quark-gluon plasma. We take into account both the soft gluon radiation in vacuum associated with the Sudakov logarithms and the jet PT-broadening effects in the QCD medium. We find that the Sudakov effects are dominant at the LHC, while the medium effects can play an important role at RHIC energies. This explains why the LHC experiments have not yet observed sizable PT-broadening effects in the measurement of dijet azimuthal correlations in heavy ion collisions. Future investigations at RHIC will provide a unique opportunity to study the PT-broadening effects and help to pin down the underlying mechanism for jet energy loss in a hot and dense medium. (C) 2016 The Author(s). Published by Elsevier B.V. C1 [Mueller, A. H.] Columbia Univ, Dept Phys, New York, NY 10027 USA. [Wu, Bin] Ohio State Univ, Dept Phys, Columbus, OH 43210 USA. [Wu, Bin] CEA Saclay, Inst Phys Theor, UMR 3681, F-91191 Gif Sur Yvette, France. [Xiao, Bo-Wen] Cent China Normal Univ, Key Lab Quark & Lepton Phys MOE, Wuhan 430079, Peoples R China. [Xiao, Bo-Wen] Cent China Normal Univ, Inst Particle Phys, Wuhan 430079, Peoples R China. [Yuan, Fen] Lawrence Berkeley Natl Lab, Div Nucl Sci, Berkeley, CA 94720 USA. RP Xiao, BW (reprint author), Cent China Normal Univ, Key Lab Quark & Lepton Phys MOE, Wuhan 430079, Peoples R China.; Xiao, BW (reprint author), Cent China Normal Univ, Inst Particle Phys, Wuhan 430079, Peoples R China. EM bowen@phys.columbia.edu OI Xiao, Bowen/0000-0002-8738-3117 FU U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-AC02-05CH11231, DE-SC0004286]; NSFC [11575070] FX We thank P. Jacobs, Y.J. Lee, G.Y. Qin, J.W. Qiu, X.N. Wang for interesting discussions and comments. We also thank A. Angerami and B. Cole for useful and interesting discussions on the subject matter of this paper. This material is based upon work supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under contract number DE-AC02-05CH11231 and Award Number DE-SC0004286 (BW), and by the NSFC under Grant No. 11575070. NR 42 TC 1 Z9 1 U1 0 U2 0 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 208 EP 212 DI 10.1016/j.physletb.2016.10.037 PG 5 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600032 ER PT J AU Adam, J Adamova, D Aggarwal, MM Rinella, GA Agnello, M Agrawal, N Ahammed, Z Ahmad, S Ahn, SU Aiola, S Akindinov, A Alam, SN Albuquerque, DSD Aleksandrov, D Alessandro, B Alexandre, D Molina, RA Alici, A Alkin, A Alme, J Alt, T Altinpinar, S Altsybeev, I Prado, CAG An, M Andrei, C Andrews, HA Andronic, A Anguelov, V Anson, C Anticic, T Antinori, F Antonioli, P Aphecetche, L Appelshauser, H Arcelli, S Arnaldi, R Arnold, OW Arsene, IC Arslandok, M Audurier, B Augustinus, A Averbeck, R Azmi, MD Badala, A Baek, YW Bagnasco, S Bailhache, R Bala, R Balasubramanian, S Baldisseri, A Baral, RC Barbano, AM Barbera, R Barile, F Barnafoldi, GG Barnby, LS Barret, V Bartalini, P Barth, K Bartke, J Bartsch, E Basile, M Bastid, N Basu, S Bathen, B Batigne, G Camejo, AB 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Zimmermann, A. Zimmermann, M. B. Zinovjev, G. Zmeskal, J. CA ALICE Collaboration TI Jet-like correlations with neutral pion triggers in pp and central Pb-Pb collisions at 2.76 TeV SO PHYSICS LETTERS B LA English DT Article ID QUARK-GLUON PLASMA; TRANSVERSE-MOMENTUM DEPENDENCE; LEAD-LEAD COLLISIONS; ROOT-S(NN)=2.76 TEV; ROOT-S-NN=2.76 TEV; ATLAS DETECTOR; SUPPRESSION; COLLABORATION; PERSPECTIVE; HADRONS AB We present measurements of two-particle correlations with neutral pion trigger particles of transverse momenta 8 < p(T)(trig) < 16 GeV/c and associated charged particles of 0.5 < p(T)(assoc) < 10 GeV/c versus the azimuthal angle difference Delta phi at midrapidity in pp and central Pb-Pb collisions at root sNN= 2.76 TeV with ALICE. The new measurements exploit associated charged hadrons down to 0.5GeV/c, which significantly extends our previous measurement that only used charged hadrons above 3GeV/c. After subtracting the contributions of the flow background, v2to v(5), the per-trigger yields are extracted for vertical bar Delta phi vertical bar < 0.7 on the near and for vertical bar Delta phi - pi vertical bar < 1.1 on the away side. The ratio of per-trigger yields in Pb-Pb to those in pp collisions, I-AA, is measured on the near and away side for the 0-10% most central Pb-Pb collisions. On the away side, the per-trigger yields in Pb-Pb are strongly suppressed to the level of I-AA approximate to 0.6 for p(T)(assoc) > 3GeV/c, while with decreasing momenta an enhancement develops reaching about 5 at low p(T)(assoc) . On the near side, an enhancement of I-AA between 1.2 at the highest to 1.8 at the lowest p(T)(assoc) is observed. The data are compared to parton-energy-loss predictions of the JEWEL and AMPT event generators, as well as to a perturbative QCD calculation with medium-modified fragmentation functions. 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[Kolojvari, A.; Kondratiev, V.; Kovalenko, V.; Vechernin, V.; Vinogradov, L.; Zarochentsev, A.] St Petersburg State Univ, V Fock Inst Phys, St Petersburg, Russia. [Ghosh, P.; Kar, S.; Khan, S. A.; Mitra, J.; Muhuri, S.; Mukherjee, M.; Nayak, T. K.; Pal, S. K.; Patra, R. N.; Sadhu, S.; Saini, J.; Sarkar, D.; Sarkar, N.; Sheikh, A. I.; Singaraju, R.; Singhal, V.] Variable Energy Cyclotron Ctr, Kolkata, India. [Graczykowski, L. K.; Jakubowska, M. J.; Janik, M. A.; Kisiel, A.; Oleniacz, J.; Pluta, J.; Szczepankiewicz, A.; Szymanski, M.; Zbroszczyk, H.] Warsaw Univ Technol, Warsaw, Poland. [Pan, J.; Pruneau, C. A.; Pujahari, P.; Putschke, J.; Saleh, M. A.; Voloshin, S. A.] Wayne State Univ, Detroit, MI USA. [Hamar, G.; Kiss, G.; Levai, P.; Lowe, A.; Olah, L.; Pochybova, S.; Varga, D.; Vertesi, R.; Volpe, G.] Hungarian Acad Sci, Wigner Res Ctr Phys, Budapest, Hungary. [Grachov, O. A.; Harris, J. W.; Lapidus, K.; Lutz, T. H.; Majka, R. D.; Mulligan, J. D.; Oh, S.; Oliver, M. H.; Smirnov, N.] Yale Univ, New Haven, CT USA. [Kang, J. H.; Kim, D.; Kim, H.; Kim, M.; Kim, T.; Kwon, Y.; Lee, S.; Song, M.] Yonsei Univ, Seoul, South Korea. [Keidel, R.] Fachhsch Worms, Zentrum Technol Transfer & Telekommunikat ZTT, Worms, Germany. [Connors, M. E.; Khan, M. Mohisin; Viinikainen, J.] Georgia State Univ, Atlanta, GA 30303 USA. [Khan, M. Mohisin] Aligarh Muslim Univ, Dept Appl Phys, Aligarh, Uttar Pradesh, India. [Malinina, L.] Moscow MV Lomonosov State Univ, DV Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Glaessel, P.; Karayan, L.; Kim, J.; Klewin, S.; Knichel, M. L.; Leardini, L.; Perez, J. Mercado; Oeschler, H.; Oyama, K.; Pachmayer, Y.; Reidt, F.; Reygers, K.; Schicker, R.; Stachel, J.; Stiller, J. H.; Voelkl, M. A.; Weiser, D. F.; Wilkinson, J.; Windelband, B.; Winn, M.; Zimmermann, A.] Heidelberg Univ, Inst Phys, Heidelberg, Germany. RP Adam, J (reprint author), Czech Tech Univ, Fac Nucl Sci & Phys Engn, Prague, Czech Republic.; Adam, J (reprint author), Creighton Univ, Dept Phys, Omaha, NE USA. RI Kovalenko, Vladimir/C-5709-2013; Altsybeev, Igor/K-6687-2013; Vickovic, Linda/F-3517-2017; Fernandez Tellez, Arturo/E-9700-2017; OI Kovalenko, Vladimir/0000-0001-6012-6615; Altsybeev, Igor/0000-0002-8079-7026; Vickovic, Linda/0000-0002-9820-7960; Fernandez Tellez, Arturo/0000-0003-0152-4220; Murray, Sean/0000-0003-0548-588X; Vechernin, Vladimir/0000-0003-1458-8055; Giubilato, Piero/0000-0003-4358-5355; Brucken, Jens Erik/0000-0001-6066-8756; Fernandez Tellez, Arturo/0000-0001-5092-9748; Garg, Prakhar/0000-0001-5143-4384 FU Grid centres; Worldwide LHC Computing Grid (WLCG) collaboration; A. I. Alikhanyan National Science Laboratory (Yerevan Physics Institute) Foundation (ANSL); State Committee of Science and World Federation of Scientists (WFS), Armenia; Austrian Academy of Sciences, Austria; Osterreichische Nationalstiftung fur Forschung, Technologie und Entwicklung, Austria; Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq), Brazil; Financiadora de Estudos e Projetos (Finep), Brazil; Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (FAPESP), Brazil; Ministry of Education of China (MOE of China), China; Ministry of Science & Technology of China (MOST of China), China; National Natural Science Foundation of China (NSFC), China; Ministry of Science, Education and Sport, Croatia; Croatian Science Foundation, Croatia; Centro de Investigaciones Energeticas, Medioambientales y Tecnologicas (CIEMAT), Cuba; Ministry of Education, Youth and Sports of the Czech Republic, Czech Republic; Danish National Research Foundation (DNRF), Denmark; Carlsberg Foundation, Denmark; Danish Council for Independent Research \ Natural Sciences, Denmark; Helsinki Institute of Physics (HIP), Finland; Commissariat a l'Energie Atomique (CEA), France; Institut National de Physique Nucleaire et de Physique des Particules (IN2P3), France; Centre National de la Recherche Scientifique (CNRS), France; Bundesministerium fur Bildung, Wissenschaft, Forschung und Technologie (BMBF), Germany; GSI Helmholtzzentrum fur Schwerionenforschung GmbH, Germany; Ministry of Education, Research and Religious Affairs, Greece; National Research, Development and Innovation Office, Hungary; Department of Atomic Energy Government of India (DAE), India; Indonesian Institute of Science, Indonesia; Centro Fermi - Museo Storico della Fisica e Centro Studi e Ricerche Enrico Fermi, Italy; Istituto Nazionale di Fisica Nucleare (INFN), Italy; Institute for Innovative Science and Technology, Japan; Nagasaki Institute of Applied Science (IIST), Japan; apan Society for the Promotion of Science (JSPS) KAKENHI, Japan; Japanese Ministry of Education, Culture, Sports, Science and Technology (MEXT), Japan; Consejo Nacional de Ciencia y Tecnologia (CONACYT), through Fondo de Cooperacion Internacional en Ciencia y Tecnologia (FONCICYT), Mexico; Direccion General de Asuntos del Personal Academico (DGAPA), Mexico; Nationaal instituut voor subatomaire fysica (Nikhef), Netherlands; Research Council of Norway, Norway; Commission on Science and Technology for Sustainable Development in the South (COMSATS), Pakistan; Pontificia Universidad Catolica del Peru, Peru; Ministry of Science and Higher Education, Poland; National Science Centre, Poland; Ministry of Education and Scientific Research, Romania; Institute of Atomic Physics, Romania; Romanian National Agency for Science, Technology and Innovation, Romania; Joint Institute for Nuclear Research (JINR), Russia; Ministry of Education and Science of the Russian Federation, Russia; National Research Centre Kurchatov Institute, Russia; Ministry of Education, Science, Research and Sport of the Slovak Republic, Slovakia; National Research Foundation of South Africa, South Africa; Korea Institute of Science and Technology Information and National Research Foundation of Korea (NRF), South Korea; Centro de Investigaciones Energeticas, Medioambientales y Tecnologicas (CIEMAT), Spain; Ministerio de Ciencia e Innovacion, Spain; Knut & Alice Wallenberg Foundation (KAW), Sweden; Swedish Research Council (VR), Sweden; European Organization for Nuclear Research, Switzerland; National Science and Technology Development Agency (NSDTA), Thailand; Office of the Higher Education Commission under NRU project of Thailand, Thailand; Suranaree University of Technology (SUT), Thailand; Turkish Atomic Energy Agency (TAEK), Turkey; National Academy of Sciences of Ukraine, Ukraine; Science and Technology Facilities Council (STFC), United Kingdom; National Science Foundation of the United States of America (NSF), United States; United States Department of Energy, Office of Nuclear Physics (DOE NP), United States FX The ALICE Collaboration would like to thank all its engineers and technicians for their invaluable contributions to the construction of the experiment and the CERN accelerator teams for the outstanding performance of the LHC complex. The ALICE Collaboration gratefully acknowledges the resources and support provided by all Grid centres and the Worldwide LHC Computing Grid (WLCG) collaboration. The ALICE Collaboration acknowledges the following funding agencies for their support in building and running the ALICE detector: A. I.; Alikhanyan National Science Laboratory (Yerevan Physics Institute) Foundation (ANSL), State Committee of Science and World Federation of Scientists (WFS), Armenia; Austrian Academy of Sciences and Osterreichische Nationalstiftung fur Forschung, Technologie und Entwicklung, Austria; Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq), Financiadora de Estudos e Projetos (Finep) and Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (FAPESP), Brazil; Ministry of Education of China (MOE of China), Ministry of Science & Technology of China (MOST of China) and National Natural Science Foundation of China (NSFC), China; Ministry of Science, Education and Sport and Croatian Science Foundation, Croatia; Centro de Investigaciones Energeticas, Medioambientales y Tecnologicas (CIEMAT), Cuba; Ministry of Education, Youth and Sports of the Czech Republic, Czech Republic; Danish National Research Foundation (DNRF), The Carlsberg Foundation and The Danish Council for Independent Research vertical bar Natural Sciences, Denmark; Helsinki Institute of Physics (HIP), Finland; Commissariat a l'Energie Atomique (CEA) and Institut National de Physique Nucleaire et de Physique des Particules (IN2P3) and Centre National de la Recherche Scientifique (CNRS), France; Bundesministerium fur Bildung, Wissenschaft, Forschung und Technologie (BMBF) and GSI Helmholtzzentrum fur Schwerionenforschung GmbH, Germany; Ministry of Education, Research and Religious Affairs, Greece; National Research, Development and Innovation Office, Hungary; Department of Atomic Energy Government of India (DAE), India; Indonesian Institute of Science, Indonesia; Centro Fermi - Museo Storico della Fisica e Centro Studi e Ricerche Enrico Fermi and Istituto Nazionale di Fisica Nucleare (INFN), Italy; Institute for Innovative Science and Technology, Nagasaki Institute of Applied Science (IIST), Japan Society for the Promotion of Science (JSPS) KAKENHI and Japanese Ministry of Education, Culture, Sports, Science and Technology (MEXT), Japan; Consejo Nacional de Ciencia y Tecnologia (CONACYT), through Fondo de Cooperacion Internacional en Ciencia y Tecnologia (FONCICYT) and Direccion General de Asuntos del Personal Academico (DGAPA), Mexico; Nationaal instituut voor subatomaire fysica (Nikhef), Netherlands; The Research Council of Norway, Norway; Commission on Science and Technology for Sustainable Development in the South (COMSATS), Pakistan; Pontificia Universidad Catolica del Peru, Peru; Ministry of Science and Higher Education and National Science Centre, Poland; Ministry of Education and Scientific Research, Institute of Atomic Physics and Romanian National Agency for Science, Technology and Innovation, Romania; Joint Institute for Nuclear Research (JINR), Ministry of Education and Science of the Russian Federation and National Research Centre Kurchatov Institute, Russia; Ministry of Education, Science, Research and Sport of the Slovak Republic, Slovakia; National Research Foundation of South Africa, South Africa; Korea Institute of Science and Technology Information and National Research Foundation of Korea (NRF), South Korea; Centro de Investigaciones Energeticas, Medioambientales y Tecnologicas (CIEMAT) and Ministerio de Ciencia e Innovacion, Spain; Knut & Alice Wallenberg Foundation (KAW) and Swedish Research Council (VR), Sweden; European Organization for Nuclear Research, Switzerland; National Science and Technology Development Agency (NSDTA), Office of the Higher Education Commission under NRU project of Thailand and Suranaree University of Technology (SUT), Thailand;; Turkish Atomic Energy Agency (TAEK), Turkey; National Academy of Sciences of Ukraine, Ukraine; Science and Technology Facilities Council (STFC), United Kingdom; National Science Foundation of the United States of America (NSF) and United States Department of Energy, Office of Nuclear Physics (DOE NP), United States. NR 82 TC 0 Z9 0 U1 10 U2 10 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 238 EP 250 DI 10.1016/j.physletb.2016.10.048 PG 13 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600037 ER PT J AU Aaboud, M Aad, G Abbott, B Abdallah, J Abdinov, O Abeloos, B Aben, R AbouZeid, S Abraham, NL Abramowicz, H Abreu, H Abreu, R Abulaiti, Y Acharya, BS Adachi, S Adamczyk, L Adams, DL Adelman, J Adomeit, S Adye, T Affolder, AA Agatonovic-Jovin, T Agricola, J Aguilar-Saavedra, JA Ahlen, SP Ahmadov, F Aielli, G Akerstedt, H Akesson, TPA Akimov, AV Alberghi, GL Albert, J Albrand, S Verzini, MJA Aleksa, M Aleksandrov, IN Alexa, C Alexander, G Alexopoulos, T Alhroob, M Ali, B Aliev, M Alimonti, G Alison, J Alkire, SP Allbrooke, BMM Allen, BW Allport, PP Aloisio, A Alonso, A Alonso, F Alpigiani, C Alshehri, AA Alstaty, M Gonzalez, BA Piqueras, DA Alviggi, MG Amadio, BT Amako, K Coutinho, YA Amelung, C Amidei, D Dos Santos, SPA Amorim, A Amoroso, S Amundsen, G Anastopoulos, C Ancu, LS Andari, N Andeen, T Anders, CF Anders, G Anders, JK Anderson, KJ Andreazza, A Andrei, V Angelidakis, S Angelozzi, I Anger, P Angerami, A Anghinolfi, F Anisenkov, AV Anjos, N Annovi, A Antel, C Antonelli, M Antonov, A Anulli, F Aoki, M Bella, LA Arabidze, G Arai, Y Araque, JP Arce, ATH Arduh, FA Arguin, JF Argyropoulos, S Arik, M Armbruster, AJ Armitage, LJ Arnaez, O Arnold, H Arratia, M Arslan, O Artamonov, A Artoni, G Artz, S Asai, S Asbah, N Ashkenazi, A Asman, B Asquith, L Assamagan, K Astalos, R Atkinson, M Atlay, NB Augsten, K Avolio, G Axen, B Ayoub, MK Azuelos, G Baak, MA Baas, AE Baca, MJ Bachacou, H Bachas, K Backes, M Backhaus, M Bagiacchi, P Bagnaia, P Bai, Y Baines, JT Baker, OK Baldin, EM Balek, P Balestri, T Balli, F Balunas, WK Banas, E Banerjee, S Bannoura, AAE Barak, L Barberio, EL Barberis, D Barbero, M Barillari, T Barisits, MS Barklow, T Barlow, N Barnes, SL Barnett, BM Barnett, RM Barnovska-Blenessy, Z Baroncelli, A Barone, G Barr, AJ Navarro, LB Barreiro, F da Costa, JBG Bartoldus, R Barton, AE Bartos, P Basalaev, A Bassalat, A Bates, RL Batista, SJ Batley, JR Battaglia, M Bauce, M Bauer, F Bawa, HS Beacham, JB Beattie, MD Beau, T Beauchemin, PH Bechtle, P Beck, HP Becker, K Becker, M Beckingham, M Becot, C Beddall, AJ Beddall, A Bednyakov, VA Bedognetti, M Bee, CP Beemster, LJ Beermann, TA Begel, M Behr, JK Belanger-Champagne, C Bell, AS Bella, G Bellagamba, L Bellerive, A Bellomo, M Belotskiy, K Beltramello, O Belyaev, NL Benary, O Benchekroun, D Bender, M Bendtz, K Benekos, N Benhammou, Y Noccioli, EB Benitez, J Benjamin, DP Bensinger, JR Bentvelsen, S Beresford, L Beretta, M Berge, D Kuutmann, EB Berger, N Beringer, J Berlendis, S Bernard, NR Bernius, C Bernlochner, FU Berry, T Berta, P Bertella, C Bertoli, G Bertolucci, F Bertram, IA Bertsche, C Bertsche, D Besjes, GJ Bylund, OB Bessner, M Besson, N Betancourt, C Bethani, A Bethke, S Bevan, AJ Bianchi, RM Bianchini, L Bianco, M Biebel, O Biedermann, D Bielski, R Biesuz, NV Biglietti, M De Mendizabal, JB Billoud, TRV Bilokon, H Bindi, M Binet, S Bingul, A Bini, C Biondi, S Bisanz, T Bjergaard, DM Black, CW Black, JE Black, KM Blackburn, D Blair, RE Blanchard, JB Blazek, T Bloch, I Blocker, C Blue, A Blum, W Blumenschein, U Blunier, S Bobbink, GJ Bobrovnikov, VS Bocchetta, SS Bocci, A Bock, C Boehler, M Boerner, D Bogaerts, JA Bogavac, D Bogdanchikov, AG Bohm, C Boisvert, V Bokan, P Bold, T Boldyrev, AS Bomben, M Bona, M Boonekamp, M Borisov, A Borissov, G Bortfeldt, J Bortoletto, D Bortolotto, V Bos, K Boscherini, D Bosman, M Sola, JDB Boudreau, J Bouffard, J Bouhova-Thacker, EV Boumediene, D Bourdarios, C Boutle, SK Boveia, A Boyd, J Boyko, IR Bracinik, J Brandt, A Brandt, G Brandt, O Bratzler, U Brau, B Brau, JE Madden, WDB Brendlinger, K Brennan, AJ Brenner, L Brenner, R Bressler, S Bristow, TM Britton, D Britzger, D Brochu, FM Brock, I Brock, R Brooijmans, G Brooks, T Brooks, WK Brosamer, J Brost, E Broughton, JH de Renstrom, PAB Bruncko, 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Zhang, G. Zhang, H. Zhang, J. Zhang, L. Zhang, R. Zhang, R. Zhang, X. Zhang, Z. Zhao, X. Zhao, Y. Zhao, Z. Zhemchugov, A. Zhong, J. Zhou, B. Zhou, C. Zhou, L. Zhou, L. Zhou, M. Zhou, N. Zhu, C. G. Zhu, H. Zhu, J. Zhu, Y. Zhuang, X. Zhukov, K. Zibell, A. Zieminska, D. Zimine, N. I. Zimmermann, C. Zimmermann, S. Zinonos, Z. Zinser, M. Ziolkowski, M. Zivkovic, L. Zobernig, G. Zoccoli, A. Nedden, M. Zur Zwalinski, L. CA ATLAS Collaboration TI Search for dark matter produced in association with a hadronically decaying vector boson in pp collisions at root s=13 TeV with the ATLAS detector SO PHYSICS LETTERS B LA English DT Article ID LHC AB A search is presented for dark matter produced in association with a hadronically decaying W or Z boson using 3.2 fb(-1) of ppcollisions at root s = 13 TeV recorded by the ATLAS detector at the Large Hadron Collider. Events with a hadronic jet compatible with a Wor Z boson and with large missing transverse momentum are analysed. The data are consistent with the Standard Model predictions and are interpreted in terms of both an effective field theory and a simplified model containing dark matter. (C) 2016 The Author. Published by Elsevier B.V. C1 [Jackson, P.; Lee, L.; Petridis, A.; White, M. J.] Univ Adelaide, Dept Phys, Adelaide, SA, Australia. [Bouffard, J.; Ernst, J.; Fischer, A.; Guindon, S.; Jain, V.] SUNY Albany, Dept Phys, Albany, NY 12222 USA. [Czodrowski, P.; Dassoulas, J.; Dehghanian, N.; Gingrich, D. M.; Jabbar, S.; Karamaoun, A.; Moore, R. W.; Pinfold, J. L.] Univ Alberta, Dept Phys, Edmonton, AB, Canada. [Cakir, O.; Ciftci, A. K.; Yildiz, H. Duran] Ankara Univ, Dept Phys, Ankara, Turkey. [Kuday, S.] Istanbul Aydin Univ, Istanbul, Turkey. [Sultansoy, S.] TOBB Univ Econ & Technol, Div Phys, Ankara, Turkey. 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[Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Pallin, D.; Romano Saez, S. M.; Santoni, C.; Simon, D.; Vazeille, F.] Univ Blaise Pascal, Clermont Ferrand, France. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Pallin, D.; Romano Saez, S. M.; Santoni, C.; Simon, D.; Vazeille, F.] CNRS, IN2P3, Clermont Ferrand, France. [Alkire, S. P.; Angerami, A.; Brooijmans, G.; Carbone, R. M.; Clark, M. R.; Cole, B.; Hughes, E. W.; Iordanidou, K.; Klein, M. H.; Mohapatra, S.; Ochoa, I.; Parsons, J. A.; Smith, M. N. K.; Smith, R. W.; Thompson, E. N.; Tuts, P. M.; Wang, T.; Zhou, L.] Columbia Univ, Nevis Lab, Irvington, NY USA. [Alonso, A.; Besjes, G. J.; Dam, M.; Galster, G.; Hansen, J. B.; Hansen, J. D.; Hansen, P. H.; Loevschall-Jensen, A. E.; Monk, J.; Mortensen, S. S.; Pedersen, L. E.; Petersen, T. C.; Pingel, A.; Wiglesworth, C.; Xella, S.] Univ Copenhagen, Niels Bohr Inst, Copenhagen, Denmark. [Cairo, V. M.; Callea, G.; Capua, M.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Palazzo, S.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Ist Nazl Fis Nucl, Grp Collegato Cosenza, Lab Nazl Frascati, Arcavacata Di Rende, Italy. [Cairo, V. M.; Callea, G.; Capua, M.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Palazzo, S.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Univ Calabria, Dipartimento Fis, Arcavacata Di Rende, Italy. [Adamczyk, L.; Bold, T.; Dabrowski, W.; Gach, G. P.; Grabowska-Bold, I.; Kisielewska, D.; Koperny, S.; Kowalski, T. Z.; Mindur, B.; Przybycien, M.; Zemla, A.] AGH Univ Sci & Technol, Fac Phys & Appl Comp Sci, Krakow, Poland. [Palka, M.; Richter-Was, E.] Jagiellonian Univ, Marian Smoluchowski Inst Phys, Krakow, Poland. [Banas, E.; de Renstrom, P. A. Bruckman; Burka, K.; Chwastowski, J. J.; Derendarz, D.; Godlewski, J.; Gornicki, E.; Hajduk, Z.; Kaczmarska, A.; Knapik, J.; Korcyl, K.; Kowalewska, A. B.; Malecki, Pa.; Olszewski, A.; Olszowska, J.; Stanecka, E.; Staszewski, R.; Trzebinski, M.; Trzupek, A.; Wolter, M. W.; Wosiek, B. K.; Wozniak, K. W.; Zabinski, B.] Polish Acad Sci, Inst Nucl Phys, Krakow, Poland. [Cao, T.; Firan, A.; Gupta, R.; Hetherly, J. W.; Kama, S.; Kehoe, R.; Sekula, S. J.; Stroynowski, R.; Varol, T.; Wang, H.; Ye, J.; Zhao, X.; Zhou, L.] So Methodist Univ, Dept Phys, Dallas, TX USA. [Izen, J. M.; Leyton, M.; Meirose, B.; Namasivayam, H.; Reeves, K.] Univ Texas Dallas, Dept Phys, Richardson, TX 75083 USA. [Asbah, N.; Behr, J. K.; Bertsche, C.; Bessner, M.; Bloch, I.; Britzger, D.; Deterre, C.; Cornell, S. Diez; Dutta, B.; Dyndal, M.; Eckardt, C.; Ferrando, J.; Filipuzzi, M.; Flaschel, N.; Bravo, A. Gascon; Gasnikova, K.; Glazov, A.; Gregor, I. M.; Haleem, M.; Hamnett, P. G.; Hiller, K. H.; Howarth, J.; Huang, Y.; Katzy, J.; Keller, J. S.; Kondrashova, N.; Kuhl, T.; Lobodzinska, E. M.; Lohwasser, K.; Madsen, A.; Medinnis, M.; Moenig, K.; Garcia, R. F. Naranjo; Naumann, T.; O'Rourke, A. A.; Peschke, R.; Peters, K.; Pirumov, H.; Poley, A.; Robinson, J. E. M.; Schaefer, R.; Schmitt, S.; South, D.; Stanescu-Bellu, M.; Stanitzki, M. M.; Styles, N. A.; Tackmann, K.; Trofymov, A.; Wang, J.; Zakharchuk, N.] DESY, Hamburg, Germany. [Asbah, N.; Behr, J. K.; Bertsche, C.; Bessner, M.; Bloch, I.; Britzger, D.; Deterre, C.; Cornell, S. Diez; Dutta, B.; Dyndal, M.; Eckardt, C.; Ferrando, J.; Filipuzzi, M.; Flaschel, N.; Bravo, A. Gascon; Gasnikova, K.; Glazov, A.; Gregor, I. M.; Haleem, M.; Hamnett, P. G.; Hiller, K. H.; Howarth, J.; Huang, Y.; Katzy, J.; Keller, J. S.; Kondrashova, N.; Kuhl, T.; Lobodzinska, E. M.; Lohwasser, K.; Madsen, A.; Medinnis, M.; Moenig, K.; Garcia, R. F. Naranjo; Naumann, T.; O'Rourke, A. A.; Peschke, R.; Peters, K.; Pirumov, H.; Poley, A.; Robinson, J. E. M.; Schaefer, R.; Schmitt, S.; South, D.; Stanescu-Bellu, M.; Stanitzki, M. M.; Styles, N. A.; Tackmann, K.; Trofymov, A.; Wang, J.; Zakharchuk, N.] DESY, Zeuthen, Germany. [Burmeister, I.; Cinca, D.; Dette, K.; Erdmann, J.; Esch, H.; Goessling, C.; Homann, M.; Klingenberg, R.; Kroeninger, K.] Tech Univ Dortmund, Lehrstuhl Expt Phys 4, Dortmund, Germany. [Anger, P.; Duschinger, D.; Friedrich, F.; Grohs, J. P.; Gutschow, C.; Hauswald, L.; Kobel, M.; Mader, W. F.; Novgorodova, O.; Siegert, F.; Socher, F.; Straessner, A.; Vest, A.; Wahrmund, S.] Tech Univ Dresden, Inst Kern & Teilchenphys, Dresden, Germany. [Arce, A. T. H.; Benjamin, D. P.; Bjergaard, D. M.; Bocci, A.; Cerio, B. C.; Goshaw, A. T.; Kajomovitz, E.; Kotwal, A.; Kruse, M. C.; Li, L.; Li, S.; Liu, M.; Oh, S. H.] Duke Univ, Dept Phys, Durham, NC USA. [Bristow, T. M.; Clark, P. J.; Dias, F. A.; Edwards, N. C.; Gao, Y.; Walls, F. M. Garay; Glaysher, P. C. F.; Harrington, R. D.; Leonidopoulos, C.; Martin, V. J.; Mijovic, L.; Mills, C.; Pino, S. A. Olivares; Washbrook, A.; Wynne, B. M.] Univ Edinburgh, SUPA Sch Phys & Astron, Edinburgh, Midlothian, Scotland. [Antonelli, M.; Beretta, M.; Bilokon, H.; Chiarella, V.; Curatolo, M.; Esposito, B.; Gatti, C.; Laurelli, P.; Maccarrone, G.; Mancini, G.; Sansoni, A.; Testa, M.; Vilucchi, E.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Arnold, H.; Betancourt, C.; Boehler, M.; Bruneliere, R.; Buehrer, F.; Burgard, C. D.; Buescher, D.; Cardillo, F.; Coniavitis, E.; Consorti, V.; Dang, N. P.; Dao, V.; Di Simone, A.; Glatzer, J.; Gonella, G.; Herten, G.; Hirose, M.; Jakobs, K.; Javurek, T.; Jenni, P.; Kiss, F.; Koeneke, K.; Kopp, A. K.; Kuehn, S.; Landgraf, U.; Luedtke, C.; Nagel, M.; Pagacova, M.; Parzefall, U.; Ronzani, M.; Rosbach, K.; Ruehr, F.; Rurikova, Z.; Sammel, D.; Schillo, C.; Schnoor, U.; Schumacher, M.; Sommer, P.; Sundermann, J. E.; Ta, D.; Temming, K. K.; Tornambe, P.; Tsiskaridze, V.; Weiser, C.; Zhang, L.; Zimmermann, S.] Univ Freiburg, Fak Math & Phys, Freiburg, Germany. [Ancu, L. S.; De Mendizabal, J. Bilbao; Calace, N.; Chatterjee, A.; Clark, A.; Coccaro, A.; Delitzsch, C. M.; della Volpe, D.; Ferrere, D.; Golling, T.; Gonzalez-Sevilla, S.; Gramling, J.; Guescini, F.; Iacobucci, G.; Katre, A.; Khoo, T. J.; Lanfermann, M. C.; Lionti, A. E.; March, L.; Mermod, P.; Nackenhorst, O.; Paolozzi, L.; Ristic, B.; Schramm, S.; Sfyrla, A.; Wu, X.] Univ Geneva, Sect Phys, Geneva, Switzerland. [Barberis, D.; Darbo, G.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Gemme, C.; Guido, E.; Miglioranzi, S.; Morettini, P.; Osculati, B.; Parodi, F.; Passaggio, S.; Rossi, L. P.; Sannino, M.; Schiavi, C.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Barberis, D.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Guido, E.; Miglioranzi, S.; Osculati, B.; Parodi, F.; Sannino, M.; Schiavi, C.] Univ Genoa, Dipartimento Fis, Genoa, Italy. [Tskhadadze, E. G.] Iv Javakhishvili Tbilisi State Univ, E Andronikashvili Inst Phys, Tbilisi, Rep of Georgia. [Djobava, T.; Durglishvili, A.; Khubua, J.; Mosidze, M.] Tbilisi State Univ, Inst High Energy Phys, Tbilisi, Rep of Georgia. [Dueren, M.; Heinz, C.; Kreutzfeldt, K.; Stenzel, H.] Univ Giessen, Inst Phys 2, Giessen, Germany. [Alshehri, A. A.; Bates, R. L.; Blue, A.; Boutle, S. K.; Madden, W. D. Breaden; Britton, D.; Buckley, A. G.; Bussey, P.; Buttar, C. M.; Buzatu, A.; Crawley, S. J.; D'Auria, S.; Doyle, A. T.; Gul, U.; Knue, A.; Mullen, P.; O'Shea, V.; Owen, M.; Pollard, C. S.; Qin, G.; Quilty, D.; Ravenscroft, T.; Robson, A.; St Denis, R. D.; Stewart, G. A.; Thompson, A. S.] Univ Glasgow, SUPA Sch Phys & Astron, Glasgow, Lanark, Scotland. [Agricola, J.; Bindi, M.; Bisanz, T.; Blumenschein, U.; Brandt, G.; De Maria, A.; Drechsler, E.; Graber, L.; Grosse-Knetter, J.; Janus, M.; Kareem, M. J.; Kawamura, G.; Lai, S.; Lemmer, B.; Magradze, E.; Mantoani, M.; Mchedlidze, G.; Llacer, M. Moreno; Musheghyan, H.; Quadt, A.; Rieger, J.; Rosien, N. -A.; Rzehorz, G. F.; Shabalina, E.; Stolte, P.; Veatch, J.; Weingarten, J.; Zinonos, Z.] Univ Gottingen, Inst Phys 2, Gottingen, Germany. [Albrand, S.; Berlendis, S.; Bethani, A.; Camincher, C.; Collot, J.; Crepe-Renaudin, S.; Delsart, P. A.; Gabaldon, C.; Genest, M. H.; Gradin, P. O. J.; Hostachy, J-Y.; Ledroit-Guillon, F.; Lleres, A.; Lucotte, A.; Malek, F.; Petit, E.; Stark, J.; Trocme, B.; Wu, M.] Univ Grenoble Alpes, CNRS, IN2P3, Lab Phys Subat & Cosmol, Grenoble, France. [Chan, S. K.; Clark, B. L.; Franklin, M.; Giromini, P.; Huth, J.; Ippolito, V.; Lazovich, T.; Mateos, D. Lopez; Morii, M.; Rogan, C. S.; Skottowe, H. P.; Sun, S.; Tolley, E.; Tong, B.; Tuna, A. N.; Yen, A. L.; Zambito, S.] Harvard Univ, Lab Particle Phys & Cosmol, Cambridge, MA 02138 USA. [Gao, J.; Geng, C.; Guo, Y.; Han, L.; Hu, Q.; Jiang, Y.; Li, B.; Li, C.; Liu, J. B.; Liu, M.; Liu, Y. L.; Liu, Y.; Peng, H.; Song, H. Y.; Wang, W.; Zhang, G.; Zhang, R.; Zhao, Z.; Zhu, Y.] Univ Sci & Technol China, Dept Modern Phys, Hefei, Anhui, Peoples R China. [Andrei, V.; Antel, C.; Baas, A. E.; Brandt, O.; Djuvsland, J. I.; Dunford, M.; Geisler, M. P.; Hanke, P.; Jongmanns, J.; Kluge, E. -E.; Lang, V. S.; Meier, K.; Zu Theenhausen, H. Meyer; Villar, D. I. Narrias; Sahinsoy, M.; Scharf, V.; Schultz-Coulon, H. -C.; Stamen, R.; Starovoitov, P.; Suchek, S.; Wessels, M.] Heidelberg Univ, Kirchhoff Inst Phys, Heidelberg, Germany. [Anders, C. F.; de Lima, D. E. Ferreira; Giulini, M.; Kolb, M.; Lisovyi, M.; Schaetzel, S.; Schoening, A.; Sosa, D.] Heidelberg Univ, Inst Phys, Heidelberg, Germany. [Kretz, M.; Kugel, A.] Heidelberg Univ, ZITI Inst Tech Informat, Mannheim, Germany. [Nagasaka, Y.] Hiroshima Inst Technol, Fac Appl Informat Sci, Hiroshima, Japan. [Bortolotto, V.; Chan, Y. L.; Castillo, L. R. Flores; Lu, H.; Salvucci, A.; Tsui, K. M.] Chinese Univ Hong Kong, Dept Phys, Shatin, Hong Kong, Peoples R China. [Bortolotto, V.; Orlando, N.; Salvucci, A.; Tu, Y.] Univ Hong Kong, Dept Phys, Hong Kong, Hong Kong, Peoples R China. [Bortolotto, V.; Prokofiev, K.; Salvucci, A.] Hong Kong Univ Sci & Technol, Dept Phys, Kowloon, Hong Kong, Peoples R China. [Choi, K.; Evans, H.; Gagnon, P.; Kopeliansky, R.; Lammers, S.; Martinez, N. Lorenzo; Luehring, F.; Ogren, H.; Penwell, J.; Weinert, B.; Zieminska, D.] Indiana Univ, Dept Phys, Bloomington, IN 47405 USA. [Guenther, J.; Iwanski, W.; Jansky, R.; Kneringer, E.; Lukas, W.; Milic, A.] Leopold Franzens Univ, Inst Astro & Teilchenphys, Innsbruck, Austria. [Argyropoulos, S.; Benitez, J.; Mallik, U.; Zaidan, R.] Univ Iowa, Iowa City, IA USA. [Chen, C.; Cochran, J.; De Lorenzi, F.; Jiang, H.; Krumnack, N.; Pluth, D.; Prell, S.; Werner, M. D.; Yu, J.] Iowa State Univ, Dept Phys & Astron, Ames, IA USA. [Ahmadov, F.; Aleksandrov, I. N.; Amako, K.; Aoki, M.; Arai, Y.; Bednyakov, V. A.; Boyko, I. R.; Budagov, I. A.; Chelkov, A.; Cheplakov, A.; Chizhov, M. V.; Demichev, M.; Gongadze, A.; Gostkin, M. I.; Hanagaki, K.; Honda, T.; Huseynov, N.; Ikegami, Y.; Ikeno, M.; Iwasaki, H.; Javadov, N.; Kanzaki, J.; Karpov, S. N.; Karpova, Z. M.; Khramov, E.; Kondo, T.; Kono, T.; Kruchonak, U.; Kukhtin, V.; Ladygin, E.; Lyubushkin, V.; Makida, Y.; Minashvili, I. A.; Mineev, M.; Nagai, R.; Nagano, K.; Nakamura, K.; Nozaki, M.; Odaka, S.; Okuyama, T.; Peshekhonov, V. D.; Plotnikova, E.; Potrap, I. N.; Pozdnyakov, V.; Rusakovich, N. A.; Sadykov, R.; Sapronov, A.; Sasaki, O.; Shiyakova, M.; Soloshenko, A.; Suzuki, S.; Takubo, Y.; Tanaka, S.; Terada, S.; Tokushuku, K.; Tsuno, S.; Turchikhin, S.; Unno, Y.; Vinogradov, V. B.; Yamamoto, A.; Yasu, Y.; Yeletskikh, I.; Zhemchugov, A.; Zimine, N. I.] Joint Inst Nucl Res Dubna, Dubna, Russia. [Chen, Y.; Hasegawa, M.; Kido, S.; Kurashige, H.; Maeda, J.; Ochi, A.; Shimizu, S.; Tanioka, R.; Yamazaki, Y.; Yuan, L.] High Energy Accelerator Res Org, KEK, Tsukuba, Ibaraki, Japan. [Chen, Y.; Hasegawa, M.; Kido, S.; Kurashige, H.; Maeda, J.; Ochi, A.; Shimizu, S.; Tanioka, R.; Yamazaki, Y.; Yuan, L.] Kobe Univ, Grad Sch Sci, Kobe, Hyogo, Japan. [Kunigo, T.; Monden, R.; Sumida, T.; Tashiro, T.] Kyoto Univ, Fac Sci, Kyoto, Japan. [Takashima, R.] Kyoto Univ, Kyoto, Japan. [Kawagoe, K.; Oda, S.; Otono, H.; Shirabe, S.; Tojo, J.] Kyushu Univ, Dept Phys, Fukuoka, Japan. [Alconada Verzini, M. J.; Alonso, F.; Arduh, F. A.; Dova, M. T.; Hoya, J.; Monticelli, F.; Wahlberg, H.] Univ Nacl La Plata, Inst Fisica La Plata, La Plata, Buenos Aires, Argentina. [Alconada Verzini, M. J.; Alonso, F.; Arduh, F. A.; Dova, M. T.; Hoya, J.; Monticelli, F.; Wahlberg, H.] Consejo Nacl Invest Cient & Tecn, La Plata, Buenos Aires, Argentina. [Barton, A. E.; Beattie, M. D.; Bertram, I. A.; Borissov, G.; Bouhova-Thacker, E. V.; Dearnaley, W. J.; Fox, H.; Grimm, K.; Henderson, R. C. W.; Hughes, G.; Jones, R. W. L.; Kartvelishvili, V.; Long, R. E.; Love, P. A.; Muenstermann, D.; Parker, A. J.; Skinner, M. B.; Smizanska, M.; Walder, J.; Wharton, A. M.] Univ Lancaster, Dept Phys, Lancaster, England. [Aliev, M.; Bachas, K.; Chiodini, G.; Gorini, E.; Longo, L.; Primavera, M.; Reale, M.; Spagnolo, S.; Ventura, A.] Ist Nazl Fis Nucl, Sez Lecce, Lecce, Italy. [Aliev, M.; Bachas, K.; Gorini, E.; Longo, L.; Reale, M.; Spagnolo, S.; Ventura, A.] Univ Salento, Dipartimento Matemat & Fis, Lecce, Italy. [Affolder, A. A.; Anders, J. K.; Burdin, S.; D'Onofrio, M.; Dervan, P.; Gwilliam, C. B.; Hayward, H. S.; Jones, T. J.; King, B. T.; Klein, M.; Klein, U.; Kretzschmar, J.; Laycock, P.; Lehan, A.; Maxfield, S. J.; Mehta, A.; Readioff, N. P.; Vossebeld, J. H.] Univ Liverpool, Oliver Lodge Lab, Liverpool, Merseyside, England. [Cindro, V.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Jozef Stefan Inst, Dept Phys, Ljubljana, Slovenia. [Cindro, V.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Univ Ljubljana, Ljubljana, Slovenia. [Armitage, L. J.; Bevan, A. J.; Bona, M.; Hays, J. M.; Hickling, R.; Landon, M. P. J.; Lewis, D.; Lloyd, S. L.; Morris, J. D.; Nooney, T.; Piccaro, E.; Rizvi, E.; Sandbach, R. L.] Queen Mary Univ London, Sch Phys & Astron, London, England. [Berry, T.; Boisvert, V.; Brooks, T.; Connelly, I. A.; Cowan, G.; Giannelli, M. Faucci; Gadomski, S.; George, S.; Gibson, S. M.; Kempster, J. J.; Kilby, C. R.; Vazquez, J. G. Panduro; Pastore, Fr.; Savage, G.; Sowden, B. C.; Spano, F.; Teixeira-Dias, P.; Thomas-Wilsker, J.] Royal Holloway Univ London, Dept Phys, Surrey, England. [Bell, A. S.; Butterworth, J. M.; Campanelli, M.; Christodoulou, V.; Cooper, B. D.; Davison, P.; Falla, R. J.; Freeborn, D.; Gregersen, K.; Grout, Z. J.; Ortiz, N. G. Gutierrez; Hesketh, G. G.; Jiggins, S.; Konstantinidis, N.; Korn, A.; Kucuk, H.; Leney, K. J. C.; Martyniuk, A. C.; McClymont, L. I.; Mcfayden, J. A.; Nurse, E.; Richter, S.; Scanlon, T.; Sherwood, P.; Simmons, B.; Wardrope, D. R.; Waugh, B. M.] UCL, Dept Phys & Astron, London, England. [Greenwood, Z. D.; Grossi, G. C.; Jana, D. K.; Sawyer, C.; Sawyer, L.] Louisiana Tech Univ, Ruston, LA USA. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] UPMC, Lab Phys Nucl & Hautes Energies, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.; Zhang, R.] Univ Paris Diderot, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.; Zhang, R.] CNRS, IN2P3, Paris, France. [Akesson, T. P. A.; Bocchetta, S. S.; Bryngemark, L.; Doglioni, C.; Hedberg, V.; Jarlskog, G.; Lytken, E.; Mjornmark, J. U.; Smirnova, O.; Viazlo, O.] Lund Univ, Inst Fys, Lund, Sweden. [Barreiro, F.; Calvente Lopez, S.; Cueto, A.; Del Peso, J.; Glasman, C.; Terron, J.] Univ Autonoma Madrid, Dept Fis Teor C15, Madrid, Spain. [Artz, S.; Becker, M.; Bertella, C.; Blum, W.; Buescher, V.; Cuth, J.; Dudder, A. Chr.; Endner, O. C.; Ertel, E.; Fiedler, F.; Torregrosa, E. Fullana; Geisen, M.; Groh, S.; Heck, T.; Jakobi, K. B.; Kaluza, A.; Karnevskiy, M.; Kleinknecht, K.; Koepke, L.; Lin, T. H.; Masetti, L.; Mattmann, J.; Meyer, C.; Moritz, S.; Pleskot, V.; Rave, S.; Reiss, A.; Sander, H. G.; Schaeffer, J.; Schaefer, U.; Schmitt, C.; Schmitz, S.; Schott, M.; Schuh, N.; Schulte, A.; Simioni, E.; Simon, M.; Tapprogge, S.; Urrejola, P.; Webb, S.; Yildirim, E.; Zimmermann, C.; Zinser, M.] Johannes Gutenberg Univ Mainz, Inst Phys, Mainz, Germany. [Barnes, S. L.; Bielski, R.; Cox, B. E.; Da Via, C.; Dann, N. S.; Forcolin, G. T.; Forti, A.; Ponce, J. M. Iturbe; Li, X.; Loebinger, F. K.; Marsden, S. P.; Masik, J.; Sanchez, F. J. Munoz; Neep, T. J.; Oh, A.; Ospanov, R.; Pater, J. R.; Peters, R. F. Y.; Pilkington, A. D.; Pin, A. W. J.; Price, D.; Qin, Y.; Queitsch-Maitland, M.; Raine, J. A.; Schweiger, H.; Shaw, S. M.; Tomlinson, L.; Watts, S.; Wilk, F.; Woudstra, M. J.; Wyatt, T. R.] Univ Manchester, Sch Phys & Astron, Manchester, Lancs, England. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.] Aix Marseille Univ, CPPM, Marseille, France. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Vacavant, L.; Wang, C.] CNRS, IN2P3, Marseille, France. [Bellomo, M.; Bernard, N. R.; Brau, B.; Dallapiccola, C.; Moyse, E. J. W.; Pais, P.; Pettersson, N. E.; Picazio, A.; Willocq, S.] Univ Massachusetts, Dept Phys, Amherst, MA USA. [Belanger-Champagne, C.; Chuinard, A. J.; Corriveau, F.; Keyes, R. A.; Lefebvre, B.; Mantifel, R.; Prince, S.; Robertson, S. H.; Robichaud-Veronneau, A.; Stockton, M. C.; Stoebe, M.; Vachon, B.; Schroeder, T. Vazquez; Wang, K.; Warburton, A.] McGill Univ, Dept Phys, Montreal, PQ, Canada. [Barberio, E. L.; Brennan, A. J.; Dawe, E.; Goldfarb, S.; Jennens, D.; Kubota, T.; Le, B.; McDonald, E. F.; Milesi, M.; Nuti, F.; Rados, P.; Scutti, F.; Spiller, L. A.; Tan, K. G.; Taylor, G. N.; Taylor, P. T. E.; Ungaro, F. C.; Urquijo, P.; Volpi, M.; Zanzi, D.] Univ Melbourne, Sch Phys, Melbourne, Vic, Australia. [Amidei, D.; Chelstowska, M. A.; Cheng, H. C.; Dai, T.; Diehl, E. B.; Edgar, R. C.; Feng, H.; Ferretti, C.; Fleischmann, P.; Geng, C.; Guan, L.; Guo, Y.; Levin, D.; Li, B.; Liu, H.; Lu, N.; Marley, D. E.; Mc kee, S. P.; Mc Carn, A.; Neal, H. A.; Qian, J.; Schwarz, T. A.; Searcy, J.; Sekhon, K.; Wu, Y.; Yu, J. M.; Zhang, D.; Zhou, B.; Zhu, J.] Univ Michigan, Dept Phys, Ann Arbor, MI 48109 USA. [Arabidze, G.; Brock, R.; Chegwidden, A.; De la Torre, H.; Fisher, W. C.; Halladjian, G.; Hauser, R.; Hayden, D.; Huston, J.; Martin, B.; Mondragon, M. C.; Plucinski, P.; Pope, B. G.; Schoenrock, B. D.; Schwienhorst, R.; Willis, C.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Alimonti, G.; Andreazza, A.; Camplani, A.; Carminati, L.; Cavalli, D.; Citterio, M.; Costa, G.; Fanti, M.; Giugni, D.; Lari, T.; Lazzaroni, M.; Mandelli, L.; Manzoni, S.; Mazza, S. M.; Meroni, C.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Resconi, S.; Shojaii, S.; Stabile, A.; Tartarelli, G. F.; Troncon, C.; Turra, R.; Perez, M. Villaplana] Ist Nazl Fis Nucl, Sez Milano, Milan, Italy. [Andreazza, A.; Camplani, A.; Carminati, L.; Fanti, M.; Lazzaroni, M.; Manzoni, S.; Mazza, S. M.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Shojaii, S.; Turra, R.; Perez, M. Villaplana] Univ Milan, Dipartimento Fis, Milan, Italy. [Harkusha, S.; Kulchitsky, Y.; Kurochkin, Y. A.; Tsiareshka, P. V.] Natl Acad Sci Belarus, BI Stepanov Phys Inst, Minsk, Byelarus. [Aloisio, A.; Hrynevich, A.] Natl Sci & Educ Ctr Particle & High Energy Phys, Minsk, Byelarus. [Arguin, J-F.; Azuelos, G.; Billoud, T. R. V.; Dallaire, F.; Ducu, O. A.; Gagnon, L. 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B.; Duckeck, G.; Hartmann, N. M.; Heinrich, J. J.; Hertenberger, R.; Hoenig, F.; Legger, F.; Lorenz, J.; Loesel, P. J.; Maier, T.; Mann, A.; Mehlhase, S.; Meineck, C.; Mitrevski, J.; Mueller, R. S. P.; Rauscher, F.; Ruschke, A.; Schachtner, B. M.; Schaile, D.; Unverdorben, C.; Valderanis, C.; Walker, R.; Wittkowski, J.] Ludwig Maximilians Univ Munchen, Fak Phys, Munich, Germany. [Barillari, T.; Bethke, S.; Compostella, G.; Cortiana, G.; Ecker, K. M.; Flowerdew, J.; Giuliani, C.; Ince, T.; Kiryunin, A. E.; Kluth, S.; Koehler, N. M.; Kortner, O.; Kortner, S.; Kroha, H.; La Rosa, A.; Macchiolo, A.; Maier, A. A.; Mc Carthy, R. L.; Menke, S.; Mueller, F.; Nisius, R.; Nowak, S.; Oberlack, H.; Richter, R.; Salihagic, D.; Savic, N.; Schacht, P.; Schmidt-Sommerfeld, K. R.; Spettel, F.; Stonjek, S.; von der Schmitt, H.; Wildauer, A.] Werner Heisenberg Inst Phys, Max Planck Inst Phys, Munich, Germany. [Fusayasu, T.; Shimojima, M.] Nagasaki Inst Appl Sci, Nagasaki, Japan. [Horii, Y.; Kawade, K.; Nakahama, Y.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Grad Sch Sci, Nagoya, Aichi, Japan. [Horii, Y.; Kawade, K.; Nakahama, Y.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Kobayashi Maskawa Inst, Nagoya, Aichi, Japan. [Aloisio, A.; Alviggi, M. G.; Canale, V.; Carlino, G.; Cirotto, F.; Conventi, F.; de Asmundis, R.; Della Pietra, M.; Doria, A.; Izzo, V.; Merola, L.; Perrella, S.; Rossi, E.; Pineda, A. Sanchez; Sekhniaidze, G.] Ist Nazl Fis Nucl, Sez Napoli, Naples, Italy. [Aloisio, A.; Alviggi, M. G.; Canale, V.; Cirotto, F.; Merola, L.; Perrella, S.; Rossi, E.; Pineda, A. Sanchez] Univ Napoli, Dipartimento Fis, Naples, Italy. [Gorelov, I.; Hoeferkamp, M. R.; Mc Fadden, N. C.; Seidel, S. C.; Taylor, A. C.; Toms, K.] Univ New Mexico, Dept Phys & Astron, Albuquerque, NM 87131 USA. [Caron, S.; Colasurdo, L.; Croft, V.; De Groot, N.; Filthaut, F.; Galea, C.; Igonkina, O.; Konig, A. C.; Nektarijevic, S.; Schouwenberg, J. F. P.; Strubig, A.] Radboud Univ Nijmegen, Nikhef, Inst Math Astrophys & Particle Phys, Nijmegen, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; de Jong, P.; Deigaard, I.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.; Wolf, T. M. H.] Nikhef Natl Inst Subat Phys, Amsterdam, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.] Univ Amsterdam, Amsterdam, Netherlands. [Adelman, J.; Brost, E.; Burghgrave, B.; Chakraborty, D.; Klimek, P.; Saha, P.] No Illinois Univ, Dept Phys, De Kalb, IL 60115 USA. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Bogdanchikov, A. G.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Kharlamova, T.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] Budker Inst Nucl Phys, SB RAS, Novosibirsk, Russia. [Becot, C.; Bernius, C.; Cranmer, K.; Haas, A.; Heinrich, L.; Kaplan, B.; Karthik, K.; Konoplich, R.; Mincer, A. I.; Nemethy, P.; Neves, R. M.] NYU, Dept Phys, 4 Washington Pl, New York, NY 10003 USA. [Beacham, J. B.; Che, S.; Gan, K. K.; Ishmukhametov, R.; Kagan, H.; Kass, R. D.; Looper, K. A.; Shrestha, S.; Tannenwald, B. B.] Ohio State Univ, Columbus, OH 43210 USA. [Nakano, I.] Okayama Univ, Fac Sci, Okayama 700, Japan. [Abbott, B.; Alhroob, M.; Bertsche, D.; De Benedetti, A.; Gutierrez, P.; Hasib, A.; Norberg, S.; Pearson, B.; Rifki, O.; Severini, H.; Shope, D. R.; Skubic, P.; Strauss, M.] Univ Oklahoma, Homer L Dodge Dept Phys & Astron, Norman, OK 73019 USA. [Cantero, J.; Haley, J.; Jamin, D. O.; Khanov, A.; Rizatdinova, F.; Sidorov, D.] Oklahoma State Univ, Dept Phys, Stillwater, OK 74078 USA. [Chytka, L.; Hamal, P.; Hrabovsky, M.; Kvita, J.; Nozka, L.] Palacky Univ, RCPTM, Olomouc, Czech Republic. [Abreu, R.; Allen, B. W.; Brau, J. E.; Dattagupta, A.; Hopkins, W. H.; Majewski, S.; Potter, C. T.; Radloff, P.; Sinev, N. B.; Snyder, I. M.; Strom, D. M.; Torrence, E.; Wanotayaroj, C.; Whalen, K.; Winklmeier, F.] Univ Oregon, Ctr High Energy Phys, Eugene, OR 97403 USA. [Abeloos, B.; Ayoub, M. K.; Bassalat, A.; Binet, S.; Bourdarios, C.; De Regie, J. B. De Vivie; Delgove, D.; Duflot, L.; Escalier, M.; Fayard, L.; Fournier, D.; Gkougkousis, E. L.; Goudet, C. R.; Grivaz, J. -F.; Hariri, F.; Henrot-Versille, S.; Hrivnac, J.; Iconomidou-Fayard, L.; Kado, M.; Lounis, A.; Maiani, C.; Makovec, N.; Morange, N.; Nellist, C.; Petroff, P.; Poggioli, L.; Puzo, P.; Rousseau, D.; Rybkin, G.; Schaffer, A. C.; Serin, L.; Simion, S.; Tanaka, R.; Zerwas, D.; Zhang, Z.] Univ Paris 11, Univ Paris Saclay, CNRS IN2P3, LAL, Orsay, France. [Hanagaki, K.; Ishijima, N.; Nomachi, M.; Sugaya, Y.; Teoh, J. J.; Yamaguchi, Y.] Osaka Univ, Grad Sch Sci, Osaka, Japan. [Bugge, M. K.; Cameron, D.; Catmore, J. R.; Feigl, S.; Franconi, L.; Garonne, V.; Gjelsten, B. K.; Gramstad, E.; Morisbak, V.; Nilsen, J. K.; Ould-Saada, F.; Pajchel, K.; Pedersen, M.; Raddum, S.; Read, A. L.; Rohne, O.; Sandaker, H.; Serfon, C.; Stapnes, S.; Strandlie, A.] Univ Oslo, Dept Phys, Oslo, Norway. [Artoni, G.; Backes, M.; Barr, A. J.; Becker, K.; Beresford, L.; Bortoletto, D.; Burr, J. T. P.; Cooper-Sarkar, A. M.; Ortuzar, M. Crispin; Fawcett, W. J.; Frost, J. A.; Gallas, E. J.; Giuli, F.; Gupta, S.; Gwenlan, C.; Hays, C. P.; Henderson, J.; Huffman, T. B.; Issever, C.; Kalderon, C. W.; Nagai, K.; Nickerson, R. B.; Norjoharuddeen, N.; Petrov, M.; Pickering, M. A.; Radescu, V.; Tseng, J. C-L.; Viehhauser, G. H. A.; Vigani, L.; Weidberg, A. R.; Zhong, J.] Univ Oxford, Dept Phys, Oxford, England. [Dondero, P.; Farina, E. M.; Ferrari, R.; Fraternali, M.; Gaudio, G.; Introzzi, G.; Kourkoumeli-Charalampidi, A.; Lanza, A.; Livan, M.; Negri, A.; Polesello, G.; Rebuzzi, D. M.; Rimoldi, A.; Vercesi, V.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Dondero, P.; Farina, E. M.; Fraternali, M.; Introzzi, G.; Kourkoumeli-Charalampidi, A.; Livan, M.; Negri, A.; Rebuzzi, D. M.; Rimoldi, A.] Univ Pavia, Dipartimento Fis, Pavia, Italy. [Balunas, W. K.; Brendlinger, K.; Di Clemente, W. K.; Fletcher, R. R. M.; Haney, B.; Heim, S.; Hines, E.; Jackson, B.; Kroll, J.; Lipeles, E.; Miguens, J. Machado; Mistry, K. P.; Reichert, J.; Schaefer, L.; Thomson, E.; Vanguri, R.; Williams, H. H.; Yoshihara, K.] Univ Penn, Dept Phys, Philadelphia, PA USA. [Basalaev, A.; Ezhilov, A.; Fedin, O. L.; Gratchev, V.; Levchenko, M.; Maleev, V. P.; Naryshkin, I.; Ryabov, Y. F.; Schegelsky, V. A.; Seliverstov, D. M.; Solovyev, V.] BP Konstantinov Nucl Phys Inst, Kurchatov Inst, Natl Res Ctr, St Petersburg, Russia. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Univ Pisa, Dipartimento Fis E Fermi, Pisa, Italy. [Bianchi, R. M.; Boudreau, J.; Escobar, C.; Farina, C.; Hong, T. M.; Mueller, J.; Sapp, K.; Su, J.] Univ Pittsburgh, Dept Phys & Astron, Pittsburgh, PA USA. [Aguilar-Saavedra, J. A.; Amor Dos Santos, S. P.; Amorim, A.; Araque, J. P.; Carvalho, J.; Castro, N. F.; Conde Muino, P.; Da Cunha Sargedas De Sousa, M. J.; Fiolhais, M. C. N.; Galhardo, B.; Gomes, A.; Goncalo, R.; Jorge, P. M.; Maio, A.; Maneira, J.; Seabra, L. F. Oleiro; Onofre, A.; Pedro, R.; Santos, H.; Saraiva, J. G.; Silva, J.; Delgado, A. Tavares; Veloso, F.; Wolters, H.] Lab Instrumentacao & Fis Expt Particulas LIP, Lisbon, Portugal. [Amorim, A.; Conde Muino, P.; Da Cunha Sargedas De Sousa, M. J.; Gomes, A.; Jorge, P. M.; Miguens, J. Machado; Maio, A.; Maneira, J.; Pedro, R.; Delgado, A. Tavares] Univ Lisbon, Fac Ciencias, Lisbon, Portugal. [Amor Dos Santos, S. P.; Carvalho, J.; Fiolhais, M. C. N.; Galhardo, B.; Veloso, F.; Wolters, H.] Univ Coimbra, Dept Phys, Coimbra, Portugal. [Gomes, A.; Maio, A.; Saraiva, J. G.; Silva, J.] Univ Lisbon, Ctr Fis Nucl, Lisbon, Portugal. [Onofre, A.] Univ Minho, Dept Fis, Braga, Portugal. [Aguilar-Saavedra, J. A.] Univ Granada, Dept Fis Teor & Cosmos, Granada, Spain. [Aguilar-Saavedra, J. A.] Univ Granada, CAFPE, Granada, Spain. Univ Nova Lisboa, Dept Fis, Caparica, Portugal. Univ Nova Lisboa, Fac Ciencias & Tecnol, CEFITEC, Caparica, Portugal. [Chudoba, J.; Havranek, M.; Hejbal, J.; Jakoubek, T.; Kepka, O.; Kupco, A.; Kus, V.; Lokajicek, M.; Lysak, R.; Marcisovsky, M.; Mikestikova, M.; Nemecek, S.; Penc, O.; Sicho, P.; Staroba, P.; Svatos, M.; Tasevsky, M.; Vrba, V.] Acad Sci Czech Republic, Inst Phys, Prague, Czech Republic. [Ali, B.; Augsten, K.; Caforio, D.; Gallus, P.; Hubacek, Z.; Myska, M.; Pospisil, S.; Seifert, F.; Simak, V.; Slavicek, T.; Smolek, K.; Solar, M.; Sopczak, A.; Sopko, V.; Suk, M.; Turecek, D.; Vacek, V.; Vlasak, M.; Vokac, P.; Vykydal, Z.; Zeman, M.] Czech Tech Univ, Prague, Czech Republic. [Berta, P.; Carli, I.; Davidek, T.; Dolejsi, J.; Dolezal, Z.; Kodys, P.; Kosek, T.; Leitner, R.; Mlynarikova, M.; Reznicek, P.; Scheirich, D.; Slovak, R.; Spousta, M.; Sykora, T.; Tas, P.; Todorova-Nova, S.; Valkar, S.; Vorobel, V.] Charles Univ Prague, Fac Math & Phys, Prague, Czech Republic. [Borisov, A.; Cheremushkina, E.; Denisov, S. P.; Fakhrutdinov, R. M.; Fenyuk, A. B.; Golubkov, D.; Kamenshchikov, A.; Karyukhin, A. N.; Kozhin, A. S.; Minaenko, A. A.; Myagkov, A. G.; Nikolaenko, V.; Ryzhov, A.; Solodkov, A. A.; Solovyanov, O. V.; Starchenko, E. A.; Zaitsev, A. M.; Zenin, O.] NRC KI, State Res Ctr, Inst High Energy Phys Protvino, Moscow, Russia. [Adye, T.; Baines, J. T.; Barnett, B. M.; Burke, S.; Dewhurst, A.; Dopke, J.; Emeliyanov, D.; Gallop, B. J.; Gee, C. N. P.; Haywood, S. J.; Kirk, J.; Martin-Haugh, S.; McMahon, S. J.; Middleton, R. P.; Murray, W. J.; Phillips, P. W.; Sankey, D. P. C.; Tyndel, M.; Wickens, F. J.; Wielers, M.; Worm, S. D.] Rutherford Appleton Lab, Particle Phys Dept, Didcot, Oxon, England. [Anulli, F.; Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; De Pedis, D.; De Salvo, A.; Di Donato, C.; Falciano, S.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Luminaria, L.; Messina, A.; Nisati, A.; Pasqualucci, E.; Petrolo, E.; Pontecorvo, L.; Rescigno, M.; Rosati, S.; Tehrani, F. Safai; Vanadia, M.; Vari, R.; Veneziano, S.; Verducci, M.; Zanello, L.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; Di Donato, C.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Messina, A.; Vanadia, M.; Verducci, M.; Zanello, L.] Univ Roma La Sapienza, Dipartimento Fis, Rome, Italy. [Aielli, G.; Camarri, P.; Cardarelli, R.; Cerrito, L.; DiCiaccio, A.; Liberti, B.; Salamon, A.; Santonico, R.] Ist Nazl Fis Nucl, Sez Roma Tor Vergata, Rome, Italy. [Aielli, G.; Camarri, P.; Cerrito, L.; DiCiaccio, A.; Salamon, A.; Santonico, R.] Univ Roma Tor Vergata, Dipartimento Fis, Rome, Italy. [Baroncelli, A.; Biglietti, M.; Ceradini, F.; Di Micco, B.; Farilla, A.; Graziani, E.; Iodice, M.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Stanescu, C.; Taccini, C.] Ist Nazl Fis Nucl, Sez Roma Tre, Rome, Italy. [Ceradini, F.; Di Micco, B.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Taccini, C.] Univ Rome Tre, Dipartimento Matemat & Fis, Rome, Italy. [Benchekroun, D.; Chafaq, A.; Hoummada, A.] Univ Hassan 2, Reseau Univ Phys Hautes Energies, Fac Sci Ain Chock, Casablanca, Morocco. Ctr Natl Energie Sci Tech Nucl, Rabat, Morocco. [El Kacimi, M.; Goujdami, D.] Univ Cadi Ayyad, LPHEA, Fac Sci Semlalia, Marrakech, Morocco. [Aaboud, M.; Derkaoui, J. E.; Ouchrif, M.] Univ Mohamed Premier, Fac Sci, Oujda, Morocco. [Aaboud, M.; Derkaoui, J. E.; Jinnouchi, O.] LPTPM, Oujda, Morocco. [Cherkaoui El Moursli, R.; Ezzi, M.; Fassi, F.; Haddad, N.; Idrissi, Z.; Tayalati, Y.] Univ Mohammed 5, Fac Sci, Rabat, Morocco. [Bachacou, H.; Balli, F.; Bauer, F.; Besson, N.; Blanchard, J. -B.; Boonekamp, M.; Chevalier, L.; Hoffmann, M. Dano; Deliot, F.; Denysiuk, D.; Etienvre, A. I.; Formica, A.; Giraud, F.; Da Costa, J. Goncalves Pinto Firmino; Guyot, C.; Hanna, R.; Hassani, S.; Jeanneau, F.; Kivernyk, O.; Kozanecki, W.; Kukla, R.; Lancon, E.; Laporte, J. F.; Le Quilleuc, E. P.; Lesage, A. A. J.; Mansoulie, B.; Meyer, J-P.; Nicolaidou, R.; Ouraou, A.; Rodriguez, L. Pacheco; Perego, M. M.; Peyaud, A.; Saimpert, M.; Schoeffel, L.; Schune, Ph.; Schwemling, Ph.; Schwindling, J.] CEA Saclay, DSM IRFU, Gif Sur Yvette, France. [AbouZeid, S.; Battaglia, M.; Debenedetti, C.; Grillo, A.; Hance, M.; Kuhl, A.; Law, A. T.; Litke, A. M.; Lockman, W. S.; Nielsen, J.; Reece, R.; Rose, P.; Sadrozinski, H. F-W.; Schier, S.; Schumm, B. A.; Seiden, A.] Univ Calif Santa Cruz, Santa Cruz Inst Particle Phys, Santa Cruz, CA 95064 USA. [Alpigiani, C.; Blackburn, D.; Goussiou, A. G.; Hsu, S. -C.; Johnson, W. J.; Lubatti, H. J.; Meehan, S.; Rompotis, N.; Rosten, R.; Rothberg, J.; Russell, H. L.; De Bruin, P. H. Sales; Pastor, E. Torro; Watts, G.; Whallon, N. L.] Univ Washington, Dept Phys, Seattle, WA 98195 USA. [Du, Y.; Feng, C.; Liu, B.; Ma, L. L.; Ma, Y.; Wang, C.; Zhang, X.; Zhao, Y.; Zhu, C. G.] Shandong Univ, Sch Phys, Jinan, Shandong, Peoples R China. [Bret, M. Cano; Guo, J.; Hu, S.; Li, L.; Yang, H.] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai Key Lab Particle Phys & Cosmol, Shanghai, Peoples R China. [Anastopoulos, C.; Costanzo, D.; Donszelmann, T. Cuhadar; Dawson, I.; Fletcher, G. T.; Hamity, G. N.; Hodgkinson, M. C.; Hodgson, P.; Johansson, P.; Klinger, J. A.; Korolkova, E. V.; Kyriazopoulos, D.; Paredes, B. Lopez; Macdonald, C. M.; Miyagawa, P. S.; Parker, K. A.; Tovey, D. R.; Vickey, T.; Boeriu, O. E. Vickey] Univ Sheffield, Dept Phys & Astron, Sheffield, S Yorkshire, England. [Hasegawa, Y.; Takeshita, T.] Shinshu Univ, Dept Phys, Nagano, Japan. [Atlay, N. B.; Buchholz, P.; Campoverde, A.; Czirr, H.; Fleck, I.; Ghasemi, S.; Ibragimov, I.; Li, Y.; Walkowiak, W.; Ziolkowski, M.] Univ Siegen, Fachbereich Phys, Siegen, Germany. [Buat, Q.; Vetterli, M. C.] Simon Fraser Univ, Dept Phys, Burnaby, BC V5A 1S6, Canada. [Armbruster, A. J.; Barklow, T.; Bartoldus, R.; Bawa, H. S.; Black, J. E.; Gao, Y. S.; Garelli, N.; Grenier, P.; Ilic, N.; Kagan, M.; Kocian, M.; Koi, T.; Malone, C.; Mount, R.; Nachman, B. P.; Piacquadio, G.; Rubbo, F.; Salnikov, A.; Schwartzman, A.; Su, D.; Tompkins, L.; Wittgen, M.; Young, C.; Zeng, Q.] SLAC Natl Accelerator Lab, Stanford, CA USA. [Astalos, R.; Bartos, P.; Blazek, T.; Dado, T.; Melo, M.; Plazak, L.; Smiesko, J.; Sykora, I.; Tokar, S.; Zenis, T.] Comenius Univ, Fac Math Phys & Informat, Bratislava, Slovakia. [Bruncko, D.; Kladiva, E.; Strizenec, P.; Urban, J.] Slovak Acad Sci, Inst Expt Phys, Dept Subnucl Phys, Kosice, Slovakia. [Castaneda-Miranda, E.; Hamilton, A.; Yacoob, S.] Univ Cape Town, Dept Phys, Cape Town, South Africa. [Connell, S. H.; Govender, N.] Univ Johannesburg, Dept Phys, Johannesburg, South Africa. [Hsu, C.; Jivan, H.; Kar, D.; Garcia, B. R. Mellado; Reed, R. G.; Ruan, X.] Univ Witwatersrand, Sch Phys, Johannesburg, South Africa. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Bohm, C.; Clement, C.; Cribbs, W. A.; Gellerstedt, K.; Hellman, S.; Jon-And, K.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Silverstein, S. B.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Santurio, E. Valdes; Wallangen, V.] Stockholm Univ, Dept Phys, Stockholm, Sweden. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Clement, C.; Cribbs, W. A.; Gellerstedt, K.; Hellman, S.; Jon-And, K.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Santurio, E. Valdes; Wallangen, V.] Oskar Klein Ctr, Stockholm, Sweden. [Lund-Jensen, B.; Sidebo, P. E.; Strandberg, J.] Royal Inst Technol, Dept Phys, Stockholm, Sweden. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; Mc Carthy, R. L.; Montalbano, A.; Morvaj, L.; Piacquadio, G.; Radhakrishnan, S. K.; Rijssenbeek, M.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; Mc Carthy, R. L.; Montalbano, A.; Morvaj, L.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA. [Abraham, N. L.; Allbrooke, B. M. M.; Asquith, L.; Cerri, A.; Barajas, C. A. Chavez; De Sanctis, U.; De Santo, A.; Lerner, G.; Miano, F.; Salvatore, F.; Castillo, I. Santoyo; Shehu, C. Y.; Suruliz, K.; Sutton, M. R.; Vivarelli, I.; Winston, O. J.] Univ Sussex, Dept Phys & Astron, Brighton, E Sussex, England. [Black, C. W.; Finelli, K. D.; Jeng, G. -Y.; Limosani, A.; Morley, A. K.; Saavedra, A. F.; Scarcella, M.; Varvell, K. E.; Wang, J.; Yabsley, B.] Univ Sydney, Sch Phys, Sydney, NSW 2006, Australia. [Hou, S.; Hsu, P. J.; Lee, S. C.; Lin, S. C.; Liu, B.; Liu, D.; Lo Sterzo, F.; Mazini, R.; Shi, L.; Soh, D. A.; Song, H. Y.; Teng, P. K.; Wang, S. M.; Yang, Y.; Zhang, G.] Acad Sinica, Inst Phys, Taipei, Taiwan. [Abreu, H.; Gozani, E.; Rozen, Y.; Tarem, S.; van Eldik, N.] Technion Israel Inst Technol, Dept Phys, Haifa, Israel. [Abramowicz, H.; Alexander, G.; Ashkenazi, A.; Bella, G.; Benary, O.; Benhammou, Y.; Davies, M.; Duarte-Campderros, J.; Etzion, E.; Gershon, A.; Gueta, O.; Oren, Y.; Soffer, A.; Taiblum, N.] Tel Aviv Univ, Raymond & Beverly Sackler Sch Phys & Astron, Tel Aviv, Israel. [Gentsos, C.; Gkaitatzis, S.; Gkialas, I.; Iliadis, D.; Kimura, N.; Kordas, K.; Papageorgiou, K.; Petridou, C.; Sampsonidis, D.] Aristotle Univ Thessaloniki, Dept Phys, GR-54006 Thessaloniki, Greece. [Adachi, S.; Asai, S.; Chen, S.; Enari, Y.; Hanawa, K.; Ishino, M.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kishimoto, T.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Minegishi, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Okumura, Y.; Saito, T.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Int Ctr Elementary Particle Phys, Tokyo, Japan. [Adachi, S.; Asai, S.; Chen, S.; Enari, Y.; Hanawa, K.; Ishino, M.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kishimoto, T.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Minegishi, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Okumura, Y.; Saito, T.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Dept Phys, Tokyo, Japan. [Bratzler, U.; Fukunaga, C.] Tokyo Metropolitan Univ, Grad Sch Sci & Technol, Tokyo, Japan. [Hayakawa, D.; Ishitsuka, M.; Jinnouchi, O.; Kobayashi, D.; Kuze, M.; Motohashi, K.; Tanaka, M.; Todome, K.; Yamaguchi, D.] Tokyo Inst Technol, Dept Phys, Tokyo, Japan. [Chelkov, A.; Vaniachine, A.] Tomsk State Univ, Tomsk, Russia. [Batista, S. J.; Chau, C. C.; Cormier, K. J. R.; DeMarco, D. A.; Di Sipio, R.; Diamond, M.; Keoshkerian, H.; Krieger, P.; Liblong, A.; Mc Goldrick, G.; Orr, R. S.; Pascuzzi, V. R.; Polifka, R.; Rudolph, M. S.; Savard, P.; Sinervo, P.; Taenzer, J.; Teuscher, R. J.; Trischuk, W.; Veloce, L. M.; Venturi, N.] Univ Toronto, Dept Phys, Toronto, ON, Canada. [Iuppa, R.] Ist Nazl Fis Nucl, TIFPA, Trento, Italy. [Iuppa, R.] Univ Trento, Trento, Italy. [Azuelos, G.; Canepa, A.; Chekulaev, S. V.; Gingrich, D. M.; Hod, N.; Jovicevic, J.; Oakham, F. G.; Codina, E. Perez; Savard, P.; Schneider, B.; Stelzer-Chilton, O.; Tafirout, R.; Trigger, I. M.; Vetterli, M. C.] TRIUMF, Vancouver, BC, Canada. [Canepa, A.; Chekulaev, S. V.; Hod, N.; Jovicevic, J.; Codina, E. Perez; Schneider, B.; Stelzer-Chilton, O.; Tafirout, R.; Trigger, I. M.] York Univ, Dept Phys & Astron, Toronto, ON, Canada. [Hagihara, M.; Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Fac Pure & Appl Sci, Tsukuba, Ibaraki, Japan. [Hagihara, M.; Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Ctr Integrated Res Fundamental Sci & Engn, Tsukuba, Ibaraki, Japan. [Beauchemin, P. H.; Meoni, E.; Sliwa, K.; Son, H.; Wetter, J.] Tufts Univ, Dept Phys & Astron, Medford, MA USA. [Casper, D. W.; Colombo, T.; Frate, M.; Guest, D.; Lankford, A. J.; Mete, A. S.; Nelson, A.; Ntekas, K.; Scannicchio, D. A.; Schernau, M.; Shimmin, C. O.; Taffard, A.; Unel, G.; Whiteson, D.] Univ Calif Irvine, Dept Phys & Astron, Irvine, CA USA. [Acharya, B. S.; Boldyrev, A. S.; Cheatham, S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Quayle, W. B.; Serkin, L.; Shaw, K.; Soualah, R.; Truong, L.] Ist Nazl Fis Nucl, Grp Collegato Udine, Sez Trieste, Udine, Italy. [Acharya, B. S.; Quayle, W. B.; Serkin, L.; Shaw, K.] Abdus Salaam Int Ctr Theoret Phys, Trieste, Italy. [Boldyrev, A. S.; Cheatham, S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Soualah, R.; Truong, L.] Univ Udine, Dipartimento Chim Fis & Ambiente, Udine, Italy. [Kuutmann, E. Bergeaas; Brenner, R.; Ekelof, T.; Ellert, M.; Ferrari, A.; Maddocks, H. J.; Ohman, H.; Rangel-Smith, C.] Uppsala Univ, Dept Phys & Astron, Uppsala, Sweden. [Atkinson, M.; Armadans, R. Caminal; Cavaliere, V.; Chang, P.; Errede, S.; Hooberman, B. H.; Khader, M.; Lie, K.; Liss, T. M.; Liu, L.; Long, J. D.; Outschoorn, V. I. Martinez; Neubauer, M. S.; Rybar, M.; Shang, R.; Sickles, A. M.; Vichou, I.; Zeng, J. C.] Univ Illinois, Dept Phys, 1110 W Green St, Urbana, IL 61801 USA. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Alberich, L. Cerda; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; RomeroAdam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, Inst Fis Corpuscular IFIC, Valencia, Spain. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Alberich, L. Cerda; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; RomeroAdam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, Dept Fis Atom Mol & Nucl, Valencia, Spain. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Alberich, L. Cerda; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; RomeroAdam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Valencia, Dept Ingn Elect, Valencia, Spain. Univ Valencia, Inst Microelect Barcelona IMB CNM, Valencia, Spain. CSIC, Valencia, Spain. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Alberich, L. Cerda; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; RomeroAdam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ British Columbia, Dept Phys, Vancouver, BC, Canada. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Alberich, L. Cerda; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; RomeroAdam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Ferrer, J. A. Valls; Vos, M.] Univ Victoria, Dept Phys & Astron, Victoria, BC, Canada. [Beckingham, M.; Ennis, J. S.; Farrington, S. M.; Harrison, P. F.; Jeske, C.; Jones, G.; Martin, T. A.; Murray, W. J.; Pianori, E.; Spangenberg, M.] Univ Warwick, Dept Phys, Coventry, W Midlands, England. [Iizawa, T.; Kaji, T.; Mitani, T.; Sakurai, Y.; Yorita, K.] Waseda Univ, Tokyo, Japan. [Balek, P.; Bressler, S.; Citron, Z. H.; Duchovni, E.; Dumancic, M.; Gross, E.; Kohler, M. K.; Lellouch, D.; Levinson, L. J.; Mikenberg, G.; Milov, A.; Pitt, M.; Ravinovich, I.; Roth, I.; Schaarschmidt, J.; Smakhtin, V.; Turgeman, D.] Weizmann Inst Sci, Dept Particle Phys, Rehovot, Israel. [Banerjee, Sw.; Guan, W.; Hard, A. S.; Heng, Y.; Ji, H.; Ju, X.; Kaplan, L. S.; Kashif, L.; Ming, Y.; Wang, F.; Wiedenmann, W.; Wu, S. L.; Yang, H.; Zhang, F.; Zhou, C.; Zobernig, G.] Univ Wisconsin, Dept Phys, 1150 Univ Ave, Madison, WI 53706 USA. [Herget, V.; Kuger, F.; Redelbach, A.; Schreyer, M.; Sidiropoulou, O.; Siragusa, G.; Stroehmer, R.; Trefzger, T.; Weber, S. W.; Zibell, A.] Univ Wurzburg, Fak Phys & Astron, Wurzburg, Germany. [Bannoura, A. A. E.; Boerner, D.; Cornelissen, T.; Ellinghaus, F.; Ernis, G.; Fischer, J.; Flick, T.; Gabizon, O.; Gilles, G.; Hamacher, K.; Harenberg, T.; Hirschbuehl, D.; Kersten, S.; Kuechler, J. T.; Maettig, P.; Neumann, M.; Pataraia, S.; Riegel, C. J.; Sandhoff, M.; Tepel, F.; Vogel, M.; Wagner, W.; Zeitnitz, C.] Berg Univ Wuppertal, Fachgrp Phys, Fak Math & Naturwissensch, Wuppertal, Germany. [Baker, O. K.; Noccioli, E. Benhar; Cummings, J.; Demers, S.; Ideal, E.; Lagouri, T.; Leister, A. G.; Loginov, A.; Paganini, M.; Hernandez, D. Paredes; Thomsen, L. A.; Tipton, P.; Vasquez, J. G.; Wang, X.] Yale Univ, Dept Phys, New Haven, CT USA. [Hakobyan, H.; Vardanyan, G.] Yerevan Phys Inst, Yerevan, Armenia. [Rahal, G.] IN2P3, Ctr Calcul, Villeurbanne, France. [Acharya, B. S.] Kings Coll London, Dept Phys, London, England. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] Novosibirsk State Univ, Novosibirsk, Russia. [Banerjee, Sw.] Univ Louisville, Dept Phys & Astron, Louisville, KY 40292 USA. [Bassalat, A.] An Najah Natl Univ, Dept Phys, Nablus, Israel. [Bawa, H. S.; Gao, Y. S.] Calif State Univ Fresno, Dept Phys, Fresno, CA 93740 USA. [Beck, H. P.] Univ Fribourg, Dept Phys, Fribourg, Switzerland. [Casado, M. P.] Univ Autonoma Barcelona, Dept Fis, Barcelona, Spain. [Castro, N. F.] Univ Porto, Fac Ciencias, Dept Fis & Astron, Oporto, Portugal. [Conventi, F.; Della Pietra, M.] Univ Napoli Parthenope, Naples, Italy. [Corriveau, F.; McPherson, R. A.; Robertson, S. H.; Sobie, R.; Teuscher, R. J.] Inst Particle Phys, Victoria, BC, Canada. [Fedin, O. L.] St Petersburg State Polytech Univ, Dept Phys, St Petersburg, Russia. [Govender, N.] Ctr High Performance Comp, CSIR Campus, Cape Town, South Africa. [Grinstein, S.; Juste Rozas, A.; Martinez, M.] ICREA, Inst Catalana Rec & Estud Avancats, Barcelona, Spain. [Hsu, P. J.] Natl Tsing Hua Univ, Dept Phys, Hsinchu 30013, Taiwan. [Khubua, J.] Georgian Tech Univ, Tbilisi, Rep of Georgia. [Kono, T.; Nagai, R.] Ochanomizu Univ, Ochadai Acad Prod, Tokyo, Japan. [Konoplich, R.] Manhattan Coll, New York, NY USA. [Lin, S. C.] Acad Sinica, Inst Phys, Acad Sinica Grid Comp, Taipei, Taiwan. [Moss, J.] Calif State Univ Sacramento, Dept Phys, Sacramento, CA 95819 USA. [Myagkov, A. G.; Nikolaenko, V.; Zaitsev, A. M.] State Univ, Moscow Inst Phys & Technol, Dolgoprudnyi, Russia. [Pasztor, G.] Eotvos Lorand Univ, Budapest, Hungary. [Pinamonti, M.] Scuola Int Super Studi Avanzati, SISSA, Trieste, Italy. Univ South Carolina, Dept Phys & Astron, Columbia, SC 29208 USA. [Rodina, Y.] Barcelona Inst Sci & Technol, Inst Fis Altes Energies, Barcelona, Spain. [Shi, L.] Sun Yat Sen Univ, Sch Phys & Engn, Guangzhou, Guangdong, Peoples R China. [Shiyakova, M.] Bulgarian Acad Sci, Inst Nucl Res & Nucl Energy, Sofia, Bulgaria. [Smirnova, L. N.] Moscow MV Lomonosov State Univ, Fac Phys, Moscow, Russia. [Tompkins, L.] Stanford Univ, Dept Phys, Stanford, CA 94305 USA. [Toth, J.] Wigner Res Ctr Phys, Inst Particle & Nucl Phys, Budapest, Hungary. [Vest, A.] Flensburg Univ Appl Sci, Flensburg, Germany. [Yusuff, I.] Univ Malaya, Dept Phys, Kuala Lumpur, Malaysia. PKU CHEP, Beijing, Peoples R China. RP Aaboud, M (reprint author), Univ Mohamed Premier, Fac Sci, Oujda, Morocco. RI Doyle, Anthony/C-5889-2009; Warburton, Andreas/N-8028-2013; Vanyashin, Aleksandr/H-7796-2013; Gladilin, Leonid/B-5226-2011; Mitsou, Vasiliki/D-1967-2009; Camarri, Paolo/M-7979-2015; Carvalho, Joao/M-4060-2013; Tikhomirov, Vladimir/M-6194-2015; Livan, Michele/D-7531-2012; Prokoshin, Fedor/E-2795-2012; OI Belyaev, Nikita/0000-0002-1131-7121; Doyle, Anthony/0000-0001-6322-6195; Warburton, Andreas/0000-0002-2298-7315; Vanyashin, Aleksandr/0000-0002-0367-5666; Gladilin, Leonid/0000-0001-9422-8636; Mitsou, Vasiliki/0000-0002-1533-8886; Camarri, Paolo/0000-0002-5732-5645; Carvalho, Joao/0000-0002-3015-7821; Tikhomirov, Vladimir/0000-0002-9634-0581; Livan, Michele/0000-0002-5877-0062; Prokoshin, Fedor/0000-0001-6389-5399; Belanger-Champagne, Camille/0000-0003-2368-2617 FU ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW, Austria; FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq, Brazil; FAPESP, Brazil; NSERC, Canada; NRC, Canada; CFI, Canada; CERN; CONICYT, Chile; CAS, China; MOST, China; NSFC, China; COLCIENCIAS, Colombia; MSMT CR, Czech Republic; MPO CR, Czech Republic; VSC CR, Czech Republic; DNRF, Denmark; DNSRC, Denmark; IN2P3-CNRS, France; CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, Germany; HGF, Germany; MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, Israel; I-CORE, Israel; Benoziyo Center, Israel; INFN, Italy; MEXT, Japan; JSPS, Japan; CNRST, Morocco; FOM, Netherlands; NWO, Netherlands; RCN, Norway; MNiSW, Poland; NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia; NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS, Slovenia; MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC, Sweden; Wallenberg Foundation, Sweden; SERI, Switzerland; SNSF, Switzerland; Canton of Bern, Switzerland; Canton of Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE, United States of America; NSF, United States of America; BCKDF, Canada; Canada Council, Canada; CANARIE, Canada; CRC, Canada; Compute Canada, Canada; FQRNT, Canada; Ontario Innovation Trust, Canada; EPLANET; ERC; Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, ANR, Region Auvergne and Fondation Partager le Savoir, France; DFG, Germany; AvH Foundation, Germany; Herakleitos; Thales and Aristeia programmes - EU-ESF; Greek NSRF; BSF, Israel; GIF, Israel; Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Generalitat Valenciana, Spain; Royal Society, United Kingdom; Leverhulme Trust, United Kingdom FX We acknowledge the support of ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW and FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq and FAPESP, Brazil; NSERC, NRC and CFI, Canada; CERN; CONICYT, Chile; CAS, MOST and NSFC, China; COLCIENCIAS, Colombia; MSMT CR, MPO CR and VSC CR, Czech Republic; DNRF and DNSRC, Denmark; IN2P3-CNRS, CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, HGF, and MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, I-CORE and Benoziyo Center, Israel; INFN, Italy; MEXT and JSPS, Japan; CNRST, Morocco; FOM and NWO, Netherlands; RCN, Norway; MNiSW and NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia and NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS and MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC and Wallenberg Foundation, Sweden; SERI, SNSF and Cantons of Bern and Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE and NSF, United States of America. In addition, individual groups and members have received support from BCKDF, the Canada Council, CANARIE, CRC, Compute Canada, FQRNT, and the Ontario Innovation Trust, Canada; EPLANET, ERC, FP7, Horizon 2020 and Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, ANR, Region Auvergne and Fondation Partager le Savoir, France; DFG and AvH Foundation, Germany; Herakleitos, Thales and Aristeia programmes co-financed by EU-ESF and the Greek NSRF; BSF, GIF and Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Generalitat Valenciana, Spain; the Royal Society and Leverhulme Trust, United Kingdom. NR 61 TC 2 Z9 2 U1 7 U2 7 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 251 EP 268 DI 10.1016/j.physletb.2016.10.042 PG 18 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600038 ER PT J AU Khachatryan, V Sirunyan, AM Tumasyan, A Adam, W Asilar, E Bergauer, T Brandstetter, J Brondolin, E Dragicevic, M Ero, J Flechl, M Friedl, M Fruhwirth, R Ghete, VM Hartl, C Hormann, N Hrubec, J Jeitler, M Konig, A Kratschmer, I Liko, D Matsushita, T Mikulec, I Rabady, D Rad, N Rahbaran, B Rohringer, H Schieck, J Strauss, J Treberer-Treberspurg, W Waltenberger, W Wulz, CE Mossolov, V Shumeiko, N Gonzalez, JS Alderweireldt, S DeWolf, EA Janssen, X Lauwers, J de Klundert, MV Van Haevermaet, H Van Mechelen, P Van Remortel, N Van Spilbeeck, A Abu Zeid, S Blekman, F D'Hondt, J Daci, N De Bruyn, I Deroover, K Heracleous, N Lowette, S Moortgat, S Moreels, L Olbrechts, A Python, Q Tavernier, S Van Doninck, W Van Mulders, P Van Parijs, I Brun, H Caillol, C Clerbaux, B De Lentdecker, G Delannoy, H Fasanella, G Favart, L Goldouzian, R Grebenyuk, A Karapostoli, G Lenzi, T Leonard, A Luetic, J Maerschalk, T Marinov, A Randle-conde, A Seva, T Vander Velde, C Vanlaer, P Yonamine, R Zenoni, F Zhang, F Cimmino, A Cornelis, T Dobur, D Fagot, A Garcia, G Gul, M Poyraz, D Salva, S Schofbeck, R Tytgat, M Van Driessche, W Yazgan, E Zaganidis, N Bakhshiansohi, H Beluffi, C Bondu, O Brochet, S Bruno, G Caudron, A De Visscher, S Delaere, C Delcourt, M Forthomme, L Francois, B Giammanco, A Jafari, A Jez, P Komm, M Lemaitre, V Magitteri, A Mertens, A Musich, M Nuttens, C Piotrzkowski, K Quertenmont, L Selvaggi, M Marono, MV Wertz, S Beliy, N Alda, WL Alves, FL Alves, GA Brito, L Hensel, C Moraes, A Pol, ME Teles, PR Das Chagas, EBB Carvalho, W Chinellato, J Custodio, A Da Costa, EM Da Silveira, GG Damiao, DD Martins, CD De Souza, SF Guativa, LMH Malbouisson, H Figueiredo, DM Herrera, CM Mundim, L Nogima, H Da Silva, WLP Santoro, A Sznajder, A Manganote, EJT Pereira, AV Ahuja, S Bernardes, CA Dogra, S Tomei, TRFP Gregores, EM Mercadante, PG Moon, CS Novaes, SF Padula, SS Abad, DR Vargas, JCR Aleksandrov, A Hadjiiska, R Iaydjiev, P Rodozov, M Stoykova, S Sultanov, G Vutova, M Dimitrov, A Glushkov, I Litov, L Pavlov, B Petkov, P Fang, W Ahmad, M Bian, JG Chen, GM Chen, HS Chen, M Chen, Y Cheng, T Jiang, CH Leggat, D Liu, Z Romeo, F Shaheen, SM Spiezia, A Tao, J Wang, C Wang, Z Zhang, H Zhao, J Ban, Y Chen, G Li, Q Liu, S Mao, Y Qian, SJ Wang, D Xu, Z Avila, C Cabrera, A Sierra, LFC Florez, C Gomez, JP Hernandez, CFG Alvarez, JDR Sanabria, JC Godinovic, N Lelas, D Puljak, I Cipriano, PMR Antunovic, Z Kovac, M Brigljevic, V Ferencek, D Kadija, K Micanovic, S Sudic, L Susa, T Attikis, A Mavromanolakis, G Mousa, J Nicolaou, C Ptochos, F Razis, PA Rykaczewski, H Finger, M Finger, M Jarrin, EC Kamel, AE Mahmoud, MA Radi, A Calpas, B Kadastik, M Murumaa, M Perrini, L Raidal, M Tiko, A Veelken, C Eerola, P Pekkanen, J Voutilainen, M Harkonen, J Karimaki, V Kinnunen, R Lampen, T Lassila-Perini, K Lehti, S Linden, T Luukka, P Peltola, T Tuominiemi, J Tuovinen, E Wendland, L Talvitie, J Tuuva, T Besancon, M Couderc, F Dejardin, M Denegri, D Fabbro, B Faure, JL Favaro, C Ferri, F Ganjour, S Ghosh, S Givernaud, A Gras, P de Monchenault, GH Jarry, P Kucher, I Locci, E Machet, M Malcles, J Rander, J Rosowsky, A Titov, M Zghiche, A Abdulsalam, A Antropov, I Baffioni, S Beaudette, F Busson, P Cadamuro, L Chapon, E Charlot, C Davignon, O de Cassagnac, RG Jo, M Lisniak, S Mine, P Nguyen, M Ochando, C Ortona, G Paganini, P Pigard, P Regnard, S Salerno, R Sirois, Y Strebler, T Yilmaz, Y Zabi, A Agram, JL Andrea, J Aubin, A Bloch, D Brom, JM Buttignol, M Chabert, EC Chanon, N Collard, C Conte, E Coubez, X Fontaine, JC Gele, D Goerlach, U Le Bihan, AC Merlin, JA Skovpen, K Van Hove, P Gadrat, S Beauceron, S Bernet, C Boudoul, G Bouvier, E Montoya, CAC Chierici, R Contardo, D Courbon, B Depasse, P El Mamouni, H Fan, J Fay, J Gascon, S Gouzevitch, M Grenier, G Ille, B Lagarde, F Laktineh, IB Lethuillier, M Mirabito, L Pequegnot, AL Perries, S Popov, A Sabes, D Sordini, V Vander Donckt, M Verdier, P Viret, S Toriashvili, T Tsamalaidze, Z Autermann, C Beranek, S Feld, L Heister, A Kiesel, MK Klein, K Lipinski, M Ostapchuk, A Preuten, M Raupach, F Schael, S Schomakers, C Schulte, JF Schulz, J Verlage, T Weber, H Zhukov, V Brodski, M Dietz-Laursonn, E Duchardt, D Endres, M Erdmann, M Erdweg, S Esch, T Fischer, R Guth, A Hamer, M Hebbeker, T Heidemann, C Hoepfner, K Knutzen, S Merschmeyer, M Meyer, A Millet, P Mukherjee, S Olschewski, M Padeken, K Pook, T Radziej, M Reithler, H Rieger, M Scheuch, F Sonnenschein, L Teyssier, D Thuer, S Cherepanov, V Flugge, G Ahmad, WH Hoehle, F Kargoll, B Kress, T Kunsken, A Lingemann, J Nehrkorn, A Nowack, A Nugent, IM Pistone, C Pooth, O Stahl, A Martin, MA Asawatangtrakuldee, C Beernaert, K Behnke, O Behrens, U Bin Anuar, AA Borras, K Campbell, A Connor, P Contreras-Campana, C Costanza, F Pardos, CD Dolinska, G Eckerlin, G Eckstein, D Eren, E Gallo, E Garcia, JG Geiser, A Gizhko, A Luyando, JMG Gunnellini, P Harb, A Hauk, J Hempel, M Jung, H Kalogeropoulos, A Karacheban, O Kasemann, M Keaveney, J Kieseler, J Kleinwort, C Korol, I Krucker, D Lange, W Lelek, A Leonard, J Lipka, K Lobanov, A Lohmann, W Mankel, R Melzer-Pellmann, IA Meyer, AB Mittag, G Mnich, J Mussgiller, A Ntomari, E Pitzl, D Placakyte, R Raspereza, A Roland, B Sahin, MO Saxena, P Schoerner-Sadenius, T Seitz, C Spannagel, S Stefaniuk, N Trippkewitz, KD Van Onsem, GP Walsh, R Wissing, C Blobel, V Vignali, MC Draeger, AR Dreyer, T Garutti, E Goebel, K Gonzalez, D Haller, J Hoffmann, M Junkes, A Klanner, R Kogler, R Kovalchuk, N Lapsien, T Lenz, T Marchesini, I Marconi, D Meyer, M Niedziela, M Nowatschin, D Ott, J Pantaleo, F Peiffer, T Perieanu, A Poehlsen, J Sander, C Scharf, C Schleper, P Schmidt, A Schumann, S Schwandt, J Stadie, H Steinbruck, G Stober, FM Stover, M Tholen, H Troendle, D Usai, E Vanelderen, L Vanhoefer, A Vormwald, B Barth, C Baus, C Berger, J Butz, E Chwalek, T Colombo, F De Boer, W Dierlamm, A Fink, S Friese, R Giffels, M Gilbert, A Goldenzweig, P Haitz, D Hartmann, F Heindl, SM Husemann, U Katkov, I Pardo, PL Maier, B Mildner, H Mozer, MU Muller, T Muller, T Plagge, M Quast, G Rabbertz, K Rocker, S Roscher, F Schroder, M Shvetsov, I Sieber, G Simonis, HJ Ulrich, R Wagner-Kuhr, J Wayand, S Weber, M Weiler, T Williamson, S Wohrmann, C Wolf, R Anagnostou, G Daskalakis, G Geralis, T Giakoumopoulou, VA Kyriakis, A Loukas, D Topsis-Giotis, I Agapitos, A Kesisoglou, S Panagiotou, A Saoulidou, N Tziaferi, E Evangelou, I Flouris, G Foudas, C Kokkas, P Loukas, N Manthos, N Papadopoulos, I Paradas, E Filipovic, N Bencze, G Hajdu, C Hidas, P Horvath, D Sikler, F Veszpremi, V Vesztergombi, G Zsigmond, AJ Beni, N Czellar, S Karancsi, J Makovec, A Molnar, J Szillasi, Z Bartok, M Raics, P Trocsanyi, ZL Ujvari, B Bahinipati, S Choudhury, S Mal, P Mandal, K Nayak, A Sahoo, DK Sahoo, N Swain, SK Bansal, S Beri, SB Bhatnagar, V Chawla, R Bhawandeep, U Kalsi, AK Kaur, A Kaur, M Kumar, R Mehta, A Mittal, M Singh, JB Walia, G Kumar, A Bhardwaj, A Choudhary, BC Garg, RB Keshri, S Malhotra, S Naimuddin, M Nishu, N Ranjan, K Sharma, R Sharma, V Bhattacharya, R Bhattacharya, S Chatterjee, K Dey, S Dutt, S Dutta, S Ghosh, S Majumdar, N Modak, A Mondal, K Mukhopadhyay, S Nandan, S Purohit, A Roy, A Roy, D Chowdhury, SR Sarkar, S Sharan, M Thakur, S Behera, PK Chudasama, R Dutta, D Jha, V Kumar, V Mohanty, AK Netrakanti, PK Pant, LM Shukla, P Topkar, A Aziz, T Dugad, S Kole, G Mahakud, B Mitra, S Mohanty, GB Parida, B Sur, N Sutar, B Banerjee, S Bhowmik, S Dewanjee, RK Ganguly, S Guchait, M Jain, S Kumar, S Maity, M Majumder, G Mazumdar, K Sarkar, T Wickramage, N Chauhan, S Dube, S Hegde, V Kapoor, A Kothekar, K Rane, A Sharma, S Behnamian, H Chenarani, S Tadavani, EE Etesami, SM Fahim, A Khakzad, M Najafabadi, MM Naseri, M Mehdiabadi, SP Hosseinabadi, FR Safarzadeh, B Zeinali, M Felcini, M Grunewald, M Abbrescia, M Calabria, C Caputo, C Colaleo, A Creanza, D Cristella, L De Filippis, N De Palma, M Fiore, L Iaselli, G Maggi, G Maggi, M Miniello, G My, S Nuzzo, S Pompili, A Pugliese, G Radogna, R Ranieri, A Selvaggi, G Silvestris, L Venditti, R Verwilligen, P Abbiendi, G Battilana, C Bonacorsi, D Braibant-Giacomelli, S Brigliadori, L Campanini, R Capiluppi, P Castro, A Cavallo, FR Chhibra, SS Codispoti, G Cuffiani, M Dallavalle, GM Fabbri, F Fanfani, A Fasanella, D Giacomelli, P Grandi, C Guiducci, L Marcellini, S Masetti, G Montanari, A Navarria, FL Perrotta, A Rossi, AM Rovelli, T Siroli, GP Tosi, N Albergo, S Chiorboli, M Costa, S Di Mattia, A Giordano, F Potenza, R Tricomi, A Tuve, C Barbagli, G Ciulli, V Civinini, C D'Alessandro, R Focardi, E Gori, V Lenzi, P Meschini, M Paoletti, S Sguazzoni, G Viliani, L Benussi, L Bianco, S Fabbri, F Piccolo, D Primavera, F Calvelli, V Ferro, F Lo Vetere, M Monge, MR Robutti, E Tosi, S Brianza, L Dinardo, ME Fiorendi, S Gennai, S Ghezzi, A Govoni, P Malvezzi, S Manzoni, RA Marzocchi, B Menasce, D Moroni, L Paganoni, M Pedrini, D Pigazzini, S Ragazzi, S de Fatis, TT Buontempo, S Cavallo, N De Nardo, G Di Guida, S Esposito, M Fabozzi, F Iorio, AOM Lanza, G Lista, L Meola, S Paolucci, P Sciacca, C Thyssen, F Azzi, P Bacchetta, N Benato, L Bisello, D Boletti, A Carlin, R De Oliveira, ACA Checchia, P Dall'Osso, M Manzano, PD Dorigo, T Dosselli, U Gasparini, F Gasparini, U Gozzelino, A Lacaprara, S Margoni, M Meneguzzo, AT Pazzini, J Pozzobon, N Ronchese, P Simonetto, F Torassa, E Zanetti, M Zotto, P Zucchetta, A Zumerle, G Braghieri, A Magnani, A Montagna, P Ratti, SP Re, V Riccardi, C Salvini, P Vai, I Vitulo, P Solestizi, LA Bilei, GM Ciangottini, D Fano, L Lariccia, P Leonardi, R Mantovani, G Menichelli, M Saha, A Santocchia, A Androsov, K Azzurri, P Bagliesi, G Bernardini, J Boccali, T Castaldi, R Ciocci, MA Dell'Orso, R Donato, S Fedi, G Giassi, A Grippo, MT Ligabue, F Lomtadze, T Martini, L Messineo, A Palla, F Rizzi, A Savoy-Navarro, A Spagnolo, P Tenchini, R Tonelli, G Venturi, A Verdini, PG Barone, L Cavallari, F Cipriani, M D'imperio, G Del Re, D Diemoz, M Gelli, S Jorda, C Longo, E Margaroli, F Meridiani, P Organtini, G Paramatti, R Preiato, F Rahatlou, S Rovelli, C Santanastasio, F Amapane, N Arcidiacono, R Argiro, S Arneodo, M Bartosik, N Bellan, R Biino, C Cartiglia, N Cenna, F Costa, M Covarelli, R Degano, A Demaria, N Finco, L Kiani, B Mariotti, C Maselli, S Migliore, E Monaco, V Monteil, E Obertino, MM Pacher, L Pastrone, N Pelliccioni, M Angioni, GLP Ravera, F Romero, A Ruspa, M Sacchi, R Shchelina, K Sola, V Solano, A Staiano, A Traczyk, P Belforte, S Casarsa, M Cossutti, F Della Ricca, G La Licata, C Schizzi, A Zanetti, A Kim, DH Kim, GN Kim, MS Lee, S Lee, SW Oh, YD Sekmen, S Son, DC Yang, YC Lee, A Cifuentes, JAB Kim, TJ Cho, S Choi, S Go, Y Gyun, D Ha, S Hong, B Jo, Y Kim, Y Lee, B Lee, K Lee, KS Lee, S Lim, J Park, SK Roh, Y Almond, J Kim, J Oh, SB Seo, SH Yang, UK Yoo, HD Yu, GB Choi, M Kim, H Kim, H Kim, JH Lee, JSH Park, IC Ryu, G Ryu, MS Choi, Y Goh, J Hwang, C Lee, J Yu, I Dudenas, V Juodagalvis, A Vaitkus, J Ahmed, I Ibrahim, ZA Komaragiri, JR Ali, MABM Idris, FM Abdullah, WATW Yusli, MN Zolkapli, Z Castilla-Valdez, H De La Cruz-Burelo, E Heredia-De La Cruz, I Hernandez-Almada, A Lopez-Fernandez, R Villalba, RM Guisao, JM Sanchez-Hernandez, A Moreno, SC Barrera, CO Valencia, FV Carpinteyro, S Pedraza, I Ibarguen, HAS Estrada, CU Pineda, AM Krofcheck, D Butler, PH Ahmad, A Ahmad, M Hassan, Q Hoorani, HR Khan, WA Shah, MA Shoaib, M Waqas, M Bialkowska, H Bluj, M Boimska, B Frueboes, T Gorski, M Kazana, M Nawrocki, K Romanowska-Rybinska, K Szleper, M Zalewski, P Bunkowski, K Byszuk, A Doroba, K Kalinowski, A Konecki, M Krolikowski, J Misiura, M Olszewski, M Walczak, M Bargassa, P Silva, CBDE Di Francesco, A Faccioli, P Parracho, PGF Gallinaro, M Hollar, J Leonardo, N Iglesias, LL Nemallapudi, MV 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CA CMS Collaboration TI Measurement of the ZZ production cross section and Z -> l(+)l(-)l '(+)l '(-) branching fraction in pp collisions at root s=13TeV SO PHYSICS LETTERS B LA English DT Article DE CMS; Physics; Electroweak ID NNLO QCD; LHC AB Four-lepton production in proton-proton collisions, pp -> (Z/gamma*)(Z/gamma*)-> l(+)l(-)l '(+)l '(-), where l,l '(-) = e or mu, is studied at a center-of-mass energy of 13 TeV with the CMS detector at the LHC. The data sample corresponds to an integrated luminosity of 2.6fb(-1). The ZZ production cross section, sigma(pp -> ZZ) = 14.6(-1.8)(+1.9)(stat)(-0.3)(+0.5) (syst) +/-0.2 (theo) +/-0.4 (lumi) pb, is measured for events with two opposite-sign, sameflavor lepton pairs produced in the mass region 60 < m(l+l-) m (l'+l'-) < 120GeV. The Z boson branching fraction to four leptons is measured to be B(Z -> l(+)l(-)l '(+)l '(-)) = 4.9(-0.7)(+0.8)(stat)(-0.2)(+0.3)(syst)(-0.1)(+0.2)(theo) +/- 0.1 (lumi) x10(-6) for the four-lepton invariant mass in the range 80 < m(l+)l-l'+l' < 100GeVand dilepton mass m(l+l-) > 4GeVfor all opposite-sign, same-flavor lepton pairs. The results are in agreement with standard model predictions. (C) 2016 The Author. Published by Elsevier B. V. This is an open access article under the CC BY license C1 [Khachatryan, V.; Sirunyan, A. M.; Tumasyan, A.] Yerevan Phys Inst, Yerevan, Armenia. [Adam, W.; Asilar, E.; Bergauer, T.; Brandstetter, J.; Brondolin, E.; Dragicevic, M.; Eroe, J.; Flechl, M.; Friedl, M.; Fruehwirth, R.; Ghete, V. 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C.; Chanon, N.; Collard, C.; Conte, E.; Coubez, X.; Fontaine, J. -C.; Gele, D.; Goerlach, U.; Le Bihan, A. -C.; Merlin, J. A.; Skovpen, K.; Van Hove, P.] Univ Haute Alsace Mulhouse, Univ Strasbourg, Inst Pluridisciplinaire Hubert Curien, CNRS,IN2P3, Strasbourg, France. [Gadrat, S.] CNRS, Ctr Calcul, IN2P3, Villeurbanne, France. [Beauceron, S.; Bernet, C.; Boudoul, G.; Bouvier, E.; Montoya, C. A. Carrillo; Chierici, R.; Contardo, D.; Courbon, B.; Depasse, P.; El Mamouni, H.; Fan, J.; Fay, J.; Gascon, S.; Gouzevitch, M.; Grenier, G.; Ille, B.; Lagarde, F.; Laktineh, I. B.; Lethuillier, M.; Mirabito, L.; Pequegnot, A. L.; Perries, S.; Popov, A.; Sabes, D.; Sordini, V.; Vander Donckt, M.; Verdier, P.; Viret, S.] Univ Lyon 1, CNRS, Inst Phys Nucl Lyon, IN2P3, Villeurbanne, France. [Toriashvili, T.] Georgian Tech Univ, Tbilisi, Rep of Georgia. [Tsamalaidze, Z.] Tbilisi State Univ, Tbilisi, Rep of Georgia. [Autermann, C.; Beranek, S.; Feld, L.; Heister, A.; Kiesel, M. K.; Klein, K.; Lipinski, M.; Ostapchuk, A.; Preuten, M.; Raupach, F.; Schael, S.; Schomakers, C.; Schulte, J. F.; Schulz, J.; Verlage, T.; Weber, H.; Zhukov, V.] Rhein Westfal TH Aachen, Inst Phys 1, Aachen, Germany. [Brodski, M.; Dietz-Laursonn, E.; Duchardt, D.; Endres, M.; Erdmann, M.; Erdweg, S.; Esch, T.; Fischer, R.; Gueth, A.; Hamer, M.; Hebbeker, T.; Heidemann, C.; Hoepfner, K.; Knutzen, S.; Merschmeyer, M.; Meyer, A.; Millet, P.; Mukherjee, S.; Olschewski, M.; Padeken, K.; Pook, T.; Radziej, M.; Reithler, H.; Rieger, M.; Scheuch, F.; Sonnenschein, L.; Teyssier, D.; Thueer, S.; Erdmann, W.] Rhein Westfal TH Aachen, Phys Inst A3, Aachen, Germany. [Cherepanov, V.; Fluegge, G.; Ahmad, W. Haj; Hoehle, F.; Kargoll, B.; Kress, T.; Kuensken, A.; Lingemann, J.; Nehrkorn, A.; Nowack, A.; Nugent, I. M.; Pistone, C.; Pooth, O.; Stahl, A.] Rhein Westfal TH Aachen, Phys Inst B3, Aachen, Germany. [Martin, M. Aldaya; Asawatangtrakuldee, C.; Beernaert, K.; Behnke, O.; Behrens, U.; Bin Anuar, A. A.; Borras, K.; Campbell, A.; Connor, P.; Contreras-Campana, C.; Costanza, F.; Pardos, C. Diez; Dolinska, G.; Eckerlin, G.; Eckstein, D.; Eren, E.; Gallo, E.; Garcia, J. Garay; Geiser, A.; Gizhko, A.; Luyando, J. M. Grados; Gunnellini, P.; Harb, A.; Hauk, J.; Hempel, M.; Jung, H.; Kalogeropoulos, A.; Karacheban, O.; Kasemann, M.; Keaveney, J.; Kieseler, J.; Kleinwort, C.; Korol, I.; Kruecker, D.; Lange, W.; Lelek, A.; Leonard, J.; Lipka, K.; Lobanov, A.; Lohmann, W.; Mankel, R.; Melzer-Pellmann, I. -A.; Meyer, A. B.; Mittag, G.; Mnich, J.; Mussgiller, A.; Ntomari, E.; Pitzl, D.; Placakyte, R.; Raspereza, A.; Roland, B.; Sahin, M. Oe.; Saxena, P.; Schoerner-Sadenius, T.; Seitz, C.; Spannagel, S.; Stefaniuk, N.; Trippkewitz, K. D.; Van Onsem, G. P.; Walsh, R.; Wissing, C.] DESY, Hamburg, Germany. [Blobel, V.; Vignali, M. Centis; Draeger, A. R.; Dreyer, T.; Garutti, E.; Goebel, K.; Gonzalez, D.; Haller, J.; Hoffmann, M.; Junkes, A.; Klanner, R.; Kogler, R.; Kovalchuk, N.; Lapsien, T.; Lenz, T.; Marchesini, I.; Marconi, D.; Meyer, M.; Niedziela, M.; Nowatschin, D.; Ott, J.; Pantaleo, F.; Peiffer, T.; Perieanu, A.; Poehlsen, J.; Sander, C.; Scharf, C.; Schleper, P.; Schmidt, A.; Schumann, S.; Schwandt, J.; Stadie, H.; Steinbrueck, G.; Stober, F. M.; Stoever, M.; Tholen, H.; Troendle, D.; Usai, E.; Vanelderen, L.; Vanhoefer, A.; Vormwald, B.] Univ Hamburg, Hamburg, Germany. [Barth, C.; Baus, C.; Berger, J.; Butz, E.; Chwalek, T.; Colombo, F.; De Boer, W.; Dierlamm, A.; Fink, S.; Friese, R.; Giffels, M.; Gilbert, A.; Goldenzweig, P.; Haitz, D.; Hartmann, F.; Heindl, S. M.; Husemann, U.; Katkov, I.; Pardo, P. Lobelle; Maier, B.; Mildner, H.; Mozer, M. U.; Mueller, T.; Mueller, Th.; Plagge, M.; Quast, G.; Rabbertz, K.; Roecker, S.; Roscher, F.; Schroeder, M.; Shvetsov, I.; Sieber, G.; Simonis, H. J.; Ulrich, R.; Wagner-Kuhr, J.; Wayand, S.; Weber, M.; Weiler, T.; Williamson, S.; Woehrmann, C.; Wolf, R.] Inst Expt Kernphys, Karlsruhe, Germany. [Anagnostou, G.; Daskalakis, G.; Geralis, T.; Giakoumopoulou, V. A.; Kyriakis, A.; Loukas, D.; Topsis-Giotis, I.] NCSR Demokritos, INPP, Aghia Paraskevi, Greece. [Agapitos, A.; Kesisoglou, S.; Panagiotou, A.; Saoulidou, N.; Tziaferi, E.] Univ Athens, Athens, Greece. [Evangelou, I.; Flouris, G.; Foudas, C.; Kokkas, P.; Loukas, N.; Manthos, N.; Papadopoulos, I.; Paradas, E.] Univ Ioannina, Ioannina, Greece. [Filipovic, N.] Eotvos Lorand Univ, MTA ELTE Lendulet CMS Particle & Nucl Phys Grp, Budapest, Hungary. [Bencze, G.; Hajdu, C.; Hidas, P.; Horvath, D.; Sikler, F.; Veszpremi, V.; Vesztergombi, G.; Zsigmond, A. J.] Wigner Res Ctr Phys, Budapest, Hungary. [Beni, N.; Czellar, S.; Karancsi, J.; Makovec, A.; Molnar, J.; Szillasi, Z.] Inst Nucl Res ATOMKI, Debrecen, Hungary. [Bartok, M.; Raics, P.; Trocsanyi, Z. L.; Ujvari, B.] Univ Debrecen, Debrecen, Hungary. [Bahinipati, S.; Choudhury, S.; Mal, P.; Mandal, K.; Nayak, A.; Sahoo, D. K.; Sahoo, N.; Swain, S. K.] Natl Inst Sci Educ & Res, Bhubaneswar, Orissa, India. [Bansal, S.; Beri, S. B.; Bhatnagar, V.; Chawla, R.; Bhawandeep, U.; Kalsi, A. K.; Kaur, A.; Kaur, M.; Kumar, R.; Mehta, A.; Mittal, M.; Singh, J. B.; Walia, G.] Panjab Univ, Chandigarh, India. [Kumar, Ashok; Bhardwaj, A.; Choudhary, B. C.; Garg, R. B.; Keshri, S.; Malhotra, S.; Naimuddin, M.; Nishu, N.; Ranjan, K.; Sharma, R.; Sharma, V.] Univ Delhi, Delhi, India. [Ghosh, S.; Bhattacharya, R.; Bhattacharya, S.; Chatterjee, K.; Dey, S.; Dutt, S.; Dutta, S.; Majumdar, N.; Modak, A.; Mondal, K.; Mukhopadhyay, S.; Nandan, S.; Purohit, A.; Roy, A.; Roy, D.; Chowdhury, S. Roy; Sarkar, S.; Sharan, M.; Thakur, S.] Saha Inst Nucl Phys, Kolkata, India. [Behera, P. K.] Indian Inst Technol Madras, Madras, Tamil Nadu, India. [Chudasama, R.; Dutta, D.; Jha, V.; Kumar, V.; Mohanty, A. K.; Netrakanti, P. K.; Pant, L. M.; Shukla, P.; Topkar, A.] Bhabha Atom Res Ctr, Mumbai, Maharashtra, India. [Aziz, T.; Dugad, S.; Kole, G.; Mahakud, B.; Mitra, S.; Mohanty, G. B.; Parida, B.; Sur, N.; Sutar, B.] Tata Inst Fundamental Res A, Mumbai, Maharashtra, India. [Banerjee, S.; Bhowmik, S.; Dewanjee, R. K.; Ganguly, S.; Guchait, M.; Jain, Sa.; Kumar, S.; Maity, M.; Majumder, G.; Mazumdar, K.; Sarkar, T.; Wickramage, N.] Tata Inst Fundamental Res B, Mumbai, Maharashtra, India. [Chauhan, S.; Dube, S.; Hegde, V.; Kapoor, A.; Kothekar, K.; Rane, A.; Sharma, S.] Indian Inst Sci Educ & Res, Pune, Maharashtra, India. [Behnamian, H.; Chenarani, S.; Tadavani, E. Eskandari; Etesami, S. M.; Fahim, A.; Khakzad, M.; Najafabadi, M. Mohammadi; Naseri, M.; Mehdiabadi, S. Paktinat; Hosseinabadi, F. Rezaei; Safarzadeh, B.; Zeinali, M.] Inst Res Fundamental Sci IPM, Tehran, Iran. [Felcini, M.; Grunewald, M.] Univ Coll Dublin, Dublin, Ireland. [Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iaselli, G.; Maggi, G.; Maggi, M.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Silvestris, L.; Venditti, R.; Verwilligen, P.] Ist Nazl Fis Nucl, Sez Bari, Bari, Italy. [Abbrescia, M.; Calabria, C.; Caputo, C.; Cristella, L.; De Palma, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Radogna, R.; Selvaggi, G.; Venditti, R.] Univ Bari, Bari, Italy. [Creanza, D.; De Filippis, N.; Iaselli, G.; Maggi, G.; Pugliese, G.] Politecn Bari, Bari, Italy. [Abbiendi, G.; Battilana, C.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Ist Nazl Fis Nucl, Sez Bologna, Bologna, Italy. [Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Fanfani, A.; Fasanella, D.; Guiducci, L.; Navarria, F. L.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Univ Bologna, Bologna, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Ist Nazl Fis Nucl, Sez Catania, Catania, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Univ Catania, Catania, Italy. [Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Meschini, M.; Paoletti, S.; Sguazzoni, G.; Viliani, L.] Ist Nazl Fis Nucl, Sez Firenze, Florence, Italy. [Ciulli, V.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Viliani, L.] Univ Firenze, Florence, Italy. [Fabbri, F.; Benussi, L.; Bianco, S.; Piccolo, D.; Primavera, F.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Calvelli, V.; Ferro, F.; Lo Vetere, M.; Monge, M. R.; Robutti, E.; Tosi, S.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Calvelli, V.; Lo Vetere, M.; Monge, M. R.; Tosi, S.] Univ Genoa, Genoa, Italy. [Brianza, L.; Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Ghezzi, A.; Govoni, P.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Pigazzini, S.; Ragazzi, S.; de Fatis, T. Tabarelli] Ist Nazl Fis Nucl, Sez Milano Bicocca, Milan, Italy. [Dinardo, M. E.; Fiorendi, S.; Ghezzi, A.; Govoni, P.; Manzoni, R. A.; Marzocchi, B.; Paganoni, M.; Ragazzi, S.; de Fatis, T. Tabarelli] Univ Milano Bicocca, Milan, Italy. [Buontempo, S.; Cavallo, N.; De Nardo, G.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Paolucci, P.; Sciacca, C.; Thyssen, F.] Ist Nazl Fis Nucl, Sez Napoli, Naples, Italy. [Esposito, M.; Iorio, A. O. M.; Sciacca, C.] Univ Napoli Federico II, Naples, Italy. [Cavallo, N.; Fabozzi, F.] Univ Basilicata, Potenza, Italy. [Di Guida, S.; Meola, S.] Univ G Marconi, Rome, Italy. [Azzi, P.; Bacchetta, N.; Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; De Oliveira, A. Carvalho Antunes; Checchia, P.; Dall'Osso, M.; Manzano, P. De Castro; Dorigo, T.; Dosselli, U.; Gasparini, F.; Gasparini, U.; Gozzelino, A.; Lacaprara, S.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Torassa, E.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Ist Nazl Fis Nucl, Sez Padova, Padua, Italy. [Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; De Oliveira, A. Carvalho Antunes; Dall'Osso, M.; Gasparini, F.; Gasparini, U.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Univ Padua, Padua, Italy. Univ Trento, Trento, Italy. [Braghieri, A.; Magnani, A.; Montagna, P.; Ratti, S. P.; Re, V.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Univ Pavia, Pavia, Italy. [Solestizi, L. Alunni; Bilei, G. M.; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Menichelli, M.; Saha, A.; Santocchia, A.] Ist Nazl Fis Nucl, Sez Perugia, Perugia, Italy. [Solestizi, L. Alunni; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Santocchia, A.] Univ Perugia, Perugia, Italy. [Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Donato, S.; Fedi, G.; Giassi, A.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Tonelli, G.] Univ Pisa, Pisa, Italy. [Donato, S.; Ligabue, F.] Scuola Normale Super Pisa, Pisa, Italy. [Barone, L.; Cavallari, F.; Cipriani, M.; D'imperio, G.; Del Re, D.; Diemoz, M.; Gelli, S.; Jorda, C.; Longo, E.; Margaroli, F.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Barone, L.; Cipriani, M.; D'imperio, G.; Del Re, D.; Gelli, S.; Longo, E.; Margaroli, F.; Organtini, G.; Preiato, F.; Rahatlou, S.; Santanastasio, F.] Univ Roma, Rome, Italy. [Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bartosik, N.; Bellan, R.; Biino, C.; Cartiglia, N.; Cenna, F.; Costa, M.; Covarelli, R.; Degano, A.; Demaria, N.; Finco, L.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Shchelina, K.; Sola, V.; Solano, A.; Staiano, A.; Traczyk, P.] Ist Nazl Fis Nucl, Sez Torino, Turin, Italy. [Amapane, N.; Argiro, S.; Bellan, R.; Cenna, F.; Costa, M.; Covarelli, R.; Degano, A.; Finco, L.; Kiani, B.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Sacchi, R.; Shchelina, K.; Solano, A.; Traczyk, P.] Univ Turin, Turin, Italy. [Arcidiacono, R.; Arneodo, M.; Ruspa, M.] Univ Piemonte Orientale, Novara, Italy. [Belforte, S.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; La Licata, C.; Schizzi, A.; Zanetti, A.] Ist Nazl Fis Nucl, Sez Trieste, Trieste, Italy. [Della Ricca, G.; La Licata, C.; Schizzi, A.] Univ Trieste, Trieste, Italy. [Kim, D. H.; Kim, G. N.; Kim, M. S.; Lee, S.; Lee, S. W.; Oh, Y. D.; Sekmen, S.; Son, D. C.; Yang, Y. C.] Kyungpook Natl Univ, Daegu, South Korea. [Lee, A.] Chonbuk Natl Univ, Jeonju, South Korea. [Cifuentes, J. A. Brochero; Kim, T. J.] Hanyang Univ, Seoul, South Korea. [Lee, S.; Cho, S.; Choi, S.; Go, Y.; Gyun, D.; Ha, S.; Hong, B.; Jo, Y.; Kim, Y.; Lee, B.; Lee, K.; Lee, K. S.; Lim, J.; Park, S. K.; Roh, Y.] Korea Univ, Seoul, South Korea. [Almond, J.; Kim, J.; Oh, S. B.; Seo, S. H.; Yang, U. K.; Yoo, H. D.; Yu, G. B.] Seoul Natl Univ, Seoul, South Korea. [Choi, M.; Kim, H.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.] Univ Seoul, Seoul, South Korea. [Choi, Y.; Goh, J.; Hwang, C.; Lee, J.; Yu, I.] Sungkyunkwan Univ, Suwon, South Korea. [Dudenas, V.; Juodagalvis, A.; Vaitkus, J.] Vilnius Univ, Vilnius, Lithuania. [Ahmed, I.; Ibrahim, Z. A.; Komaragiri, J. R.; Ali, M. A. B. Md; Idris, F. Mohamad; Abdullah, W. A. T. Wan; Yusli, M. N.; Zolkapli, Z.] Univ Malaya, Natl Ctr Particle Phys, Kuala Lumpur, Malaysia. [Castilla-Valdez, H.; De La Cruz-Burelo, E.; Heredia-De La Cruz, I.; Hernandez-Almada, A.; Lopez-Fernandez, R.; Magana Villalba, R.; Mejia Guisao, J.; Sanchez-Hernandez, A.] IPN, Ctr Invest & Estudios Avanzados, Mexico City, DF, Mexico. [Carrillo Moreno, S.; Oropeza Barrera, C.; Vazquez Valencia, F.] Univ Iberoamer, Mexico City, DF, Mexico. [Carpinteyro, S.; Pedraza, I.; Salazar Ibarguen, H. A.; Uribe Estrada, C.] Benemerita Univ Autonoma Puebla, Puebla, Mexico. [Morelos Pineda, A.] Univ Autonoma San Luis Potosi, San Luis Potosi, Mexico. [Krofcheck, D.] Univ Auckland, Auckland, New Zealand. [Butler, P. H.] Univ Canterbury, Christchurch, New Zealand. [Ahmad, M.; Ahmad, A.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Shah, M. A.; Shoaib, M.; Waqas, M.] Quaid I Azam Univ, Natl Ctr Phys, Islamabad, Pakistan. [Bialkowska, H.; Bluj, M.; Boimska, B.; Frueboes, T.; Gorski, M.; Kazana, M.; Nawrocki, K.; Romanowska-Rybinska, K.; Szleper, M.; Zalewski, P.] Natl Ctr Nucl Res, Otwock, Poland. [Bunkowski, K.; Byszuk, A.; Doroba, K.; Kalinowski, A.; Konecki, M.; Krolikowski, J.; Misiura, M.; Olszewski, M.; Walczak, M.] Univ Warsaw, Inst Expt Phys, Fac Phys, Warsaw, Poland. [Bargassa, P.; Beirao Da Cruz E Silva, C.; Di Francesco, A.; Faccioli, P.; Ferreira Parracho, P. G.; Gallinaro, M.; Hollar, J.; Leonardo, N.; Lloret Iglesias, L.; Nemallapudi, M. V.; Rodrigues Antunes, J.; Seixas, J.; Toldaiev, O.; Vadruccio, D.; Varela, J.; Vischia, P.] Lab Instrumentacao & Fis Expt Particulas, Lisbon, Portugal. [Afanasiev, S.; Bunin, P.; Gavrilenko, M.; Golutvin, I.; Gorbunov, I.; Kamenev, A.; Karjavin, V.; Lanev, A.; Malakhov, A.; Matveev, V.; Moisenz, P.; Palichik, V.; Perelygin, V.; Shmatov, S.; Shulha, S.; Skatchkov, N.; Smirnov, V.; Voytishin, N.; Zarubin, A.] Joint Inst Nucl Res, Dubna, Russia. [Chtchipounov, L.; Golovtsov, V.; Ivanov, Y.; Kim, V.; Kuznetsova, E.; Murzin, V.; Oreshkin, V.; Sulimov, V.; Vorobyev, A.] Petersburg Nucl Phys Inst, St Petersburg, Russia. [Andreev, Yu.; Dermenev, A.; Gninenko, S.; Golubev, N.; Karneyeu, A.; Kirsanov, M.; Krasnikov, N.; Pashenkov, A.; Tlisov, D.; Toropin, A.] Inst Nucl Res, Moscow, Russia. [Epshteyn, V.; Gavrilov, V.; Lychkovskaya, N.; Popov, V.; Pozdnyakov, I.; Safronov, G.; Spiridonov, A.; Toms, M.; Vlasov, E.; Zhokin, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Bylinkin, A.] Moscow Inst Phys & Technol, Moscow, Russia. [Chadeeva, M.; Popova, E.; Tarkovskii, E.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Andreev, V.; Azarkin, M.; Dremin, I.; Kirakosyan, M.; Leonidov, A.; Rusakov, S. V.; Terkulov, A.] PN Lebedev Phys Inst, Moscow, Russia. [Baskakov, A.; Belyaev, A.; Boos, E.; Dubinin, M.; Dudko, L.; Ershov, A.; Gribushin, A.; Klyukhin, V.; Kodolova, O.; Lokhtin, I.; Miagkov, I.; Obraztsov, S.; Petrushanko, S.; Savrin, V.; Snigirev, A.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Blinov, V.; Skovpen, Y.] Novosibirsk State Univ, Novosibirsk, Russia. [Azhgirey, I.; Bayshev, I.; Bitioukov, S.; Elumakhov, D.; Kachanov, V.; Kalinin, A.; Konstantinov, D.; Krychkine, V.; Petrov, V.; Ryutin, R.; Sobol, A.; Troshin, S.; Tyurin, N.; Uzunian, A.; Volkov, A.] State Res Ctr Russian Federat, Inst High Energy Phys, Protvino, Russia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Dordevic, M.; Milosevic, J.; Milosevic, V.; Rekovic, V.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Dordevic, M.; Milosevic, J.; Milosevic, V.; Rekovic, V.] Vinca Inst Nucl Sci, Belgrade, Serbia. [Maestre, J. Alcaraz; BarrioLuna, M.; Calvo, E.; Cerrada, M.; Llatas, M. Chamizo; Colino, N.; De La Cruz, B.; Peris, A. Delgado; Del Valle, A. Escalante; Bedoya, C. Fernandez; Ramos, J. P. Fernandez; Flix, J.; Fouz, M. C.; Garcia-Abia, P.; Lopez, O. Gonzalez; Lopez, S. Goy; Hernandez, J. M.; Josa, M. I.; De Martino, E. Navarro; Yzquierdo, A. Perez-Calero; Pelayo, J. Puerta; Olmeda, A. Quintario; Redondo, I.; Romero, L.; Soares, M. S.] CIEMAT, Madrid, Spain. [de Troconiz, J. F.; Missiroli, M.; Moran, D.] Univ Autonoma Madrid, Madrid, Spain. [Cuevas, J.; Menendez, J. Fernandez; Caballero, I. Gonzalez; Fernandez, J. R. Gonzalez; Cortezon, E. Palencia; Cruz, S. Sanchez; Andres, I. Suarez; Garcia, J. M. Vizan] Univ Oviedo, Oviedo, Spain. [Cabrillo, I. J.; Calderon, A.; De Saa, J. R. Castineiras; Curras, E.; Fernandez, M.; Garcia-Ferrero, J.; Gomez, G.; Virto, A. Lopez; Marco, J.; Rivero, C. Martinez; Matorras, F.; Gomez, J. Piedra; Rodrigo, T.; Ruiz-Jimeno, A.; Scodellaro, L.; Trevisani, N.; Vila, I.; Cortabitarte, R. Vilar] Univ Cantabria, CSIC, Inst Fis Cantabria IFCA, Santander, Spain. [Abbaneo, D.; Auffray, E.; Auzinger, G.; Bachtis, M.; Baillon, P.; Ball, A. H.; Barney, D.; Bloch, P.; Bocci, A.; Bonato, A.; Botta, C.; Camporesi, T.; Castello, R.; Cepeda, M.; Cerminara, G.; D'Alfonso, M.; d'Enterria, D.; Dabrowski, A.; Daponte, V.; David, A.; De Gruttola, M.; De Guio, F.; De Roeck, A.; Di Marco, E.; Dobson, M.; Dorney, B.; du Pree, T.; Duggan, D.; Dunser, M.; Dupont, N.; Elliott-Peisert, A.; Fartoukh, S.; Franzoni, G.; Fulcher, J.; Funk, W.; Gigi, D.; Gill, K.; Girone, M.; Glege, F.; Gulhan, D.; Gundacker, S.; Guthoff, M.; Hammer, J.; Harris, P.; Hegeman, J.; Innocente, V.; Janot, P.; Kirschenmann, H.; Knunz, V.; Kornmayer, A.; Kortelainen, M. J.; Kousouris, K.; Krammer, M.; Lecoq, P.; Lourenco, C.; Lucchini, M. T.; Malgeri, L.; Mannelli, M.; Martelli, A.; Meijers, F.; Mersi, S.; Meschi, E.; Moortgat, F.; Morovic, S.; Mulders, M.; Neugebauer, H.; Orfanelli, S.; Orsini, L.; Pape, L.; Perez, E.; Peruzzi, M.; Petrilli, A.; Petrucciani, G.; Pfeiffer, A.; Pierini, M.; Racz, A.; Reis, T.; Rolandi, G.; Rovere, M.; Ruan, M.; Sakulin, H.; Sauvan, J. B.; Schafer, C.; Schwick, C.; Seidel, M.; Sharma, A.; Silva, P.; Simon, M.; Sphicas, P.; Steggemann, J.; Stoye, M.; Takahashi, Y.; Tosi, M.; Treille, D.; Triossi, A.; Tsirou, A.; Veckalns, V.; Veres, G. I.; Wardle, N.; Zagozdzinska, A.; Zeuner, W. D.] CERN, European Org Nucl Res, Geneva, Switzerland. [Bertl, W.; Deiters, K.; Erdmann, W.; Horisberger, R.; Ingram, Q.; Kaestli, H. C.; Kotlinski, D.; Langenegger, U.; Rohe, T.] Paul Scherrer Inst, Villigen, Switzerland. [Bachmair, F.; Bani, L.; Bianchini, L.; Casal, B.; Dissertori, G.; Dittmar, M.; Donega, M.; Eller, P.; Grab, C.; Heidegger, C.; Hits, D.; Hoss, J.; Kasieczka, G.; Lecomte, P.; Lustermann, W.; Mangano, B.; Marionneau, M.; del Arbol, P. Martinez Ruiz; Masciovecchio, M.; Meinhard, M. T.; Meister, D.; Micheli, F.; Musella, P.; Nessi-Tedaldi, F.; Pandolfi, F.; Pata, J.; Pauss, F.; Perrin, G.; Perrozzi, L.; Quittnat, M.; Rossini, M.; Schonenberger, M.; Starodumov, A.; Tavolaro, V. R.; Theofilatos, K.; Wallny, R.] Swiss Fed Inst Technol, Inst Particle Phys, Zurich, Switzerland. [Aarrestad, T. K.; Amsler, C.; Caminada, L.; Canelli, M. F.; De Cosa, A.; Galloni, C.; Hinzmann, A.; Hreus, T.; Kilminster, B.; Lange, C.; Ngadiuba, J.; Pinna, D.; Rauco, G.; Robmann, P.; Salerno, D.; Yang, Y.] Univ Zurich, Zurich, Switzerland. [Candelise, V.; Doan, T. H.; Jain, Sh.; Khurana, R.; Konyushikhin, M.; Kuo, C. M.; Lin, W.; Lu, Y. J.; Pozdnyakov, A.; Yu, S. S.] Natl Cent Univ, Chungli, Taiwan. [Kumar, Arun; Chang, P.; Chang, Y. H.; Chang, Y. W.; Chao, Y.; Chen, K. F.; Chen, P. H.; Dietz, C.; Fiori, F.; Hou, W. -S.; Hsiung, Y.; Liu, Y. F.; Lu, R. -S.; Moya, M. Minano; Paganis, E.; Psallidas, A.; Tsai, J. F.; Tzeng, Y. M.] Natl Taiwan Univ, Taipei, Taiwan. [Asavapibhop, B.; Singh, G.; Srimanobhas, N.; Suwonjandee, N.] Chulalongkorn Univ, Dept Phys, Fac Sci, Bangkok, Thailand. [Adiguzel, A.; Cerci, S.; Damarseckin, S.; Demiroglu, Z. S.; Dozen, C.; Dumanoglu, I.; Girgis, S.; Gokbulut, G.; Guler, Y.; Gurpinar, E.; Hos, I.; Kangal, E. E.; Kara, O.; Kiminsu, U.; Oglakci, M.; Onengut, G.; Ozdemir, K.; SunarCerci, D.; Tali, B.; Topakli, H.; Turkcapar, S.; Zorbakir, I. S.; Zorbilmez, C.] Cukurova Univ, Adana, Turkey. [Bilin, B.; Bilmis, S.; Isildak, B.; Karapinar, G.; Yalvac, M.; Zeyrek, M.] Middle East Tech Univ, Dept Phys, Ankara, Turkey. [Gulmez, E.; Kaya, M.; Kaya, O.; Yetkin, E. A.; Yetkin, T.] Bogazici Univ, Istanbul, Turkey. [Cakir, A.; Cankocak, K.; Sen, S.] Istanbul Tech Univ, Istanbul, Turkey. [Grynyov, B.] Natl Acad Sci Ukraine, Inst Scintillat Mat, Kharkov, Ukraine. [Levchuk, L.; Sorokin, P.] Kharkov Inst Phys & Technol, Natl Sci Ctr, Kharkov, Ukraine. [Aggleton, R.; Ball, F.; Beck, L.; Brooke, J. J.; Burns, D.; Clement, E.; Cussans, D.; Flacher, H.; Goldstein, J.; Grimes, M.; Heath, G. P.; Heath, H. F.; Jacob, J.; Kreczko, L.; Lucas, C.; Newbold, D. M.; Paramesvaran, S.; Poll, A.; Sakuma, T.; El Nasr-Storey, S. Seif; Smith, D.; Smith, V. J.] Univ Bristol, Bristol, Avon, England. [Belyaev, A.; Bell, K. W.; Brew, C.; Brown, R. M.; Calligaris, L.; Cieri, D.; Cockerill, D. J. A.; Coughlan, J. A.; Harder, K.; Harper, S.; Olaiya, E.; Petyt, D.; Shepherd-Themistocleous, C. H.; Thea, A.; Tomalin, I. R.; Williams, T.] Rutherford Appleton Lab, Didcot, Oxon, England. [Baber, M.; Bainbridge, R.; Buchmuller, O.; Bundock, A.; Burton, D.; Casasso, S.; Citron, M.; Colling, D.; Corpe, L.; Dauncey, P.; Davies, G.; De Wit, A.; Della Negra, M.; Di Maria, R.; Dunne, P.; Elwood, A.; Futyan, D.; Haddad, Y.; Hall, G.; Iles, G.; James, T.; Lane, R.; Laner, C.; Lucas, R.; Lyons, L.; Magnan, A. -M.; Malik, S.; Mastrolorenzo, L.; Nash, J.; Nikitenko, A.; Pela, J.; Penning, B.; Pesaresi, M.; Raymond, D. M.; Richards, A.; Rose, A.; Seez, C.; Summers, S.; Tapper, A.; Uchida, K.; Acosta, M. Vazquez; Virdee, T.; Wright, J.; Zenz, S. C.] Imperial Coll, London, England. [Cole, J. E.; Hobson, P. R.; Khan, A.; Kyberd, P.; Leslie, D.; Reid, I. D.; Symonds, P.; Teodorescu, L.; Turner, M.] Brunel Univ, Uxbridge, Middx, England. [Borzou, A.; Call, K.; Dittmann, J.; Hatakeyama, K.; Liu, H.; Pastika, N.] Baylor Univ, Waco, TX 76798 USA. [Charaf, O.; Cooper, S. I.; Henderson, C.; Rumerio, P.] Univ Alabama, Tuscaloosa, AL USA. [Arcaro, D.; Avetisyan, A.; Bose, T.; Gastler, D.; Rankin, D.; Richardson, C.; Rohlf, J.; Sulak, L.; Zou, D.] Boston Univ, Boston, MA 02215 USA. [Benelli, G.; Berry, E.; Cutts, D.; Garabedian, A.; Hakala, J.; Heintz, U.; Hogan, J. M.; Jesus, O.; Laird, E.; Landsberg, G.; Mao, Z.; Narain, M.; Piperov, S.; Sagir, S.; Spencer, E.; Syarif, R.] Brown Univ, Providence, RI 02912 USA. [Chauhan, S.; Burns, D.; Breedon, R.; Breto, G.; Sanchez, M. Calderon De La Barca; Chertok, M.; Conway, J.; Conway, R.; Cox, P. T.; Erbacher, R.; Flores, C.; Funk, G.; Gardner, M.; Ko, W.; Lander, R.; Mclean, C.; Mulhearn, M.; Pellett, D.; Pilot, J.; Ricci-Tam, F.; Shalhout, S.; Smith, J.; Squires, M.; Stolp, D.; Tripathi, M.; Wilbur, S.; Yohay, R.] Univ Calif Davis, Davis, CA 95616 USA. [Weber, M.; Cousins, R.; Everaerts, P.; Florent, A.; Hauser, J.; Ignatenko, M.; Saltzberg, D.; Takasugi, E.; Valuev, V.] Univ Calif Los Angeles, Los Angeles, CA USA. [Burt, K.; Clare, R.; Ellison, J.; Gary, J. W.; Hanson, G.; Heilman, J.; Jandir, P.; Kennedy, E.; Lacroix, F.; Long, O. R.; Malberti, M.; Negrete, M. Olmedo; Paneva, M. I.; Shrinivas, A.; Wei, H.; Wimpenny, S.; Yates, B. R.] Univ Calif Riverside, Riverside, CA 92521 USA. [Sharma, V.; Branson, J. G.; Cerati, G. B.; Cittolin, S.; Derdzinski, M.; Gerosa, R.; Holzner, A.; Klein, D.; Krutelyov, V.; Letts, J.; Macneill, I.; Olivito, D.; Padhi, S.; Pieri, M.; Sani, M.; Simon, S.; Tadel, M.; Vartak, A.; Wasserbaech, S.; Welke, C.; Wood, J.; Wurthwein, F.; Yagil, A.; Della Porta, G. Zevi] Univ Calif San Diego, La Jolla, CA 92093 USA. [Bhandari, R.; Bradmiller-Feld, J.; Campagnari, C.; Dishaw, A.; Dutta, V.; Flowers, K.; Sevilla, M. Franco; Geffert, P.; George, C.; Golf, F.; Gouskos, L.; Gran, J.; Heller, R.; Incandela, J.; Mccoll, N.; Mullin, S. D.; Ovcharova, A.; Richman, J.; Stuart, D.; Suarez, I.; West, C.; Yoo, J.] Univ Calif Santa Barbara, Santa Barbara, CA 93106 USA. [Anderson, D.; Apresyan, A.; Bendavid, J.; Bornheim, A.; Bunn, J.; Chen, Y.; Duarte, J.; Lawhorn, J. M.; Mott, A.; Newman, H. B.; Pena, C.; Spiropulu, M.; Vlimant, J. R.; Xie, S.; Zhu, R. Y.] CALTECH, Pasadena, CA 91125 USA. [Andrews, M. B.; Azzolini, V.; Carlson, B.; Ferguson, T.; Paulini, M.; Russ, J.; Sun, M.; Vogel, H.; Vorobiev, I.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Cumalat, J. P.; Ford, W. T.; Jensen, F.; Johnson, A.; Krohn, M.; Mulholland, T.; Stenson, K.; Wagner, S. R.] Univ Colorado Boulder, Boulder, CO USA. [Alexander, J.; Chaves, J.; Chu, J.; Dittmer, S.; Mcdermott, K.; Mirman, N.; Kaufman, G. Nicolas; Patterson, J. R.; Rinkevicius, A.; Ryd, A.; Skinnari, L.; Soffi, L.; Tan, S. M.; Tao, Z.; Thom, J.; Tucker, J.; Wittich, P.; Zientek, M.] Cornell Univ, Ithaca, NY USA. [Winn, D.] Fairfield Univ, Fairfield, CT 06430 USA. [Banerjee, S.; Abdullin, S.; Albrow, M.; Apollinari, G.; Bauerdick, L. A. T.; Beretvas, A.; Berryhill, J.; Bhat, P. C.; Bolla, G.; Burkett, K.; Butler, J. N.; Cheung, H. W. K.; Chlebana, F.; Cihangir, S.; Cremonesi, M.; Elvira, V. D.; Fisk, I.; Freeman, J.; Gottschalk, E.; Gray, L.; Green, D.; Grunendahl, S.; Gutsche, O.; Hare, D.; Harris, R. M.; Hasegawa, S.; Hirschauer, J.; Hu, Z.; Jayatilaka, B.; Jindariani, S.; Johnson, M.; Joshi, U.; Klima, B.; Kreis, B.; Lammel, S.; Linacre, J.; Lincoln, D.; Lipton, R.; Liu, T.; De Sa, R. Lopes; Lykken, J.; Maeshima, K.; Magini, N.; Marraffino, J. M.; Maruyama, S.; Mason, D.; McBride, P.; Merkel, P.; Mrenna, S.; Nahn, S.; Newman-Holmes, C.; O'Dell, V.; Pedro, K.; Prokofyev, O.; Rakness, G.; Ristori, L.; Sexton-Kennedy, E.; Soha, A.; Spalding, W. J.; Spiegel, L.; Stoynev, S.; Strobbe, N.; Taylor, L.; Tkaczyk, S.; Tran, N. V.; Uplegger, L.; Vaandering, E. W.; Vernieri, C.; Verzocchi, M.; Vidal, R.; Wang, M.; Weber, H. A.; Whitbeck, A.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Acosta, D.; Avery, P.; Bortignon, P.; Bourilkov, D.; Brinkerhoff, A.; Carnes, A.; Carver, M.; Curry, D.; Das, S.; Field, R. D.; Furic, I. K.; Konigsberg, J.; Korytov, A.; Ma, P.; Matchev, K.; Mei, H.; Milenovic, P.; Mitselmakher, G.; Rank, D.; Shchutska, L.; Sperka, D.; Thomas, L.; Wang, J.; Wang, S.; Yelton, J.] Univ Florida, Gainesville, FL USA. [Linn, S.; Markowitz, P.; Martinez, G.; Rodriguez, J. L.] Florida Int Univ, Miami, FL 33199 USA. [Ackert, A.; Adams, J. R.; Adams, T.; Askew, A.; Bein, S.; Diamond, B.; Hagopian, S.; Hagopian, V.; Johnson, K. F.; Khatiwada, A.; Prosper, H.; Santra, A.; Weinberg, M.] Florida State Univ, Tallahassee, FL 32306 USA. [Baarmand, M. M.; Bhopatkar, V.; Colafranceschi, S.; Hohlmann, M.; Noonan, D.; Roy, T.; Yumiceva, F.] Florida Inst Technol, Melbourne, FL USA. [Adams, M. R.; Apanasevich, L.; Berry, D.; Betts, R. R.; Bucinskaite, I.; Cavanaugh, R.; Evdokimov, O.; Gauthier, L.; Gerber, C. E.; Hofman, D. J.; Kurt, P.; O'Brien, C.; Gonzalez, I. D. Sandoval; Turner, P.; Varelas, N.; Wang, H.; Wu, Z.; Zakaria, M.; Zhang, J.] Univ Illinois, Chicago, IL USA. [Bilki, B.; Clarida, W.; Dilsiz, K.; Durgut, S.; Gandrajula, R. P.; Haytmyradov, M.; Khristenko, V.; Merlo, J. -P.; Mermerkaya, H.; Mestvirishvili, A.; Moeller, A.; Nachtman, J.; Ogul, H.; Onel, Y.; Ozok, F.; Penzo, A.; Snyder, C.; Tiras, E.; Wetzel, J.; Yi, K.] Univ Iowa, Iowa City, IA USA. [Anderson, I.; Blumenfeld, B.; Cocoros, A.; Eminizer, N.; Fehling, D.; Feng, L.; Gritsan, A. V.; Maksimovic, P.; Osherson, M.; Roskes, J.; Sarica, U.; Swartz, M.; Xiao, M.; Xin, Y.; You, C.] Johns Hopkins Univ, Baltimore, MD USA. [Al-Bataineh, A.; Baringer, P.; Bean, A.; Bowen, J.; Bruner, C.; Castle, J.; Kenny, R. P., III; Kropivnitskaya, A.; Majumder, D.; Mcbrayer, W.; Murray, M.; Sanders, S.; Stringer, R.; Takaki, J. D. Tapia; Wang, Q.] Univ Kansas, Lawrence, KS 66045 USA. [Ivanov, A.; Kaadze, K.; Khalil, S.; Makouski, M.; Maravin, Y.; Mohammadi, A.; Saini, L. K.; Skhirtladze, N.; Toda, S.] Kansas State Univ, Manhattan, KS 66506 USA. [Rebassoo, F.; Wright, D.] Lawrence Livermore Natl Lab, Livermore, CA USA. [Anelli, C.; Baden, A.; Baron, O.; Belloni, A.; Calvert, B.; Eno, S. C.; Ferraioli, C.; Gomez, J. A.; Hadley, N. J.; Jabeen, S.; Kellogg, R. G.; Kolberg, T.; Kunkle, J.; Lu, Y.; Mignerey, A. C.; Shin, Y. H.; Skuja, A.; Tonjes, M. B.; Tonwar, S. C.] Univ Maryland, College Pk, MD 20742 USA. [Wang, J.; Abercrombie, D.; Allen, B.; Apyan, A.; Barbieri, R.; Baty, A.; Bi, R.; Bierwagen, K.; Brandt, S.; Busza, W.; Cali, I. A.; Demiragli, Z.; Di Matteo, L.; Gomez Ceballos, G.; Goncharov, M.; Hsu, D.; Iiyama, Y.; Innocenti, G. M.; Klute, M.; Kovalskyi, D.; Krajczar, K.; Lai, Y. S.; Lee, Y. -J.; Levin, A.; Luckey, P. D.; Marini, A. C.; Mcginn, C.; Mironov, C.; Narayanan, S.; Niu, X.; Paus, C.; Roland, C.; Roland, G.; Salfeld-Nebgen, J.; Stephans, G. S. F.; Sumorok, K.; Tatar, K.; Varma, M.; Velicanu, D.; Veverka, J.; Wang, T. W.; Wyslouch, B.; Yang, M.; Zhukova, V.] MIT, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Benvenuti, A. C.; Chatterjee, R. M.; Evans, A.; Finkel, A.; Gude, A.; Hansen, P.; Kalafut, S.; Kao, S. C.; Kubota, Y.; Lesko, Z.; Mans, J.; Nourbakhsh, S.; Ruckstuhl, N.; Rusack, R.; Tambe, N.; Turkewitz, J.] Univ Minnesota, Minneapolis, MN USA. [Acosta, J. G.; Oliveros, S.] Univ Mississippi, Oxford, MS USA. [Avdeeva, E.; Bartek, R.; Bloom, K.; Bose, S.; Claes, D. R.; Dominguez, A.; Fangmeier, C.; Suarez, R. Gonzalez; Kamalieddin, R.; Knowlton, D.; Kravchenko, I.; Rodrigues, A. Malta; Meier, F.; Monroy, J.; Siado, J. E.; Snow, G. R.; Stieger, B.] Univ Nebraska, Lincoln, NE USA. [Alyari, M.; Dolen, J.; George, J.; Godshalk, A.; Harrington, C.; Iashvili, I.; Kaisen, J.; Kharchilava, A.; Kumar, A.; Parker, A.; Rappoccio, S.; Roozbahani, B.] SUNY Buffalo, Buffalo, NY USA. [Alverson, G.; Barberis, E.; Baumgartel, D.; Hortiangtham, A.; Knapp, B.; Massironi, A.; Morse, D. M.; Nash, D.; Orimoto, T.; De Lima, R. Teixeira; Trocino, D.; Wang, R. -J.; Wood, D.] Northeastern Univ, Boston, MA 02115 USA. [Bhattacharya, S.; Kumar, A.; Hahn, K. A.; Kubik, A.; Low, J. F.; Mucia, N.; Odell, N.; Pollack, B.; Schmitt, M. H.; Sung, K.; Trovato, M.; Velasco, M.] Northwestern Univ, Evanston, IL USA. [Dev, N.; Hildreth, M.; Anampa, K. Hurtado; Jessop, C.; Karmgard, D. J.; Kellams, N.; Lannon, K.; Marinelli, N.; Meng, F.; Mueller, C.; Musienko, Y.; Planer, M.; Reinsvold, A.; Ruchti, R.; Smith, G.; Taroni, S.; Valls, N.; Wayne, M.; Wolf, M.; Woodard, A.] Univ Notre Dame, Notre Dame, IN 46556 USA. [Alimena, J.; Antonelli, L.; Brinson, J.; Bylsma, B.; Durkin, L. S.; Flowers, S.; Francis, B.; Hart, A.; Hill, C.; Hughes, R.; Ji, W.; Liu, B.; Luo, W.; Puigh, D.; Winer, B. L.; Wulsin, H. W.] Ohio State Univ, Columbus, OH 43210 USA. [Cooperstein, S.; Driga, O.; Elmer, P.; Hardenbrook, J.; Hebda, P.; Lange, D.; Luo, J.; Marlow, D.; Medvedeva, T.; Mei, K.; Mooney, M.; Olsen, J.; Palmer, C.; Piroue, P.; Stickland, D.; Tully, C.; Zuranski, A.] Princeton Univ, Princeton, NJ 08544 USA. [Malik, S.] Univ Puerto Rico, Mayaguez, PR USA. [Barker, A.; Barnes, V. E.; Folgueras, S.; Gutay, L.; Jha, M. K.; Jones, M.; Jung, A. W.; Jung, K.; Miller, D. H.; Neumeister, N.; Radburn-Smith, B. C.; Shi, X.; Sun, J.; Svyatkovskiy, A.; Wang, F.; Xie, W.; Xu, L.] Purdue Univ, W Lafayette, IN 47907 USA. [Parashar, N.; Stupak, J.] Purdue Univ Calumet, Hammond, LA USA. [Adair, A.; Akgun, B.; Chen, Z.; Ecklund, K. M.; Geurts, F. J. M.; Guilbaud, M.; Li, W.; Michlin, B.; Northup, M.; Padley, B. P.; Redjimi, R.; Roberts, J.; Rorie, J.; Tu, Z.; Zabel, J.] Rice Univ, Houston, TX USA. [Betchart, B.; Bodek, A.; de Barbaro, P.; Demina, R.; Duh, Y. T.; Ferbel, T.; Galanti, M.; Garcia-Bellido, A.; Han, J.; Hindrichs, O.; Khukhunaishvili, A.; Lo, K. H.; Tan, P.; Verzetti, M.] Univ Rochester, Rochester, NY USA. [Contreras-Campana, C.; Chou, J. P.; Gershtein, Y.; Espinosa, T. A. Gomez; Halkiadakis, E.; Heindl, M.; Hidas, D.; Hughes, E.; Kaplan, S.; Elayavalli, R. Kunnawalkam; Kyriacou, S.; Lath, A.; Nash, K.; Saka, H.; Salur, S.; Schnetzer, S.; Sheffield, D.; Somalwar, S.; Stone, R.; Thomas, S.; Thomassen, P.; Walker, M.] Rutgers State Univ, Piscataway, NJ USA. [Foerster, M.; Heideman, J.; Riley, G.; Rose, K.; Spanier, S.; Thapa, K.] Univ Tennessee, Knoxville, TN USA. [Rose, A.; Bouhali, O.; Celik, A.; Dalchenko, M.; De Mattia, M.; Delgado, A.; Dildick, S.; Eusebi, R.; Gilmore, J.; Huang, T.; Juska, E.; Kamon, T.; Mueller, R.; Pakhotin, Y.; Patel, R.; Perloff, A.; Pernie, L.; Rathjens, D.; Safonov, A.; Tatarinov, A.; Ulmer, K. A.] Texas A&M Univ, College Stn, TX USA. [Wang, Z.; Lee, S. W.; Akchurin, N.; Cowden, C.; Damgov, J.; Dragoiu, C.; Dudero, P. 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[Bhowmik, S.; Maity, M.; Sarkar, T.] Visva Bharati Univ, Santini Ketan, W Bengal, India. [Wickramage, N.] Univ Ruhuna, Matara, Sri Lanka. [Chenarani, S.; Etesami, S. M.] Isfahan Univ Technol, Esfahan, Iran. [Fahim, A.] Univ Tehran, Dept Engn Sci, Tehran, Iran. [Safarzadeh, B.] Islamic Azad Univ, Sci & Res Branch, Plasma Phys Res Ctr, Tehran, Iran. [Androsov, K.; Ciocci, M. A.; Grippo, M. T.] Univ Siena, Siena, Italy. [Savoy-Navarro, A.] Purdue Univ, W Lafayette, IN 47907 USA. [Ali, M. A. B. Md] Int Islamic Univ Malaysia, Kuala Lumpur, Malaysia. [Idris, F. Mohamad] Agensi Nuklear Malaysia, MOSTI, Kajang, Malaysia. [Heredia-De La Cruz, I.] Consejo Nacl Ciencia & Technol, Mexico City, DF, Mexico. [Byszuk, A.; Zagozdzinska, A.] Warsaw Univ Technol, Inst Elect Syst, Warsaw, Poland. [Matveev, V.; Musienko, Y.] Inst Nucl Res, Moscow, Russia. [Matveev, V.; Bylinkin, A.; Azarkin, M.; Dremin, I.; Leonidov, A.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. 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[Bouhali, O.] Texas A&M Univ Qatar, Doha, Qatar. [Kamon, T.] Kyungpook Natl Univ, Daegu, South Korea. RP Khachatryan, V (reprint author), Yerevan Phys Inst, Yerevan, Armenia. RI Della Ricca, Giuseppe/B-6826-2013; Lokhtin, Igor/D-7004-2012; TUVE', Cristina/P-3933-2015; Terkulov, Adel/M-8581-2015; Goh, Junghwan/Q-3720-2016; Konecki, Marcin/G-4164-2015; OI Della Ricca, Giuseppe/0000-0003-2831-6982; TUVE', Cristina/0000-0003-0739-3153; Goh, Junghwan/0000-0002-1129-2083; Konecki, Marcin/0000-0001-9482-4841; Luukka, Panja/0000-0003-2340-4641 NR 38 TC 3 Z9 3 U1 8 U2 8 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 280 EP 303 DI 10.1016/j.physletb.2016.10.054 PG 24 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600041 ER PT J AU Aad, G Abbott, B Abdallah, J Abdinov, O Abeloos, B Aben, R AbouZeid, OS Abraham, NL Abramowicz, H Abreu, H Abreu, R Abulaitia, Y Acharya, BS Adamczyk, L Adams, DL Adelman, J Adomeit, S Adye, T Affolder, AA Agatonovic-Jovin, T Agricola, J Aguilar-Saavedra, JA Ahlen, SP Ahmadov, F Aielli, G Akerstedt, H Akesson, TPA Akimov, AV Alberghi, GL Albert, J Albrand, S Verzini, MJA Aleksa, M Aleksandrov, IN Alexa, C Alexander, G Alexopoulos, T Alhroob, M Aliev, M Alimonti, G Alison, J Alkire, SP Allbrooke, BMM Allen, BW Allport, PP Aloisio, A Alonso, A Alonso, F Alpigiani, C Alstaty, M Gonzalez, BA Piqueras, DA Alviggi, MG Amadio, BT Amako, K Coutinho, YA Amelung, C Amidei, D Dos Santos, SPA Amorim, A Amoroso, S Amundsen, G Anastopoulos, C Ancu, LS Andari, N 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Zhou, B. Zhou, C. Zhou, L. Zhou, L. Zhou, M. Zhou, N. Zhu, C. G. Zhu, H. Zhu, J. Zhu, Y. Zhuang, X. Zhukov, K. Zibell, A. Zieminska, D. Zimine, N. I. Zimmermann, C. Zimmermann, S. Zinonos, Z. Zinser, M. Ziolkowski, M. Zivkovic, L. Zobernig, G. Zoccoli, A. zur Nedden, M. Zurzolo, G. Zwalinski, L. CA ATLAS Collaboration TI Transverse momentum, rapidity, and centrality dependence ofinclusive charged-particle production in root s(NN)=5.02 TeV p+Pb collisions measured by the ATLAS experiment SO PHYSICS LETTERS B LA English DT Article ID P-PB COLLISIONS; PROTON-NUCLEUS COLLISIONS; MONTE-CARLO MODEL; ROOT-S-NN=5.02 TEV; MULTIPLICITY DEPENDENCE; CGC PREDICTIONS; LHC; PLUS; SCATTERING; KAON AB Measurements of the per-event charged-particle yield as a function of the charged-particle transverse momentum and rapidity are performed using p + Pbcollision data collected by the ATLAS experiment at the LHC at a centre-of-mass energy of root sNN= 5.02 TeV. Charged particles are reconstructed over pseudorapidity |eta| < 2.3and transverse momentum between 0.1GeVand 22GeVin a dataset corresponding to an integrated luminosity of 1 mu b(-1). The results are presented in the form of chargedparticle nuclear modification factors, where the p + Pbcharged-particle multiplicities are compared between central and peripheral p + Pbcollisions as well as to charged-particle cross sections measured in ppcollisions. The p + Pbcollision centrality is characterized by the total transverse energy measured in -4.9 b (b) over bar, WW*. Our study improves the existing analyses of the proposed future resonant Higgs factories and provides further guidance for the accelerator designs with respect to the physical goals. Published by Elsevier B.V. C1 [Greco, Mario] Univ Roma Tre, Ist Nazl Fis Nucl, Sez Roma, Dipartimento Matemat & Fis, Via Vasca Navale 84, I-00146 Rome, Italy. [Han, Tao] Univ Pittsburgh, Pittsburgh Particle Phys Astrophys & Cosmol Ctr, Dept Phys & Astron, 3941 OHara St, Pittsburgh, PA 15260 USA. [Han, Tao] Tsinghua Univ, Dept Phys, Beijing 100086, Peoples R China. [Han, Tao] Collaborat Innovat Ctr Quantum Matter, Beijing, Peoples R China. [Liu, Zhen] Fermilab Natl Accelerator Lab, Theoret Phys Dept, POB 500, Batavia, IL 60510 USA. RP Liu, Z (reprint author), Fermilab Natl Accelerator Lab, Theoret Phys Dept, POB 500, Batavia, IL 60510 USA. EM mario.greco@roma3.infn.it; than@pitt.edu; zliu2@fnal.gov OI Greco, Mario/0000-0003-0809-2993 FU U.S. Department of Energy [DE-FG02-95ER40896, DE-AC02-07CH11359]; PITT PACC FX This work is supported in part by the U.S. Department of Energy under grant Nos. DE-FG02-95ER40896, DE-AC02-07CH11359 in part by PITT PACC. Fermilab is operated by Fermi Research Alliance, LLC under Contract No. DE-AC02-07CH11359 with the U.S. Department of Energy. Z.L. and T.H. thank the Kavli Institutes for Theoretical Physics at UC Santa Barbara and in China at the CAS, respectively, for their hospitality during the final stage of this paper. NR 31 TC 0 Z9 0 U1 0 U2 0 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 409 EP 415 DI 10.1016/j.physletb.2016.10.078 PG 7 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600058 ER PT J AU Khachatryan, V Sirunyan, AM Tumasyan, A Adam, W Asilar, E Bergauer, T Brandstetter, J Brondolin, E Dragicevic, M Ero, J Flechl, M Friedl, M Fruhwirth, R Ghete, VM Hartl, C Hormann, N Hrubec, J Jeitler, M Knunz, V Konig, A Krammer, M Kratschmer, I Liko, D Matsushita, T Mikulec, I Rabady, D Rahbaran, B Rohringer, H Schieck, J Schoefbeck, R Strauss, J Treberer-Treberspurg, W Waltenberger, W Wulz, CE Mossolov, V Shumeiko, N Gonzalez, JS Alderweireldt, S Cornelis, T DeWolf, EA Janssen, X Knutsson, A Lauwers, J Luyckx, S De Klundert, MV Van Haevermaet, H Van Mechelen, P Van Remortel, N Van Spilbeeck, A Abu Zeid, S Blekman, F D'Hondt, J Daci, N De Bruyn, I Deroover, K Heracleous, N Keaveney, J Lowette, S Moreels, L Olbrechts, A Python, Q Strom, D Tavernier, S 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CA CMS Collaboration TI Search for lepton flavour violating decays of the Higgs boson to e tau and e mu in proton-proton collisions at root s=8 TeV SO PHYSICS LETTERS B LA English DT Article DE CMS; Physics; Higgs; Lepton-flavour-violation ID HADRON COLLIDERS; H(0) DECAYS; PARTICLES AB A direct search for lepton flavour violating decays of the Higgs boson (H) in the H. etand H. e mu channels is described. The data sample used in the search was collected in proton-proton collisions at root s= 8 TeVwith the CMS detector at the LHC and corresponds to an integrated luminosity of 19.7 fb(-1). No evidence is found for lepton flavour violating decays in either final state. Upper limits on the branching fractions, B(H. et) < 0.69% and B(H. e mu) < 0.035%, are set at the 95% confidence level. The constraint set on B(H. et) is an order of magnitude more stringent than the existing indirect limits. 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L.; Ujvari, B.] Univ Debrecen, Debrecen, Hungary. [Choudhury, S.; Mal, P.; Mandal, K.; Sahoo, D. K.; Sahoo, N.; Swain, S. K.] Natl Inst Sci Educ & Res, Bhubaneswar, Orissa, India. [Bansal, S.; Beri, S. B.; Bhatnagar, V.; Chawla, R.; Gupta, R.; Bhawandeep, U.; Kalsi, A. K.; Kaur, A.; Kaur, M.; Kumar, R.; Mehta, A.; Mittal, M.; Singh, J. B.; Walia, G.] Panjab Univ, Chandigarh, India. [Kumar, Ashok; Bhardwaj, A.; Choudhary, B. C.; Garg, R. B.; Kumar, A.; Malhotra, S.; Naimuddin, M.; Nishu, N.; Ranjan, K.; Sharma, R.; Sharma, V.] Univ Delhi, Delhi, India. [Bhattacharya, S.; Chatterjee, K.; Dey, S.; Dutta, S.; Jain, Sa.; Majumdar, N.; Modak, A.; Mondal, K.; Mukherjee, S.; Mukhopadhyay, S.; Roy, A.; Roy, D.; Roy Chowdhury, S.; Sarkar, S.; Sharan, M.] Saha Inst Nucl Phys, Kolkata, India. [Abdulsalam, A.; Chudasama, R.; Dutta, D.; Jha, V.; Kumar, V.; Mohanty, A. K.; Pant, L. M.; Shukla, P.; Topkar, A.] Bhabha Atom Res Ctr, Bombay, Maharashtra, India. [Aziz, T.; Banerjee, S.; Bhowmik, S.; Chatterjee, R. M.; Dewanjee, R. K.; Dugad, S.; Ganguly, S.; Ghosh, S.; Guchait, M.; Gurtu, A.; Kole, G.; Kumar, S.; Mahakud, B.; Maity, M.; Majumder, G.; Mazumdar, K.; Mitra, S.; Mohanty, G. B.; Parida, B.; Sarkar, T.; Sur, N.; Sutar, B.; Wickramage, N.] Tata Inst Fundamental Res, Bombay, Maharashtra, India. [Chauhan, S.; Dube, S.; Kapoor, A.; Kothekar, K.; Sharma, S.] Indian Inst Sci Educ & Res, Pune, Maharashtra, India. [Bakhshiansohi, H.; Behnamian, H.; Etesami, S. M.; Fahim, A.; Goldouzian, R.; Khakzad, M.; Najafabadi, M. Mohammadi; Naseri, M.; Mehdiabadi, S. Paktinat; Hosseinabadi, F. Rezaei; Safarzadeh, B.; Zeinali, M.] Inst Res Fundamental Sci IPM, Tehran, Iran. [Felcini, M.; Grunewald, M.] Univ Coll Dublin, Dublin, Ireland. [Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iasellia, G.; Maggia, G.; Maggi, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Silvestris, L.; Venditti, R.; Verwilligen, P.] Ist Nazl Fis Nucl, Sez Bari, Bari, Italy. [Abbrescia, M.; Calabria, C.; Caputo, C.; Cristella, L.; De Palma, M.; Miniello, G.; Nuzzo, S.; Pompili, A.; Radogna, R.; Selvaggi, G.; Venditti, R.] Univ Bari, Bari, Italy. [Creanza, D.; De Filippis, N.; Iasellia, G.; Maggia, G.; My, S.; Pugliese, G.] Politecn Bari, Bari, Italy. [Abbiendi, G.; Benvenuti, A. C.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.; Travaglini, R.] Ist Nazl Fis Nucl, Sez Bologna, Bologna, Italy. [Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Fanfani, A.; Fasanella, D.; Guiducci, L.; Navarria, F. L.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.; Travaglini, R.] Univ Bologna, Bologna, Italy. [Cappello, G.; Chiorboli, M.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Ist Nazl Fis Nucl, Sez Catania, Catania, Italy. [Chiorboli, M.; Costa, S.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Univ Catania, Catania, Italy. [Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Meschini, M.; Paoletti, S.; Sguazzoni, G.; Viliani, L.] Ist Nazl Fis Nucl, Sez Firenze, Florence, Italy. [Ciulli, V.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Viliani, L.] Univ Florence, Florence, Italy. [Fabbri, F.; Benussi, L.; Bianco, S.; Piccolo, D.; Primavera, F.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Calvelli, V.; Ferro, F.; Lo Vetere, M.; Monge, M. R.; Robutti, E.; Tosi, S.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Calvelli, V.; Lo Vetere, M.; Monge, M. R.; Tosi, S.] Univ Genoa, Genoa, Italy. [Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Gerosa, R.; Ghezzi, A.; Govoni, P.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Ragazzi, S.; Redaelli, N.; de Fatis, T. Tabarelli] Ist Nazl Fis Nucl, Sez Milano Bicocca, Milan, Italy. [Dinardo, M. E.; Fiorendi, S.; Gerosa, R.; Ghezzi, A.; Govoni, P.; Manzoni, R. A.; Marzocchi, B.; Paganoni, M.; Ragazzi, S.; de Fatis, T. Tabarelli] Univ Milano Bicocca, Milan, Italy. [Buontempo, S.; Cavallo, N.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Merola, M.; Paolucci, P.; Sciacca, C.] Ist Nazl Fis Nucl, Sez Napoli, Naples, Italy. [Esposito, M.; Iorio, A. O. M.; Sciacca, C.] Univ Naples Federico II, Naples, Italy. [Cavallo, N.; Fabozzi, F.] Univ Basilicata, Potenza, Italy. [Di Guida, S.; Meola, S.] Univ G Marconi, Rome, Italy. [Azzi, P.; Bacchetta, N.; Benato, L.; Bisello, D.; Boletti, A.; Branca, A.; Carlin, R.; Checchia, P.; Dall'Osso, M.; Dorigo, T.; Dosselli, U.; Fanzago, F.; Gasparini, F.; Gasparini, U.; Gozzelino, A.; Kanishchev, K.; Lacaprara, S.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Torassa, E.; Tosi, M.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Ist Nazl Fis Nucl, Sez Padova, Padua, Italy. [Benato, L.; Bisello, D.; Boletti, A.; Branca, A.; Carlin, R.; Dall'Osso, M.; Gasparini, F.; Gasparini, U.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Tosi, M.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Univ Padua, Padua, Italy. [Kanishchev, K.] Univ Trento, Trento, Italy. [Braghieri, A.; Magnani, A.; Montagna, P.; Ratti, S. P.; Re, V.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Univ Pavia, Pavia, Italy. [Solestizi, L. Alunni; Bilei, G. M.; Ciangottini, D.; Fano, L.; Lariccia, P.; Mantovani, G.; Menichelli, M.; Saha, A.; Santocchia, A.] Ist Nazl Fis Nucl, Sez Perugia, Perugia, Italy. [Solestizi, L. Alunni; Ciangottini, D.; Fano, L.; Lariccia, P.; Mantovani, G.; Santocchia, A.] Univ Perugia, Perugia, Italy. [Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Donato, S.; Foa, L.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Serban, A. T.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Tonelli, G.] Univ Pisa, Pisa, Italy. [Donato, S.; Foa, L.; Ligabue, F.] Scuola Normale Super Pisa, Pisa, Italy. [Barone, L.; Cavallari, F.; D'imperio, G.; Del Re, D.; Diemoz, M.; Gelli, S.; Jorda, C.; Longo, E.; Margaroli, F.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.; Traczyk, P.; Di Marco, E.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Barone, L.; D'imperio, G.; Del Re, D.; Gelli, S.; Longo, E.; Margaroli, F.; Organtini, G.; Preiato, F.; Rahatlou, S.; Santanastasio, F.; Traczyk, P.] Univ Rome, Rome, Italy. [Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bellan, R.; Biino, C.; Cartiglia, N.; Costa, M.; Covarelli, R.; Degano, A.; Demaria, N.; Finco, L.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Solano, A.; Staiano, A.] Ist Nazl Fis Nucl, Sez Torino, Turin, Italy. [Amapane, N.; Argiro, S.; Bellan, R.; Costa, M.; Covarelli, R.; Degano, A.; Finco, L.; Kiani, B.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Sacchi, R.; Solano, A.] Univ Turin, Turin, Italy. [Arcidiacono, R.; Arneodo, M.] Univ Piemonte Orientale, Novara, Italy. [Belforte, S.; Candelise, V.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; Gobbo, B.; La Licata, C.; Marone, M.; Schizzi, A.; Zanetti, A.] Ist Nazl Fis Nucl, Sez Trieste, Trieste, Italy. [Candelise, V.; Della Ricca, G.; La Licata, C.; Marone, M.; Schizzi, A.] Univ Trieste, Trieste, Italy. [Kropivnitskaya, A.; Nam, S. K.] Kangwon Natl Univ, Chunchon, South Korea. [Kim, D. H.; Kim, G. N.; Kim, M. S.; Kong, D. J.; Lee, S.; Oh, Y. D.; Sakharov, A.; Son, D. C.; Kamon, T.] Kyungpook Natl Univ, Daegu, South Korea. [Cifuentes, J. A. Brochero; Kim, H.; Kim, T. J.] Chonbuk Natl Univ, Jeonju, South Korea. [Song, S.] Chonnam Natl Univ, Inst Univ & Elementary Particles, Kwangju, South Korea. [Lee, S.; Kim, H.; Choi, S.; Go, Y.; Gyun, D.; Hong, B.; Kim, Y.; Lee, B.; Lee, K.; Lee, K. S.; Park, S. K.; Roh, Y.] Korea Univ, Seoul, South Korea. [Yoo, H. D.] Seoul Natl Univ, Seoul, South Korea. [Kim, H.; Choi, M.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.] Univ Seoul, Seoul, South Korea. [Choi, Y.; Goh, J.; Kim, D.; Kwon, E.; Lee, J.; Yu, I.] Sungkyunkwan Univ, Suwon, South Korea. [Dudenas, V.; Juodagalvis, A.; Vaitkus, J.] Vilnius Univ, Vilnius, Lithuania. [Ahmed, I.; Ibrahim, Z. A.; Komaragiri, J. R.; Ali, M. A. B. Md; Idris, F. Mohamad; Abdullah, W. A. T. Wan; Yusli, M. N.] Univ Malaya, Natl Ctr Particle Phys, Kuala Lumpur, Malaysia. [Casimiro Linares, E.; Castilla-Valdez, H.; De La Cruz-Burelo, E.; Heredia-De La Cruz, I.; Hernandez-Almada, A.; Lopez-Fernandez, R.; Sanchez-Hernandez, A.] IPN, Ctr Invest & Estudios Avanzados, Mexico City, DF, Mexico. [Carrillo Moreno, S.; Vazquez Valencia, F.] Univ Iberoamer, Mexico City, DF, Mexico. [Pedraza, I.; Salazar Ibarguen, H. A.] Benemerita Univ Autonoma Puebla, Puebla, Mexico. [Morelos Pineda, A.] Univ Autonoma San Luis Potosi, San Luis Potosi, Mexico. [Krofcheck, D.] Univ Auckland, Auckland, New Zealand. [Butler, P. H.] Univ Canterbury, Christchurch, New Zealand. [Ahmad, M.; Ahmad, A.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Khurshid, T.; Shoaib, M.] Quaid I Azam Univ, Natl Ctr Phys, Islamabad, Pakistan. [Bialkowska, H.; Bluj, M.; Boimska, B.; Frueboes, T.; Gorski, M.; Kazana, M.; Nawrocki, K.; Romanowska-Rybinska, K.; Szleper, M.; Zalewski, P.] Natl Ctr Nucl Res, Otwock, Poland. [Brona, G.; Bunkowski, K.; Byszuk, A.; Doroba, K.; Kalinowski, A.; Konecki, M.; Krolikowski, J.; Misiura, M.; Olszewski, M.; Walczak, M.] Univ Warsaw, Inst Expt Phys, Fac Phys, Warsaw, Poland. [Bargassa, P.; Da Cruz E Silva, C. Beirao; Di Francesco, A.; Faccioli, P.; Parracho, P. G. Ferreira; Gallinaro, M.; Leonardo, N.; Iglesias, L. Lloret; Nguyen, F.; Antunes, J. Rodrigues; Seixas, J.; Toldaiev, O.; Vadruccio, D.; Varela, J.; Vischia, P.] Lab Instrumentacao & Fis Expt Particulas, Lisbon, Portugal. [Finger, M.; Finger, M., Jr.; Tsamalaidze, Z.; Bunin, P.; Golutvin, I.; Gorbounov, N.; Gorbunov, I.; Karjavin, V.; Konoplyanikov, V.; Kozlov, G.; Lanev, A.; Malakhov, A.; Matveev, V.; Moisenz, P.; Palichik, V.; Perelygin, V.; Savina, M.; Shmatov, S.; Shulha, S.; Skatchkov, N.; Smirnov, V.; Zarubin, A.] Joint Inst Nucl Res, Dubna, Russia. [Golovtsov, V.; Ivanov, Y.; Kim, V.; Kuznetsova, E.; Levchenko, P.; Murzin, V.; Oreshkin, V.; Smirnov, I.; Sulimov, V.; Uvarov, L.; Vavilov, S.; Vorobyev, A.] Petersburg Nucl Phys Inst, St Petersburg, Russia. [Matveev, V.; Andreev, Yu.; Dermenev, A.; Gninenko, S.; Golubev, N.; Karneyeu, A.; Kirsanov, M.; Krasnikov, N.; Pashenkov, A.; Tlisov, D.; Toropin, A.; Musienko, Y.] Inst Nucl Res, Moscow, Russia. [Epshteyn, V.; Gavrilov, V.; Lychkovskaya, N.; Popov, V.; Pozdnyakov, I.; Safronov, G.; Spiridonov, A.; Vlasov, E.; Zhokin, A.; Starodumov, A.; Nikitenko, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Matveev, V.; Bylinkin, A.; Azarkin, M.; Dremin, I.; Leonidov, A.] Natl Res Nucl Univ Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Andreev, V.; Azarkin, M.; Dremin, I.; Kirakosyan, M.; Leonidov, A.; Mesyats, G.; Rusakov, S. V.] PN Lebedev Phys Inst, Moscow, Russia. [Katkov, I.; Baskakov, A.; Belyaev, A.; Boos, E.; Dubinin, M.; Dudko, L.; Ershov, A.; Gribushin, A.; Klyukhin, V.; Kodolova, O.; Lokhtin, I.; Myagkov, I.; Obraztsov, S.; Petrushanko, S.; Savrin, V.; Snigirev, A.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Azhgirey, I.; Bayshev, I.; Bitioukov, S.; Kachanov, V.; Kalinin, A.; Konstantinov, D.; Krychkine, V.; Petrov, V.; Ryutin, R.; Sobol, A.; Tourtchanovitch, L.; Troshin, S.; Tyurin, N.; Uzunian, A.; Volkov, A.] State Res Ctr Russian Federat, Inst High Energy Phys, Protvino, Russia. [Adzic, P.; Cirkovic, P.; Milosevic, J.; Rekovic, V.; Milenovic, P.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Adzic, P.; Cirkovic, P.; Milosevic, J.; Rekovic, V.; Milenovic, P.] Vinca Inst Nucl Sci, Belgrade, Serbia. [Alcaraz Maestre, J.; Calvo, E.; Cerrada, M.; Chamizo Llatas, M.; Colino, N.; De la cruz, B.; Delgado Peris, A.; Escalante Del Valle, A.; Fernandez Bedoya, C.; Fernandez Ramos, J. P.; Flix, J.; Fouz, M. C.; Garcia-Abia, P.; Gonzalez Lopez, O.; Goy Lopez, S.; Hernandez, J. M.; Josa, M. I.; Navarro De Martino, E.; Perez-Calero Yzquierdo, A.; Puerta Pelayo, J.; Quintario Olmeda, A.; Redondo, I.; Romero, L.; Santaolalla, J.; Soares, M. S.] CIEMAT, Madrid, Spain. [Albajar, C.; de Troconiz, J. F.; Missiroli, M.; Moran, D.] Univ Autonoma Madrid, Madrid, Spain. [Cuevas, J.; Fernandez Menendez, J.; Folgueras, S.; Gonzalez Caballero, I.; Palencia Cortezon, E.; Vizan Garcia, J. M.] Univ Oviedo, Oviedo, Spain. [Cabrillo, I. J.; Calderon, A.; Castineiras De Saa, J. R.; De Castro Manzano, P.; Fernandez, M.; Garcia-Ferrero, J.; Gomez, G.; Lopez Virto, A.; Marco, J.; Martinez Rivero, C.; Matorras, F.; Piedra Gomez, J.; Rodrigo, T.; Rodriguez-Marrero, A. Y.; Ruiz-Jimeno, A.; Scodellaro, L.; Trevisani, N.; Vila, I.; Vilar Cortabitarte, R.] Univ Cantabria, CSIC, Inst Fis Cantabria IFCA, Santander, Spain. [Merlin, J. A.; Pantaleo, F.; Hartmann, F.; Kornmayer, A.; Szillasi, Z.; Mohanty, A. K.; Silvestris, L.; Battilana, C.; Tosi, N.; Viliani, L.; Primavera, F.; Manzoni, R. A.; Di Guida, S.; Meola, S.; Paolucci, P.; Azzi, P.; Dall'Osso, M.; Pazzini, J.; Zucchetta, A.; Ciangottini, D.; Azzurri, P.; Donato, S.; D'imperio, G.; Del Re, D.; Traczyk, P.; Arcidiacono, R.; Finco, L.; Abbaneo, D.; Auffray, E.; Auzinger, G.; Bachtis, M.; Baillon, P.; Ball, A. H.; Barney, D.; Benaglia, A.; Bendavid, J.; Benhabib, L.; Benitez, J. F.; Berruti, G. M.; Bloch, P.; Bocci, A.; Bonato, A.; Botta, C.; Breuker, H.; Camporesi, T.; Castello, R.; Cerminara, G.; D'Alfonso, M.; d'Enterria, D.; Dabrowski, A.; Daponte, V.; David, A.; De Gruttola, M.; De Guio, F.; De Roeck, A.; De Visscher, S.; Di Marco, E.; Dobson, M.; Dordevic, M.; Dorney, B.; du Pree, T.; Duggan, D.; Dunser, M.; Dupont, N.; Elliott-Peisert, A.; Franzoni, G.; Fulcher, J.; Funk, W.; Gigi, D.; Gill, K.; Giordano, D.; Girone, M.; Glege, F.; Guida, R.; Gundacker, S.; Guthoff, M.; Hammer, J.; Harris, P.; Hegeman, J.; Innocente, V.; Janot, P.; Kirschenmann, H.; Kortelainen, M. J.; Kousouris, K.; Krajczar, K.; Lecoq, P.; Lourenco, C.; Lucchini, M. T.; Magini, N.; Malgeri, L.; Mannelli, M.; Martelli, A.; Masetti, L.; Meijers, F.; Mersi, S.; Meschi, E.; Moortgat, F.; Morovic, S.; Mulders, M.; Nemallapudi, M. V.; Neugebauer, H.; Orfanelli, S.; Orsini, L.; Pape, L.; Perez, E.; Peruzzi, M.; Petrilli, A.; Petrucciani, G.; Pfeiffer, A.; Pierini, M.; Piparo, D.; Racz, A.; Reis, T.; Rolandi, G.; Rovere, M.; Ruan, M.; Sakulin, H.; Schafer, C.; Schwick, C.; Seidel, M.; Sharma, A.; Silva, P.; Simon, M.; Sphicas, P.; Steggemann, J.; Stieger, B.; Stoye, M.; Takahashi, Y.; Treille, D.; Triossi, A.; Tsirou, A.; Veres, G. I.; Wardle, N.; Wohri, H. K.; Zagozdzinska, A.; Zeuner, W. D.] CERN, European Org Nucl Res, Geneva, Switzerland. [Bertl, W.; Deiters, K.; Erdmann, W.; Horisberger, R.; Ingram, Q.; Kaestli, H. C.; Kotlinski, D.; Langenegger, U.; Renker, D.; Rohe, T.] Paul Scherrer Inst, Villigen, Switzerland. [Bachmair, F.; Bani, L.; Bianchini, L.; Casal, B.; Dissertori, G.; Dittmar, M.; Donega, M.; Eller, P.; Grab, C.; Heidegger, C.; Hits, D.; Hoss, J.; Kasieczka, G.; Lustermann, W.; Mangano, B.; Marionneau, M.; del Arbol, P. Martinez Ruiz; Masciovecchio, M.; Meister, D.; Micheli, F.; Musella, P.; Nessi-Tedaldi, F.; Pandolfi, F.; Pata, J.; Pauss, F.; Perrozzi, L.; Quittnat, M.; Rossini, M.; Schonenberger, M.; Starodumov, A.; Takahashi, M.; Tavolaro, V. R.; Theofilatos, K.; Wallny, R.] ETH, Inst Particle Phys, Zurich, Switzerland. [Aarrestad, T. K.; Amsler, C.; Caminada, L.; Canelli, M. F.; Chiochia, V.; De Cosa, A.; Galloni, C.; Hinzmann, A.; Hreus, T.; Kilminster, B.; Lange, C.; Ngadiuba, J.; Pinna, D.; Rauco, G.; Robmann, P.; Ronga, F. J.; Salerno, D.; Yang, Y.] Univ Zurich, Zurich, Switzerland. [Cardaci, M.; Chen, K. H.; Doan, T. H.; Jain, Sh.; Khurana, R.; Konyushikhin, M.; Kuo, C. M.; Lin, W.; Lu, Y. J.; Pozdnyakov, A.; Yu, S. S.] Natl Cent Univ, Chungli, Taiwan. [Arun Kumar; Bartek, R.; Chang, P.; Chang, Y. H.; Chang, Y. W.; Chao, Y.; Chen, K. F.; Chen, P. H.; Dietz, C.; Fiori, F.; Grundler, U.; Hou, W. -S.; Hsiung, Y.; Liu, Y. F.; Lu, R. -S.; Moya, M. Minano; Petrakou, E.; Tsai, J. F.; Tzeng, Y. M.] Natl Taiwan Univ, Taipei, Taiwan. [Asavapibhop, B.; Kovitanggoon, K.; Singh, G.; Srimanobhas, N.; Suwonjandee, N.] Chulalongkorn Univ, Fac Sci, Dept Phys, Bangkok, Thailand. [Adiguzel, A.; Bakirci, M. N.; Demiroglu, Z. S.; Dozen, C.; Gecit, F. H.; Girgis, S.; Gokbulut, G.; Guler, Y.; Gurpinar, E.; Hos, I.; Kangal, E. E.; Topaksu, A. Kayis; Onengut, G.; Ozcan, M.; Ozdemir, K.; Ozturk, S.; Cerci, D. Sunar; Tali, B.; Topakli, H.; Vergili, M.; Zorbilmez, C.] Cukurova Univ, Adana, Turkey. [Akin, I. V.; Bilin, B.; Bilmis, S.; Isildak, B.; Karapinar, G.; Yalvac, M.; Zeyrek, M.] Middle East Tech Univ, Dept Phys, Ankara, Turkey. [Gulmez, E.; Kaya, M.; Kaya, O.; Yetkin, E. A.; Yetkin, T.] Bogazici Univ, Istanbul, Turkey. [Cakir, A.; Cankocak, K.; Sen, S.; Vardarli, F. I.] Istanbul Tech Univ, Istanbul, Turkey. [Grynyov, B.] Natl Acad Sci Ukraine, Inst Scintillat Mat, Kharkov, Ukraine. [Levchuk, L.; Sorokin, P.] Kharkov Inst Phys & Technol, Natl Sci Ctr, Kharkov, Ukraine. [Aggleton, R.; Ball, F.; Beck, L.; Brooke, J. J.; Clement, E.; Cussans, D.; Flacher, H.; Goldstein, J.; Grimes, M.; Heath, G. P.; Heath, H. F.; Jacob, J.; Kreczko, L.; Lucas, C.; Meng, Z.; Newbold, D. M.; Paramesvaran, S.; Poll, A.; Sakuma, T.; El Nasr-storey, S. Seif; Senkin, S.; Smith, D.; Smith, V. J.] Univ Bristol, Bristol, Avon, England. [Belyaev, A.; Newbold, D. M.; Bell, K. W.; Brew, C.; Brown, R. M.; Calligaris, L.; Cieri, D.; Cockerill, D. J. A.; Coughlan, J. A.; Harder, K.; Harper, S.; Olaiya, E.; Petyt, D.; Shepherd-Themistocleous, C. H.; Thea, A.; Tomalin, I. R.; Williams, T.; Worm, S. D.; Lucas, R.] Rutherford Appleton Lab, Didcot, Oxon, England. [Baber, M.; Bainbridge, R.; Buchmuller, O.; Bundock, A.; Burton, D.; Casasso, S.; Citron, M.; Colling, D.; Corpe, L.; Dauncey, P.; Davies, G.; De Wit, A.; Della Negra, M.; Dunne, P.; Elwood, A.; Futyan, D.; Hall, G.; Iles, G.; Lane, R.; Lucas, R.; Lyons, L.; Magnan, A. -M.; Malik, S.; Nash, J.; Nikitenko, A.; Pela, J.; Pesaresi, M.; Petridis, K.; Raymond, D. M.; Richards, A.; Rose, A.; Seez, C.; Tapper, A.; Uchida, K.; Acosta, M. Vazquez; Virdee, T.] Imperial Coll, London, England. [Cole, J. E.; Hobson, P. R.; Khan, A.; Kyberd, P.; Leggat, D.; Leslie, D.; Reid, I. D.; Symonds, P.; Teodorescu, L.; Turner, M.] Brunel Univ, Uxbridge, Middx, England. [Borzou, A.; Call, K.; Dittmann, J.; Hatakeyama, K.; Liu, H.; Pastika, N.] Baylor Univ, Waco, TX 76798 USA. [Charaf, O.; Cooper, S. I.; Henderson, C.; Rumerio, P.] Univ Alabama, Tuscaloosa, AL USA. [Arcaro, D.; Avetisyan, A.; Bose, T.; Fantasia, C.; Gastler, D.; Lawson, P.; Rankin, D.; Richardson, C.; Rohlf, J.; St John, J.; Sulak, L.; Zou, D.] Boston Univ, Boston, MA 02215 USA. [Bhattacharya, S.; Alimena, J.; Berry, E.; Cutts, D.; Ferapontov, A.; Garabedian, A.; Hakala, J.; Heintz, U.; Laird, E.; Landsberg, G.; Mao, Z.; Narain, M.; Sagir, S.; Syarif, R.] Brown Univ, Providence, RI 02912 USA. [Chauhan, S.; Breedon, R.; Breto, G.; Sanchez, M. Calderon De la Barca; Chertok, M.; Conway, J.; Conway, R.; Cox, P. T.; Erbacher, R.; Funk, G.; Gardner, M.; Ko, W.; Lander, R.; Mclean, C.; Mulhearn, M.; Pellett, D.; Pilot, J.; Ricci-Tam, F.; Shalhout, S.; Smith, J.; Squires, M.; Stolp, D.; Tripathi, M.; Wilbur, S.; Yohay, R.] Univ Calif Davis, Davis, CA 95616 USA. [Weber, M.; Cousins, R.; Everaerts, P.; Florent, A.; Hauser, J.; Ignatenko, M.; Saltzberg, D.; Takasugi, E.; Valuev, V.] Univ Calif Los Angeles, Los Angeles, CA USA. [Burt, K.; Clare, R.; Ellison, J.; Gary, J. W.; Hanson, G.; Heilman, J.; Paneva, M. Ivova; Jandir, P.; Kennedy, E.; Lacroix, F.; Long, O. R.; Luthra, A.; Malberti, M.; Negrete, M. Olmedo; Shrinivas, A.; Wei, H.; Wimpenny, S.; Yates, B. R.] Univ Calif Riverside, Riverside, CA 92521 USA. [Sharma, V.; Branson, J. G.; Cerati, G. B.; Cittolin, S.; D'Agnolo, R. T.; Derdzinski, M.; Holzner, A.; Kelley, R.; Klein, D.; Letts, J.; Macneill, I.; Olivito, D.; Padhi, S.; Pieri, M.; Sani, M.; Simon, S.; Tadel, M.; Vartak, A.; Wasserbaech, S.; Welke, C.; Wurthwein, F.; Yagil, A.; Della Porta, G. Zevi] Univ Calif San Diego, La Jolla, CA 92093 USA. [Bradmiller-Feld, J.; Campagnari, C.; Dishaw, A.; Dutta, V.; Flowers, K.; Sevilla, M. Franco; Geffert, P.; George, C.; Golf, F.; Gouskos, L.; Gran, J.; Incandela, J.; Mccoll, N.; Mullin, S. D.; Richman, J.; Stuart, D.; Suarez, I.; West, C.; Yoo, J.] Univ Calif Santa Barbara, Santa Barbara, CA 93106 USA. [Dubinin, M.; Anderson, D.; Apresyan, A.; Bornheim, A.; Bunn, J.; Chen, Y.; Duarte, J.; Mott, A.; Newman, H. B.; Pena, C.; Spiropulu, M.; Vlimant, J. R.; Xie, S.; Zhu, R. Y.] CALTECH, Pasadena, CA 91125 USA. [Andrews, M. B.; Azzolini, V.; Calamba, A.; Carlson, B.; Ferguson, T.; Paulini, M.; Russ, J.; Sun, M.; Vogel, H.; Vorobiev, I.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Cumalat, J. P.; Ford, W. T.; Gaz, A.; Jensen, F.; Johnson, A.; Krohn, M.; Mulholland, T.; Nauenberg, U.; Stenson, K.; Wagner, S. R.] Univ Colorado, Boulder, CO 80309 USA. [Alexander, J.; Chatterjee, A.; Chaves, J.; Chu, J.; Dittmer, S.; Eggert, N.; Mirman, N.; Kaufman, G. Nicolas; Patterson, J. R.; Rinkevicius, A.; Ryd, A.; Skinnari, L.; Soffi, L.; Sun, W.; Tan, S. M.; Teo, W. D.; Thom, J.; Thompson, J.; Tucker, J.; Weng, Y.; Wittich, P.] Cornell Univ, Ithaca, NY USA. [Banerjee, S.; Abdullin, S.; Albrow, M.; Apollinari, G.; Bauerdick, L. A. T.; Beretvas, A.; Berryhill, J.; Bhat, P. C.; Bolla, G.; Burkett, K.; Butler, J. N.; Cheung, H. W. K.; Chlebana, F.; Cihangir, S.; Elvira, V. D.; Fisk, I.; Freeman, J.; Gottschalk, E.; Gray, L.; Green, D.; Grunendahl, S.; Gutsche, O.; Hanlon, J.; Hare, D.; Harris, R. M.; Hasegawa, S.; Hirschauer, J.; Hu, Z.; Jayatilaka, B.; Jindariani, S.; Johnson, M.; Joshi, U.; Klima, B.; Kreis, B.; Lammel, S.; Linacre, J.; Lincoln, D.; Lipton, R.; Liu, T.; De Sa, R. Lopes; Lykken, J.; Maeshima, K.; Marraffino, J. M.; Maruyama, S.; Mason, D.; McBride, P.; Merkel, P.; Mishra, K.; Mrenna, S.; Nahn, S.; Newman-Holmes, C.; O'Dell, V.; Pedro, K.; Prokofyev, O.; Rakness, G.; Sexton-Kennedy, E.; Soha, A.; Spalding, W. J.; Spiegel, L.; Strobbe, N.; Taylor, L.; Tkaczyk, S.; Tran, N. V.; Uplegger, L.; Vaandering, E. W.; Vernieri, C.; Verzocchi, M.; Vidal, R.; Weber, H. A.; Whitbeck, A.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Acosta, D.; Avery, P.; Bortignon, P.; Bourilkov, D.; Carnes, A.; Carver, M.; Curry, D.; Das, S.; Field, R. D.; Furic, I. K.; Gleyzer, S. V.; Konigsberg, J.; Korytov, A.; Kotov, K.; Ma, P.; Matchev, K.; Mei, H.; Milenovic, P.; Mitselmakher, G.; Rank, D.; Rossin, R.; Shchutska, L.; Snowball, M.; Sperka, D.; Terentyev, N.; Thomas, L.; Wang, J.; Wang, S.; Yelton, J.] Univ Florida, Gainesville, FL USA. [Hewamanage, S.; Linn, S.; Markowitz, P.; Martinez, G.; Rodriguez, J. L.] Florida Int Univ, Miami, FL 33199 USA. [Ackert, A.; Adams, J. R.; Adams, T.; Askew, A.; Bein, S.; Bochenek, J.; Diamond, B.; Haas, J.; Hagopian, S.; Hagopian, V.; Johnson, K. F.; Khatiwada, A.; Prosper, H.; Weinberg, M.] Florida State Univ, Tallahassee, FL 32306 USA. [Baarmand, M. M.; Bhopatkar, V.; Colafranceschi, S.; Hohlmann, M.; Kalakhety, H.; Noonan, D.; Roy, T.; Yumiceva, F.] Florida Inst Technol, Melbourne, FL 32901 USA. [Adams, M. R.; Apanasevich, L.; Berry, D.; Betts, R. R.; Bucinskaite, I.; Cavanaugh, R.; Evdokimov, O.; Gauthier, L.; Gerber, C. E.; Hofman, D. J.; Kurt, P.; O'Brien, C.; Gonzalez, I. D. Sandoval; Turner, P.; Varelas, N.; Wu, Z.; Zakaria, M.] Univ Illinois, Chicago, IL USA. [Bilki, B.; Clarida, W.; Dilsiz, K.; Durgut, S.; Gandrajula, R. P.; Haytmyradov, M.; Khristenko, V.; Merlo, J. -P.; Mermerkaya, H.; Mestvirishvili, A.; Moeller, A.; Nachtman, J.; Ogul, H.; Onel, Y.; Penzo, A.; Snyder, C.; Tiras, E.; Wetzel, J.; Yi, K.] Univ Iowa, Iowa City, IA USA. [Anderson, I.; Barnett, B. A.; Blumenfeld, B.; Eminizer, N.; Fehling, D.; Feng, L.; Gritsan, A. V.; Maksimovic, P.; Martin, C.; Osherson, M.; Roskes, J.; Sady, A.; Sarica, U.; Swartz, M.; Xiao, M.; Xin, Y.; You, C.] Johns Hopkins Univ, Baltimore, MD USA. [Baringer, P.; Bean, A.; Benelli, G.; Bruner, C.; Kenny, R. P., III; Majumder, D.; Malek, M.; Murray, M.; Sanders, S.; Stringer, R.; Wang, Q.] Univ Kansas, Lawrence, KS 66045 USA. [Ivanov, A.; Kaadze, K.; Khalil, S.; Makouski, M.; Maravin, Y.; Mohammadi, A.; Saini, L. K.; Skhirtladze, N.; Toda, S.] Kansas State Univ, Manhattan, KS 66506 USA. [Lange, D.; Rebassoo, F.; Wright, D.] Lawrence Livermore Natl Lab, Livermore, CA USA. [Anelli, C.; Baden, A.; Baron, O.; Calvert, B.; Eno, S. C.; Ferraioli, C.; Gomez, J. A.; Hadley, N. J.; Jabeen, S.; Kellogg, R. G.; Kolberg, T.; Kunkle, J.; Lu, Y.; Mignerey, A. C.; Shin, Y. H.; Skuja, A.; Tonjes, M. B.; Tonwar, S. C.] Univ Maryland, College Pk, MD 20742 USA. [Wang, J.; Apyan, A.; Barbieri, R.; Baty, A.; Bierwagen, K.; Brandt, S.; Busza, W.; Cali, I. A.; Demiragli, Z.; Di Matteo, L.; Ceballos, G. Gomez; Goncharov, M.; Gulhan, D.; Iiyama, Y.; Innocenti, G. M.; Klute, M.; Kovalskyi, D.; Lai, Y. S.; Lee, Y. -J.; Levin, A.; Luckey, P. D.; Marini, A. C.; Mcginn, C.; Mironov, C.; Narayanan, S.; Niu, X.; Paus, C.; Roland, C.; Roland, G.; Salfeld-Nebgen, J.; Stephans, G. S. F.; Sumorok, K.; Varma, M.; Velicanu, D.; Veverka, J.; Wang, T. W.; Wyslouch, B.; Yang, M.; Zhukova, V.] MIT, Cambridge, MA 02139 USA. [Dahmes, B.; Evans, A.; Finkel, A.; Gude, A.; Hansen, P.; Kalafut, S.; Kao, S. C.; Klapoetke, K.; Kubota, Y.; Lesko, Z.; Mans, J.; Nourbakhsh, S.; Ruckstuhl, N.; Rusack, R.; Tambe, N.; Turkewitz, J.] Univ Minnesota, Minneapolis, MN USA. [Acosta, J. G.; Oliveros, S.] Univ Mississippi, University, MS 38677 USA. [Avdeeva, E.; Bloom, K.; Bose, S.; Claes, D. R.; Dominguez, A.; Fangmeier, C.; Suarez, R. Gonzalez; Kamalieddin, R.; Knowlton, D.; Kravchenko, I.; Meier, F.; Monroy, J.; Ratnikov, F.; Siado, J. E.; Snow, G. R.] Univ Nebraska, Lincoln, NE USA. [Kumar, A.; Alyari, M.; Dolen, J.; George, J.; Godshalk, A.; Harrington, C.; Iashvili, I.; Kaisen, J.; Kharchilava, A.; Rappoccio, S.; Roozbahani, B.] SUNY Buffalo, Buffalo, NY USA. [Alverson, G.; Barberis, E.; Baumgartel, D.; Chasco, M.; Hortiangtham, A.; Massironi, A.; Morse, D. M.; Nash, D.; Orimoto, T.; De Lima, R. Teixeira; Trocino, D.; Wang, R. -J.; Zhang, J.] Northeastern Univ, Boston, MA 02115 USA. [Hahn, K. A.; Kubik, A.; Low, J. F.; Mucia, N.; Odell, N.; Pollack, B.; Schmitt, M.; Stoynev, S.; Sung, K.; Trovato, M.; Velasco, M.] Northwestern Univ, Evanston, IL USA. [Brinkerhoff, A.; Dev, N.; Hildreth, M.; Jessop, C.; Karmgard, D. J.; Kellams, N.; Lannon, K.; Marinelli, N.; Meng, F.; Mueller, C.; Musienko, Y.; Planer, M.; Reinsvold, A.; Ruchti, R.; Smith, G.; Taroni, S.; Valls, N.; Wayne, M.; Wolf, M.; Woodard, A.] Univ Notre Dame, Notre Dame, IN 46556 USA. [Antonelli, L.; Brinson, J.; Bylsma, B.; Durkin, L. S.; Flowers, S.; Hart, A.; Hill, C.; Hughes, R.; Ji, W.; Ling, T. Y.; Liu, B.; Luo, W.; Puigh, D.; Rodenburg, M.; Winer, B. L.; Wulsin, H. W.] Ohio State Univ, Columbus, OH 43210 USA. [Driga, O.; Elmer, P.; Hardenbrook, J.; Hebda, P.; Koay, S. A.; Lujan, P.; Marlow, D.; Medvedeva, T.; Mooney, M.; Olsen, J.; Palmer, C.; Piroue, P.; Saka, H.; Stickland, D.; Tully, C.; Zuranski, A.] Princeton Univ, Princeton, NJ 08544 USA. [Malik, S.] Univ Puerto Rico, Mayaguez, PR USA. [Savoy-Navarro, A.; Barker, A.; Barnes, V. E.; Benedetti, D.; Bortoletto, D.; Gutay, L.; Jha, M. K.; Jones, M.; Jung, A. W.; Jung, K.; Miller, D. H.; Neumeister, N.; Radburn-Smith, B. C.; Shipsey, I.; Sun, J.; Svyatkovskiy, A.; Wang, F.; Xie, W.; Xu, L.] Purdue Univ, W Lafayette, IN 47907 USA. [Parashar, N.; Stupak, J.] Purdue Univ Calumet, Hammond, LA USA. [Adair, A.; Akgun, B.; Chen, Z.; Ecklund, K. M.; Geurts, F. J. M.; Guilbaud, M.; Li, W.; Michlin, B.; Northup, M.; Padley, B. P.; Redjimi, R.; Roberts, J.; Rorie, J.; Tu, Z.; Zabel, J.] Rice Univ, Houston, TX USA. [Betchart, B.; Bodek, A.; Debarbaro, P.; Demina, R.; Eshaq, Y.; Ferbel, T.; Galanti, M.; Garcia-Bellido, A.; Han, J.; Harel, A.; Hindrichs, O.; Khukhunaishvili, A.; Petrillo, G.; Tan, P.; Verzetti, M.] Univ Rochester, Rochester, NY 14627 USA. [Arora, S.; Chou, J. P.; Contreras-Campana, C.; Contreras-Campana, E.; Ferencek, D.; Gershtein, Y.; Gray, R.; Halkiadakis, E.; Hidas, D.; Hughes, E.; Kaplan, S.; Elayavalli, R. Kunnawalkam; Lath, A.; Nash, K.; Panwalkar, S.; Park, M.; Salur, S.; Schnetzer, S.; Sheffield, D.; Somalwar, S.; Stone, R.; Thomas, S.; Thomassen, P.; Walker, M.] Rutgers State Univ, Piscataway, NJ USA. [Foerster, M.; Riley, G.; Rose, K.; Spanier, S.] Univ Tennessee, Knoxville, TN USA. [Rose, A.; Bouhali, O.; Hernandez, A. Castaneda; Celik, A.; Dalchenko, M.; De Mattia, M.; Delgado, A.; Dildick, S.; Eusebi, R.; Gilmore, J.; Huang, T.; Kamon, T.; Krutelyov, V.; Mueller, R.; Osipenkov, I.; Pakhotin, Y.; Patel, R.; Perloff, A.; Safonov, A.; Tatarinov, A.; Ulmer, K. A.] Texas A&M Univ, College Stn, TX USA. [Akchurin, N.; Cowden, C.; Damgov, J.; Dragoiu, C.; Dudero, P. R.; Faulkner, J.; Kunori, S.; Lamichhane, K.; Lee, S. W.; Libeiro, T.; Undleeb, S.; Volobouev, I.] Texas Tech Univ, Lubbock, TX 79409 USA. [Mao, Y.; Appelt, E.; Delannoy, A. G.; Greene, S.; Gurrola, A.; Janjam, R.; Johns, W.; Maguire, C.; Melo, A.; Ni, H.; Sheldon, P.; Snook, B.; Tuo, S.; Velkovska, J.; Xu, Q.] Vanderbilt Univ, 221 Kirkland Hall, Nashville, TN 37235 USA. [Arenton, M. W.; Cox, B.; Francis, B.; Goodell, J.; Hirosky, R.; Ledovskoy, A.; Li, H.; Lin, C.; Neu, C.; Sinthuprasith, T.; Sun, X.; Wang, Y.; Wolfe, E.; Wood, J.; Xia, F.] Univ Virginia, Charlottesville, VA USA. [Clarke, C.; Harr, R.; Karchin, P. E.; Don, C. Kottachchi Kankanamge; Lamichhane, P.; Sturdy, J.] Wayne State Univ, Detroit, MI USA. [Sharma, A.; Belknap, D. A.; Carlsmith, D.; Cepeda, M.; Dasu, S.; Dodd, L.; Duric, S.; Gomber, B.; Grothe, M.; Hall-Wilton, R.; Herndon, M.; Herve, A.; Klabbers, P.; Lanaro, A.; Levine, A.; Long, K.; Loveless, R.; Mohapatra, A.; Ojalvo, I.; Perry, T.; Pierro, G. A.; Polese, G.; Ruggles, T.; Sarangi, T.; Savin, A.; Smith, N.; Smith, W. H.; Taylor, D.; Woods, N.] Univ Wisconsin, Madison, WI USA. [Fruehwirth, R.; Jeitler, M.; Krammer, M.; Schieck, J.; Wulz, C. -E.] Vienna Univ Technol, Vienna, Austria. [Chinellato, J.; Tonelli Manganote, E. J.] Univ Estadual Campinas, Campinas, SP, Brazil. [Moon, C. S.] CNRS, IN2P3, Paris, France. [Abdelalim, A. A.; Mahrous, A.] Helwan Univ, Cairo, Egypt. [Abdelalim, A. A.] Zewail City Sci & Technol, Zewail, Egypt. [Radi, A.] British Univ Egypt, Cairo, Egypt. [Radi, A.] Ain Shams Univ, Cairo, Egypt. [Agram, J. -L.; Conte, E.; Fontaine, J. -C.] Univ Haute Alsace, Mulhouse, France. [Karacheban, O.; Lohmann, W.; Marfin, I.] Brandenburg Tech Univ Cottbus, Cottbus, Germany. [Vesztergombi, G.; Veres, G. I.] Eotvos Lorand Univ, Budapest, Hungary. [Choudhury, S.] Indian Inst Sci Educ & Res, Bhopal, India. [Bhowmik, S.; Maity, M.; Sarkar, T.] Visva Bharati Univ, Santini Ketan, W Bengal, India. [Gurtu, A.] King Abdulaziz Univ, Jeddah, Saudi Arabia. [Wickramage, N.] Univ Ruhuna, Matara, Sri Lanka. [Etesami, S. M.] Isfahan Univ Technol, Esfahan, Iran. [Fahim, A.] Univ Tehran, Dept Engn Sci, Tehran, Iran. [Safarzadeh, B.] Islamic Azad Univ, Plasma Phys Res Ctr, Sci & Res Branch, Tehran, Iran. [Androsov, K.; Ciocci, M. A.; Grippo, M. T.] Univ Siena, Siena, Italy. [Kim, T. J.] Hanyang Univ, Seoul, South Korea. [Ali, M. A. B. Md] Int Islamic Univ Malaysia, Kuala Lumpur, Malaysia. [Idris, F. Mohamad] MOSTI, Malaysian Nucl Agcy, Kajang, Malaysia. [Heredia-De La Cruz, I.] Consejo Nacl Ciencia & Technol, Mexico City, DF, Mexico. [Byszuk, A.; Zagozdzinska, A.] Warsaw Univ Technol, Inst Elect Syst, Warsaw, Poland. [Kim, V.] St Petersburg State Polytech Univ, St Petersburg, Russia. [Adzic, P.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Orfanelli, S.] Natl Tech Univ Athens, Athens, Greece. [Rolandi, G.] Scuola Normale & Sez INFN, Pisa, Italy. [Amsler, C.] Albert Einstein Ctr Fundamental Phys, Bern, Switzerland. [Bakirci, M. N.; Ozturk, S.; Topakli, H.] Gaziosmanpasa Univ, Tokat, Turkey. [Kangal, E. E.] Mersin Univ, Mersin, Turkey. [Onengut, G.] Cag Univ, Mersin, Turkey. [Ozdemir, K.] Piri Reis Univ, Istanbul, Turkey. [Cerci, D. Sunar; Tali, B.] Adiyaman Univ, Adiyaman, Turkey. [Isildak, B.] Ozyegin Univ, Istanbul, Turkey. [Karapinar, G.] Izmir Inst Technol, Izmir, Turkey. [Kaya, M.] Marmara Univ, Istanbul, Turkey. [Kaya, O.] Kafkas Univ, Kars, Turkey. [Yetkin, E. A.; Ozok, F.] Mimar Sinan Univ, Istanbul, Turkey. [Yetkin, T.] Yildiz Tech Univ, Istanbul, Turkey. [Sen, S.] Hacettepe Univ, Ankara, Turkey. [Belyaev, A.] Univ Southampton, Sch Phys & Astron, Southampton, Hants, England. [Acosta, M. Vazquez] Inst Astrofis Canarias, San Cristobal la Laguna, Spain. [Wasserbaech, S.] Utah Valley Univ, Orem, UT USA. [Colafranceschi, S.] Univ Rome, Fac Ingn, Rome, Italy. [Bilki, B.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Mermerkaya, H.] Erzincan Univ, Erzincan, Turkey. [Bouhali, O.; Hernandez, A. Castaneda] Texas A&M Univ Qatar, Doha, Qatar. RP Khachatryan, V (reprint author), Yerevan Phys Inst, Yerevan, Armenia. RI Fernandez Menendez, Javier/B-6550-2014; Della Ricca, Giuseppe/B-6826-2013; Lokhtin, Igor/D-7004-2012; TUVE', Cristina/P-3933-2015; Goh, Junghwan/Q-3720-2016; Konecki, Marcin/G-4164-2015 OI Fernandez Menendez, Javier/0000-0002-5213-3708; Della Ricca, Giuseppe/0000-0003-2831-6982; TUVE', Cristina/0000-0003-0739-3153; Goh, Junghwan/0000-0002-1129-2083; Konecki, Marcin/0000-0001-9482-4841 FU BMWFW (Austria); FWF (Austria); FNRS (Belgium); FWO (Belgium); CNPq, (Brazil); CAPES, (Brazil); FAPERJ, (Brazil); FAPESP (Brazil); MES (Bulgaria); CERN; CAS, (China); MOST, (China); NSFC (China); COLCIENCIAS (Colombia); MSES (Croatia); CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER, (Estonia); ERC IUT (Estonia); ERDF (Estonia); Academy of Finland; MEC (Finland); HIP (Finland); CEA (France); CNRS/IN2P3 (France); BMBF, (Germany); DFG, (Germany); HGF (Germany); GSRT (Greece); OTKA (Hungary); NIH (Hungary); DAE (India); DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP (Republic of Korea); NRF (Republic of Korea); LAS (Lithuania); MOE (Malaysia); UM (Malaysia); BUAP, (Mexico); CINVESTAV, (Mexico); CONACYT, (Mexico); LNS, (Mexico); SEP, (Mexico); UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE (Poland); NSC (Poland); FCT (Portugal); JINR (Dubna); MON, (Russia); RosAtom, (Russia); RAS (Russia); RFBR (Russia); MESTD (Serbia); SEIDI (Spain); CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter (Thailand); IPST, (Thailand); STAR (Thailand); NSTDA (Thailand); TUBITAK (Turkey); TAEK (Turkey); NASU (Ukraine); SFFR (Ukraine); STFC (United Kingdom); DOE (USA); NSF (USA); Marie-Curie programme; European Research Council; EPLANET (European Union); Leventis Foundation; Alfred P. Sloan Foundation; Alexander von Humboldt Foundation; Belgian Federal Science Policy Office; Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; Council of Science and Industrial Research, India; HOMING PLUS programme of the Foundation for Polish Science; European Union; Regional Development Fund; Mobility Plus programme of the Ministry of Science and Higher Education; OPUS programme [2014/13/B/ST2/02543]; National Science Center (Poland) [Sonata-bis DEC-2012/07/E/ST2/01406]; Thalis and Aristeia programmes - EU-ESF; Greek NSRF; National Priorities Research Program by Qatar National Research Fund; Programa Clarin-COFUND del Principado de Asturias; Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University; Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); Welch Foundation [C-1845] FX We congratulate our colleagues in the CERN accelerator departments for the excellent performance of the LHC and thank the technical and administrative staffs at CERN and at other CMS institutes for their contributions to the success of the CMS effort. In addition, we gratefully acknowledge the computing centres and personnel of the Worldwide LHC Computing Grid for delivering so effectively the computing infrastructure essential to our analyses. Finally, we acknowledge the enduring support for the construction and operation of the LHC and the CMS detector provided by the following funding agencies: BMWFW and FWF (Austria); FNRS and FWO (Belgium); CNPq, CAPES, FAPERJ, and FAPESP (Brazil); MES (Bulgaria); CERN; CAS, MOST, and NSFC (China); COLCIENCIAS (Colombia); MSES and CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER, ERC IUT and ERDF (Estonia); Academy of Finland, MEC, and HIP (Finland); CEA and CNRS/IN2P3 (France); BMBF, DFG, and HGF (Germany); GSRT (Greece); OTKA and NIH (Hungary); DAE and DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP and NRF (Republic of Korea); LAS (Lithuania); MOE and UM (Malaysia); BUAP, CINVESTAV, CONACYT, LNS, SEP, and UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE and NSC (Poland); FCT (Portugal); JINR (Dubna); MON, RosAtom, RAS and RFBR (Russia); MESTD (Serbia); SEIDI and CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter, IPST, STAR and NSTDA (Thailand); TUBITAK and TAEK (Turkey); NASU and SFFR (Ukraine); STFC (United Kingdom); DOE and NSF (USA).; Individuals have received support from the Marie-Curie programme and the European Research Council and EPLANET (European Union); the Leventis Foundation; the Alfred P. Sloan Foundation; the Alexander von Humboldt Foundation; the Belgian Federal Science Policy Office; the Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); the Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); the Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; the Council of Science and Industrial Research, India; the HOMING PLUS programme of the Foundation for Polish Science, cofinanced from European Union, Regional Development Fund, the Mobility Plus programme of the Ministry of Science and Higher Education, the OPUS programme contract 2014/13/B/ST2/02543 and contract Sonata-bis DEC-2012/07/E/ST2/01406 of the National Science Center (Poland); the Thalis and Aristeia programmes cofinanced by EU-ESF and the Greek NSRF; the National Priorities Research Program by Qatar National Research Fund; the Programa Clarin-COFUND del Principado de Asturias; the Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University and the Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); and the Welch Foundation, contract C-1845. NR 83 TC 1 Z9 1 U1 6 U2 6 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0370-2693 EI 1873-2445 J9 PHYS LETT B JI Phys. Lett. B PD DEC 10 PY 2016 VL 763 BP 472 EP 500 DI 10.1016/j.physletb.2016.09.062 PG 29 WC Astronomy & Astrophysics; Physics, Nuclear; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EF2AM UT WOS:000390126600068 ER PT J AU Hall, DM Beck, JR Brand, E Ziomek-Moroz, M Lvov, SN AF Hall, Derek M. Beck, Justin R. Brand, Edward Ziomek-Moroz, Margaret Lvov, Serguei N. TI Copper-Copper Sulfate Reference Electrode for Operating in High Temperature and High Pressure Aqueous Environments SO ELECTROCHIMICA ACTA LA English DT Article DE copper-copper sulfate electrode; high temperature and high pressure; aqueous solutions; Gibbs energy minimization; reference electrode ID PH AB A copper-copper sulfate electrode (CSE) was constructed and tested at elevated temperatures. Experimental cell potentials versus a silver-silver chloride electrode were compared against results from Gibbs energy minimization (GEM) calculations. After accounting for irreversible thermodynamic processes, experimental and calculated CSE potentials, were generally within 3% of the observed potential from 25 to 150 degrees C at 3 MPa. The CSE potentials changed by less than 20 mV with increasing temperature, compared to 120 mV for the silver-silver chloride electrode. With its repeatability and small temperature dependence, the CSE electrode appears to be a viable reference electrode for measuring in situ real time cell potentials in aqueous phase-containing media at elevated temperature and pressure. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Hall, Derek M.; Beck, Justin R.; Brand, Edward; Lvov, Serguei N.] Penn State Univ, EMS Energy Inst, University Pk, PA 16802 USA. [Brand, Edward; Lvov, Serguei N.] Penn State Univ, Dept Energy & Mineral Engn, University Pk, PA 16802 USA. [Lvov, Serguei N.] Penn State Univ, Dept Mat Sci & Engn, University Pk, PA 16802 USA. [Ziomek-Moroz, Margaret] US DOE, Natl Energy Technol Lab, 1450 Queen Ave SW, Albany, OR 97321 USA. RP Lvov, SN (reprint author), Penn State Univ, EMS Energy Inst, University Pk, PA 16802 USA.; Ziomek-Moroz, M (reprint author), US DOE, Natl Energy Technol Lab, 1450 Queen Ave SW, Albany, OR 97321 USA. EM Margaret.Ziomek-Moroz@NETL.DOE.GOV; Ivov@psu.edu NR 20 TC 0 Z9 0 U1 5 U2 5 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0013-4686 EI 1873-3859 J9 ELECTROCHIM ACTA JI Electrochim. Acta PD DEC 10 PY 2016 VL 221 BP 96 EP 106 DI 10.1016/j.electacta.2016.10.143 PG 11 WC Electrochemistry SC Electrochemistry GA EG0UB UT WOS:000390746600013 ER PT J AU Becerra, L Bianco, CL Fryer, CL Rueda, JA Ruffini, R AF Becerra, L. Bianco, C. L. Fryer, C. L. Rueda, J. A. Ruffini, R. TI ON THE INDUCED GRAVITATIONAL COLLAPSE SCENARIO OF GAMMA-RAY BURSTS ASSOCIATED WITH SUPERNOVAE SO ASTROPHYSICAL JOURNAL LA English DT Article DE accretion, accretion disks; stars: black holes; gamma-ray burst: general; stars: neutron; supernovae: general ID NEUTRINO ENERGY-LOSS; AXIAL-VECTOR CONTRIBUTION; BINARY-DRIVEN HYPERNOVAE; STELLAR INTERIORS; PAIR BREMSSTRAHLUNG; DENSE STARS; BLACK-HOLE; HYPERCRITICAL ACCRETION; IB/C SUPERNOVAE; LIGHT CURVES AB Following the induced gravitational collapse (IGC) paradigm of gamma-ray bursts (GRBs) associated with type Ib/c supernovae, we present numerical simulations of the explosion of a carbon-oxygen (CO) core in a binary system with a neutron-star (NS) companion. The supernova ejecta trigger a hypercritical accretion process onto the NS thanks to a copious neutrino emission and the trapping of photons within the accretion flow. We show that temperatures of 1-10. MeV develop near the NS surface, hence electron-positron annihilation into neutrinos becomes the main cooling channel leading to accretion rates of 10(-9)-10(-1) M-circle dot s(-1) and neutrino luminosities of 10(43)-10(52). erg s(-1) (the shorter the orbital period the higher the accretion rate). We estimate the maximum orbital period, P-max, as a function of the NS initial mass, up to which the NS companion can reach by hypercritical accretion the critical mass for gravitational collapse leading to black hole formation. We then estimate the effects of the accreting and orbiting NS companion onto a novel geometry of the supernova ejecta density profile. We present the results of a 1.4 x 10(7) particle simulation which show that the NS induces accentuated asymmetries in the ejecta density around the orbital plane. We elaborate on the observables associated with the above features of the IGC process. We apply this framework to specific GRBs: we find that X-ray flashes (XRFs) and binary-driven hypernovae are produced in binaries with P > P-max and P < P-max, respectively. We analyze in detail the case of XRF 060218. C1 [Becerra, L.; Bianco, C. L.; Rueda, J. A.; Ruffini, R.] Sapienza Univ Roma, Dipartimento Fis, Piazzale Aldo Moro 5, I-00185 Rome, Italy. [Becerra, L.; Bianco, C. L.; Rueda, J. A.; Ruffini, R.] Sapienza Univ Roma, ICRA, Piazzale Aldo Moro 5, I-00185 Rome, Italy. [Becerra, L.; Bianco, C. L.; Rueda, J. A.; Ruffini, R.] ICRANet, Piazza Repubbl 10, I-65122 Pescara, Italy. [Fryer, C. L.] Los Alamos Natl Lab, CCS 2, Los Alamos, NM 87545 USA. [Rueda, J. A.; Ruffini, R.] Ctr Brasileiro Pesquisas Fis, ICRANet Rio, Rua Dr Xavier Sigaud 150, BR-22290180 Rio De Janeiro, Brazil. RP Becerra, L (reprint author), Sapienza Univ Roma, Dipartimento Fis, Piazzale Aldo Moro 5, I-00185 Rome, Italy.; Becerra, L (reprint author), Sapienza Univ Roma, ICRA, Piazzale Aldo Moro 5, I-00185 Rome, Italy.; Becerra, L (reprint author), ICRANet, Piazza Repubbl 10, I-65122 Pescara, Italy. FU International Relativistic Astrophysics Ph. D Program (IRAP-PhD); International Cooperation Program CAPES-ICRANet - CAPES, Brazilian Federal Agency within the Ministry of Education of Brazil; Ministry of Education and Science of the Republic of Kazakhstan; [3101/GF4 IPC-11/2015] FX We thank the referee for the comments and suggestions. L.B. acknowledges the support given by the International Relativistic Astrophysics Ph. D Program (IRAP-PhD). J. A. R. acknowledges the support by the International Cooperation Program CAPES-ICRANet financed by CAPES, Brazilian Federal Agency for Support and Evaluation of Graduate Education within the Ministry of Education of Brazil. J. A. R. acknowledges partial support of the project No. 3101/GF4 IPC-11/2015 and the target program of the Ministry of Education and Science of the Republic of Kazakhstan. NR 66 TC 0 Z9 0 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 10 PY 2016 VL 833 IS 1 AR 107 DI 10.3847/1538-4357/833/1/107 PG 21 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG1BG UT WOS:000390765800003 ER PT J AU Gnedin, NY AF Gnedin, Nickolay Y. TI ON THE PROPER USE OF THE REDUCED SPEED OF LIGHT APPROXIMATION SO ASTROPHYSICAL JOURNAL LA English DT Article DE cosmology: theory; galaxies: formation; large-scale structure of universe ID REIONIZATION; SIMULATIONS; EVOLUTION; UNIVERSE AB I show that the reduced speed of light (RSL) approximation, when used properly (i.e., as originally designed-only for local sources but not for the cosmic background), remains a highly accurate numerical method for modeling cosmic reionization. Simulated ionization and star formation histories from the "Cosmic Reionization on Computers" project are insensitive to the adopted value of the RSL for as long as that value does not fall below about 10% of the true speed of light. A recent claim of the failure of the RSL approximation in the Illustris reionization model appears to be due to the effective speed of light being reduced in the equation for the cosmic background too and hence illustrates the importance of maintaining the correct speed of light in modeling the cosmic background. C1 [Gnedin, Nickolay Y.] Fermilab Natl Accelerator Lab, Ctr Particle Astrophys, POB 500, Batavia, IL 60510 USA. [Gnedin, Nickolay Y.] Univ Chicago, Kavli Inst Cosmol Phys, Chicago, IL 60637 USA. [Gnedin, Nickolay Y.] Univ Chicago, Dept Astron & Astrophys, Chicago, IL 60637 USA. RP Gnedin, NY (reprint author), Fermilab Natl Accelerator Lab, Ctr Particle Astrophys, POB 500, Batavia, IL 60510 USA.; Gnedin, NY (reprint author), Univ Chicago, Kavli Inst Cosmol Phys, Chicago, IL 60637 USA.; Gnedin, NY (reprint author), Univ Chicago, Dept Astron & Astrophys, Chicago, IL 60637 USA. EM gnedin@fnal.gov FU Fermi Research Alliance, LLC [DE-AC02-07CH11359]; DOE Office of Science User Facility [DE-AC02-06CH11357]; United States Department of Energy FX I am grateful to Volker Springel for the extensive comments and frank discussion. This work was motivated by the discussion at the "Cosmic Reionization" program at the Munich Institute for Astro- and Particle Physics (MIAPP) of the DFG cluster of excellence "Origin and Structure of the Universe." Fermilab is operated by Fermi Research Alliance, LLC, under Contract No. DE-AC02-07CH11359 with the United States Department of Energy. The CROC simulations were performed on the University of Chicago Research Computing Center cluster "Midway," on National Energy Research Supercomputing Center (NERSC) supercomputers "Cori" and "Edison," and on the Argonne Leadership Computing Facility supercomputer "Mira." An award of computer time was provided by the Innovative and Novel Computational Impact on Theory and Experiment (INCITE) program. This research used resources of the Argonne Leadership Computing Facility, which is a DOE Office of Science User Facility supported by Contract DE-AC02-06CH11357. NR 11 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 10 PY 2016 VL 833 IS 1 AR 66 DI 10.3847/1538-4357/833/1/66 PG 4 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EF8CX UT WOS:000390557100030 ER PT J AU Gray, WJ Raskin, C Owen, JM AF Gray, William J. Raskin, Cody Owen, J. Michael TI SHADOWS OF OUR FORMER COMPANIONS: HOW THE SINGLE-DEGENERATE BINARY TYPE IA SUPERNOVA SCENARIO AFFECTS REMNANTS SO ASTROPHYSICAL JOURNAL LA English DT Article DE hydrodynamics; supernovae: general; white dwarfs; X-rays: general ID SMOOTHED-PARTICLE HYDRODYNAMICS; WHITE-DWARF COLLISIONS; X-RAY-SPECTRUM; DOUBLE-DETONATION; DELAY TIMES; RS OPHIUCHI; SYSTEMS; STAR; EXPLOSIONS; MODELS AB Here we present three-dimensional high-resolution simulations of Type Ia supernova in the presence of a nondegenerate companion. We find that the presence of a nearby companion leaves a long-lived hole in the supernova ejecta. In particular, we aim to study the long-term evolution of this hole as the supernova ejecta interacts with the surrounding interstellar medium (ISM). Using estimates for the X-ray emission, we find that the hole generated by the companion remains for many centuries after the interaction between the ejecta and the ISM. We also show that the hole is discernible over a wide range of viewing angles and companion masses. C1 [Gray, William J.; Raskin, Cody; Owen, J. Michael] Lawrence Livermore Natl Lab, POB 808,L-038, Livermore, CA 94550 USA. RP Gray, WJ (reprint author), Lawrence Livermore Natl Lab, POB 808,L-038, Livermore, CA 94550 USA. FU U.S. Department of Energy by Lawrence Livermore National Laboratory [DEAC52-07NA27344] FX We. also thank the anonymous referee for their comments, which helped to improve this paper. This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DEAC52-07NA27344. The authors also acknowledge the Livermore Computing Center at Lawrence Livermore Nation Laboratory for providing HPC resources that contributed to the results reported within this paper. NR 60 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-637X EI 1538-4357 J9 ASTROPHYS J JI Astrophys. J. PD DEC 10 PY 2016 VL 833 IS 1 AR 62 DI 10.3847/1538-4357/833/1/62 PG 10 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EF8CX UT WOS:000390557100026 ER PT J AU Gaulme, P Rowe, JF Bedding, TR Benomar, O Corsaro, E Davies, GR Hale, SJ Howe, R Garcia, RA Huber, D Jimenez, A Mathur, S Mosser, B Appourchaux, T Boumier, P Jackiewicz, J Leibacher, J Schmider, FX Hammel, HB Lissauer, JJ Marley, MS Simon, AA Chaplin, WJ Elsworth, Y Guzik, JA Murphy, N Aguirre, VS AF Gaulme, P. Rowe, J. F. Bedding, T. R. Benomar, O. Corsaro, E. Davies, G. R. Hale, S. J. Howe, R. Garcia, R. A. Huber, D. Jimenez, A. Mathur, S. Mosser, B. Appourchaux, T. Boumier, P. Jackiewicz, J. Leibacher, J. Schmider, F. -X. Hammel, H. B. Lissauer, J. J. Marley, M. S. Simon, A. A. Chaplin, W. J. Elsworth, Y. Guzik, J. A. Murphy, N. Aguirre, V. Silva TI A DISTANT MIRROR: SOLAR OSCILLATIONS OBSERVED ON NEPTUNE BY THE KEPLER K2 MISSION SO ASTROPHYSICAL JOURNAL LETTERS LA English DT Article DE planets and satellites: individual (Neptune); stars: oscillations (including pulsations); Sun: helioseismology; techniques: photometric ID RED-GIANT STARS; STELLAR OSCILLATIONS; SCALING RELATIONS; BAYESIAN-APPROACH; MAIN-SEQUENCE; HR DIAGRAM; AMPLITUDES; ASTEROSEISMOLOGY; COROT; FREQUENCIES AB Starting in 2014 December, Kepler K2 observed Neptune continuously for 49 days at a 1 minute cadence. The goals consisted of studying its atmospheric dynamics, detecting its global acoustic oscillations, and those of the Sun, which we report on here. We present the first indirect detection of solar oscillations in intensity measurements. Beyond the remarkable technical performance, it indicates how Kepler would see a star like the Sun. The result from the global asteroseismic approach, which consists of measuring the oscillation frequency at maximum amplitude nu(max) and the mean frequency separation between mode overtones Delta nu, is surprising as the nu(max) measured from Neptune photometry is larger than the accepted value. Compared to the usual reference nu(max,circle dot) = 3100 mu Hz, the asteroseismic scaling relations therefore make the solar mass and radius appear larger by 13.8 +/- 5.8% and 4.3 +/- 1.9%, respectively. The higher nu(max) is caused by a combination of the value of nu(max,circle dot), being larger at the time of observations than the usual reference from SOHO/VIRGO/SPM data (3160 +/- 10 mu Hz), and the noise level of the K2 time series, being 10 times larger than VIRGO's. The peak-bagging method provides more consistent results: despite a low signal-to-noise ratio (S/N), we model 10 overtones for degrees l = 0, 1, 2. We compare the K2 data with simultaneous SOHO/VIRGO/SPM photometry and BiSON velocity measurements. The individual frequencies, widths, and amplitudes mostly match those from VIRGO and BiSON within 1 sigma, except for the few peaks with the lowest S/N. C1 [Gaulme, P.; Jackiewicz, J.] New Mexico State Univ, Dept Astron, POB 30001,MSC 4500, Las Cruces, NM 88003 USA. [Gaulme, P.] Apache Point Observ, 2001 Apache Point Rd,POB 59, Sunspot, NM 88349 USA. [Gaulme, P.] New Mexico Inst Min & Technol, Dept Phys, 801 Leroy Pl, Socorro, NM 87801 USA. [Rowe, J. F.] Univ Montreal, Dept Phys, Inst Rech Exoplanetes, iREx, Montreal, PQ H3C 3J7, Canada. [Bedding, T. R.; Huber, D.] Univ Sydney, Sch Phys, Sydney Inst Astron SIfA, Sydney, NSW 2006, Australia. [Bedding, T. R.; Davies, G. R.; Hale, S. J.; Howe, R.; Elsworth, Y.] Univ Birmingham, Sch Phys & Astron, Birmingham B15 2TT, W Midlands, England. [Benomar, O.] New York Univ Abu Dhabi, NYUAD Inst, Ctr Space Sci, POB 129188, Abu Dhabi, U Arab Emirates. [Corsaro, E.; Garcia, R. A.] Univ Paris 7 Diderot, Lab AIM, Ctr Saclay, CEA,DRF,CNRS,IRFU,SAp, F-91191 Gif Sur Yvette, France. [Corsaro, E.; Jimenez, A.] Inst Astrofis Canarias, E-38200 Tenerife, Spain. [Corsaro, E.; Jimenez, A.] Univ La Laguna, Dept Astrofis, E-38205 Tenerife, Spain. [Corsaro, E.; Davies, G. R.] Osserv Astrofis Catania, INAF, Via S Sofia 78, I-95123 Catania, Italy. [Hale, S. J.; Howe, R.; Huber, D.; Chaplin, W. J.; Elsworth, Y.; Aguirre, V. Silva] Aarhus Univ, Dept Phys & Astron, SAC, Ny Munkegade 120, DK-8000 Aarhus C, Denmark. [Huber, D.] SETI Inst, 189 Bernardo Ave, Mountain View, CA 94043 USA. [Mathur, S.] Space Sci Inst, Ctr Extrasolar Planetary Syst, 4750 Walnut St,Suite 205, Boulder, CO 80301 USA. [Mosser, B.] Univ Paris 07, Univ Pierre & Marie Curie, CNRS, LESIA,Observ Paris,PSL Res Univ, F-92195 Meudon, France. [Appourchaux, T.; Boumier, P.; Leibacher, J.] Univ Paris 11, Inst Astrophys Spatiale, Batiment 121, F-91405 Orsay, France. [Appourchaux, T.; Boumier, P.; Leibacher, J.] CNRS, UMR 8617, Batiment 121, F-91405 Orsay, France. [Leibacher, J.] Natl Solar Observ, North Cherry Ave, Tucson, AZ 85718 USA. [Schmider, F. -X.] Univ Nice Sophia Antipolis, CNRS, Lab Lagrange, Observ Cote Azur, Nice, France. [Hammel, H. B.] AURA Inc, 1331 Pennsylvania Ave NW,Suite 1475, Washington, DC 20004 USA. [Lissauer, J. J.; Marley, M. S.] NASA, Ames Res Ctr, Space Sci & Astrobiol Div, MS 245-3, Moffett Field, CA 94035 USA. [Simon, A. A.] NASA, Goddard Space Flight Ctr, Solar Syst Explorat Div 690 0, 8800 Greenbelt Rd, Greenbelt, MD 20771 USA. [Guzik, J. A.] Los Alamos Natl Lab, XTD NTA, MS T086, Los Alamos, NM 87545 USA. [Murphy, N.] CALTECH, Jet Prop Lab, 4800 Oak Grove Dr, Pasadena, CA 91109 USA. RP Gaulme, P (reprint author), New Mexico State Univ, Dept Astron, POB 30001,MSC 4500, Las Cruces, NM 88003 USA.; Gaulme, P (reprint author), Apache Point Observ, 2001 Apache Point Rd,POB 59, Sunspot, NM 88349 USA.; Gaulme, P (reprint author), New Mexico Inst Min & Technol, Dept Phys, 801 Leroy Pl, Socorro, NM 87801 USA. EM gaulme@nmsu.edu RI Simon, Amy/C-8020-2012; OI Bedding, Tim/0000-0001-5222-4661; Davies, Guy/0000-0002-4290-7351; Simon, Amy/0000-0003-4641-6186; Gaulme, Patrick/0000-0001-8330-5464; Benomar, Othman/0000-0001-9405-5552 FU CNES GOLF grant; European Community [312844]; European Union's Horizon 2020 research and innovation programme under the Marie Sklodowska-Curie grant [664931]; Australian Research Council [DE140101364]; National Aeronautics and Space Administration under Kepler Participating Scientist Program [NNX14AB92G]; NASA [NNX12AE17G, NNX15AF13G]; NSF [AST-1411685] FX T.A., P.B., and R.A.G. acknowledge the support received from the CNES GOLF grant. E.C. and R.A.G. received funding from the European Community's Seventh Framework Programme ([FP7/2007-2013]) under grant agreement No. 312844 (SPACEINN). E.C. has received fundings from the European Union's Horizon 2020 research and innovation programme under the Marie Sklodowska-Curie grant agreement No. 664931. D.H. acknowledges support by the Australian Research Council's Discovery Projects funding scheme (project number DE140101364) and support by the National Aeronautics and Space Administration under grant NNX14AB92G issued through the Kepler Participating Scientist Program. S.M. would like to acknowledge support from NASA grants NNX12AE17G and NNX15AF13G and NSF grant AST-1411685. NR 51 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 2041-8205 EI 2041-8213 J9 ASTROPHYS J LETT JI Astrophys. J. Lett. PD DEC 10 PY 2016 VL 833 IS 1 AR L13 DI 10.3847/2041-8213/833/1/L13 PG 7 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EG1WA UT WOS:000390822200003 ER PT J AU Dobrev, VA Kolev, TV Rieben, RN Tomov, VZ AF Dobrev, V. A. Kolev, T. V. Rieben, R. N. Tomov, V. Z. TI Multi-material closure model for high-order finite element Lagrangian hydrodynamics SO INTERNATIONAL JOURNAL FOR NUMERICAL METHODS IN FLUIDS LA English DT Article DE closure models; pressure equilibration; shock hydrodynamics; multi-material hydrody- namics; finite element methods; high-order methods ID CELLS; DYNAMICS AB We present a new closure model for single fluid, multi-material Lagrangian hydrodynamics and its application to high-order finite element discretizations of these equations . The model is general with respect to the number of materials, dimension and space and time discretizations. Knowledge about exact material interfaces is not required. Material indicator functions are evolved by a closure computation at each quadrature point of mixed cells, which can be viewed as a high-order variational generalization of the method of Tipton . This computation is defined by the notion of partial non-instantaneous pressure equilibration, while the full pressure equilibration is achieved by both the closure model and the hydrodynamic motion. Exchange of internal energy between materials is derived through entropy considerations, that is, every material produces positive entropy, and the total entropy production is maximized in compression and minimized in expansion. Results are presented for standard one-dimensional two-material problems, followed by two-dimensional and three-dimensional multi-material high-velocity impact arbitrary Lagrangian-Eulerian calculations. Published 2016. This article is a U.S. Government work and is in the public domain in the USA. C1 [Dobrev, V. A.; Kolev, T. V.; Tomov, V. Z.] Lawrence Livermore Natl Lab, Ctr Appl Sci Comp, 7000 East Ave L-561, Livermore, CA 94550 USA. [Rieben, R. N.] Lawrence Livermore Natl Lab, Weap & Complex Integrat, Livermore, CA USA. RP Tomov, VZ (reprint author), Lawrence Livermore Natl Lab, Ctr Appl Sci Comp, 7000 East Ave L-561, Livermore, CA 94550 USA. EM tomov2@llnl.gov FU US Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344, LLNL-JRNL-680774] FX The authors would like to acknowledge the help of Robert Tipton, Douglas Miller, Tom Brunner and Robert Anderson of LLNL, whose guidance and input was very influential in the development of this paper. This work performed under the auspices of the US Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344, LLNL-JRNL-680774. NR 19 TC 0 Z9 0 U1 5 U2 5 PU WILEY-BLACKWELL PI HOBOKEN PA 111 RIVER ST, HOBOKEN 07030-5774, NJ USA SN 0271-2091 EI 1097-0363 J9 INT J NUMER METH FL JI Int. J. Numer. Methods Fluids PD DEC 10 PY 2016 VL 82 IS 10 BP 689 EP 706 DI 10.1002/fld.4236 PG 18 WC Computer Science, Interdisciplinary Applications; Mathematics, Interdisciplinary Applications; Mechanics; Physics, Fluids & Plasmas SC Computer Science; Mathematics; Mechanics; Physics GA EB2QH UT WOS:000387206400005 ER PT J AU Schlegel, M Munsterktter, M Guldener, U Bruggmann, R Duo, A Hainaut, M Henrissat, B Sieber, CMK Hoffmeister, D Grunig, CR AF Schlegel, Markus Munsterktter, Martin Guldener, Ulrich Bruggmann, Remy Duo, Angelo Hainaut, Matthieu Henrissat, Bernard Sieber, Christian M. K. Hoffmeister, Dirk Grunig, Christoph R. TI Globally distributed root endophyte Phialocephala subalpina links pathogenic and saprophytic lifestyles SO BMC GENOMICS LA English DT Article DE Comparative genomics; Lifestyle; Root endophyte; Species complex; Parasitism-mutualism continuum ID POPULATION GENETIC-ANALYSIS; APPLANATA SPECIES COMPLEX; TRANSPOSABLE ELEMENTS; ACEPHALA-APPLANATA; FUNGAL GENOMES; FORTINII S.L.; MICROFUNGAL ENDOPHYTES; STRUCTURE PREDICTION; FUSARIUM-OXYSPORUM; PLANT-PATHOGENS AB Background: Whereas an increasing number of pathogenic and mutualistic ascomycetous species were sequenced in the past decade, species showing a seemingly neutral association such as root endophytes received less attention. In the present study, the genome of Phialocephala subalpina, the most frequent species of the Phialocephala fortinii s.l. - Acephala applanata species complex, was sequenced for insight in the genome structure and gene inventory of these wide-spread root endophytes. Results: The genome of P. subalpina was sequenced using Roche/454 GS FLX technology and a whole genome shotgun strategy. The assembly resulted in 205 scaffolds and a genome size of 69.7 Mb. The expanded genome size in P. subalpina was not due to the proliferation of transposable elements or other repeats, as is the case with other ascomycetous genomes. Instead, P. subalpina revealed an expanded gene inventory that includes 20,173 gene models. Comparative genome analysis of P. subalpina with 13 ascomycetes shows that P. subalpina uses a versatile gene inventory including genes specific for pathogens and saprophytes. Moreover, the gene inventory for carbohydrate active enzymes (CAZymes) was expanded including genes involved in degradation of biopolymers, such as pectin, hemicellulose, cellulose and lignin. Conclusions: The analysis of a globally distributed root endophyte allowed detailed insights in the gene inventory and genome organization of a yet largely neglected group of organisms. We showed that the ubiquitous root endophyte P. subalpina has a broad gene inventory that links pathogenic and saprophytic lifestyles. C1 [Schlegel, Markus; Duo, Angelo; Grunig, Christoph R.] ETH, Inst Integrat Biol IBZ Forest Pathol & Dendrol, CH-8092 Zurich, Switzerland. [Munsterktter, Martin; Guldener, Ulrich; Sieber, Christian M. K.] Helmholtz Zentrum Munchen, German Res Ctr Environm Hlth, Inst Bioinformat & Syst Biol, D-85764 Neuherberg, Germany. [Guldener, Ulrich] Tech Univ Munich, Dept Genome Oriented Bioinformat, Wissensch Zentrum Weihenstephan, D-85354 Freising Weihenstephan, Germany. [Bruggmann, Remy] Univ Bern, Interfac Bioinformat Unit, Baltzerstr 6, CH-3012 Bern, Switzerland. [Bruggmann, Remy] Univ Bern, Swiss Inst Bioinformat, Baltzerstr 6, CH-3012 Bern, Switzerland. [Hainaut, Matthieu; Henrissat, Bernard] Univ Aix Marseille, AFMB, UMR CNRS 7257, 163 Ave Luminy, F-13288 Marseille, France. [Sieber, Christian M. K.] DOE Joint Genome Inst, 2800 Mitchell Dr, Walnut Creek, CA 94598 USA. [Hoffmeister, Dirk] Friedrich Schiller Univ, Pharmazeut Mikrobiol, Winzerlaer Str 2, D-07745 Jena, Germany. [Grunig, Christoph R.] Microsynth AG, Schutzenstr 15, CH-9436 Balgach, Switzerland. RP Grunig, CR (reprint author), ETH, Inst Integrat Biol IBZ Forest Pathol & Dendrol, CH-8092 Zurich, Switzerland.; Grunig, CR (reprint author), Microsynth AG, Schutzenstr 15, CH-9436 Balgach, Switzerland. EM christoph.gruenig@microsynth.ch FU Vontobel Stiftung, Zurich FX This study was partially funded by Vontobel Stiftung, Zurich to CRG. The funding agency had no influence on the design of the study and collection, analysis, and interpretation of data and in writing the manuscript. NR 130 TC 0 Z9 0 U1 9 U2 9 PU BIOMED CENTRAL LTD PI LONDON PA 236 GRAYS INN RD, FLOOR 6, LONDON WC1X 8HL, ENGLAND SN 1471-2164 J9 BMC GENOMICS JI BMC Genomics PD DEC 9 PY 2016 VL 17 AR 1015 DI 10.1186/s12864-016-3369-8 PG 22 WC Biotechnology & Applied Microbiology; Genetics & Heredity SC Biotechnology & Applied Microbiology; Genetics & Heredity GA EE7ZK UT WOS:000389843800004 PM 27938347 ER PT J AU Anazco, C Lopez-Jimenez, AJ Rafi, M Vega-Montoto, L Zhang, MZ Hudson, BG Vanacore, RM AF Anazco, Carolina Lopez-Jimenez, Alberto J. Rafi, Mohamed Vega-Montoto, Lorenzo Zhang, Ming-Zhi Hudson, Billy G. Vanacore, Roberto M. TI Lysyl Oxidase-like-2 Cross-links Collagen IV of Glomerular Basement Membrane SO JOURNAL OF BIOLOGICAL CHEMISTRY LA English DT Article ID TO-MESENCHYMAL TRANSITION; REGION 7S DOMAIN; DIABETIC-NEPHROPATHY; ENZYMATIC-ACTIVITY; KIDNEY GLOMERULI; 7-S COLLAGEN; NETWORK; EXPRESSION; HYPOXIA; CELL AB The 7S dodecamer is recognized as an important structural cross-linking domain of collagen IV networks that provide mechanical stability to basement membranes, a specialized form of extracellular matrix essential for the development and maintenance of tissue architecture. Although the 7S dodecamer is stabilized by covalent cross-linking, the molecular mechanism by which such cross-links are formed has not been revealed. Here, we aimed to identify the enzyme(s) that crosslinks the 7S dodecamer and characterize its expression in the kidney glomerulus. Pharmacological inhibition of candidate extracellular matrix enzymes revealed that lysyl oxidase activity is required for cross-linking of 7S polypeptides. Among all lysyl oxidase family members, lysyl oxidase-like-2 (LOXL2) was identified as the isoform cross-linking collagen IV in mouse embryonal PFHR-9 cells. Biochemical analyses revealed that LOXL2 readily promoted the formation of lysyl-derived cross-links in the 7S dodecamer but not in the NC1 domain. We also established that LOXL2 is the main lysyl oxidase family member present in the glomerular extracellular matrix. Altogether, we demonstrate that LOXL2 is a novel component of the molecular machinery that forms cross-linked collagen IV networks, which are essential for glomerular basement membrane stability and molecular ultrafiltration function. C1 [Anazco, Carolina; Lopez-Jimenez, Alberto J.; Rafi, Mohamed; Vega-Montoto, Lorenzo; Zhang, Ming-Zhi; Hudson, Billy G.; Vanacore, Roberto M.] Vanderbilt Univ, Med Ctr, Div Nephrol & Hypertens, Dept Med, Nashville, TN 37232 USA. [Anazco, Carolina; Lopez-Jimenez, Alberto J.; Vega-Montoto, Lorenzo; Hudson, Billy G.; Vanacore, Roberto M.] Vanderbilt Univ, Med Ctr, Ctr Matrix Biol, Nashville, TN 37232 USA. [Vega-Montoto, Lorenzo] Idaho Natl Lab, Idaho Falls, ID 83415 USA. RP Vanacore, RM (reprint author), Vanderbilt Univ, Med Ctr, Dept Med, Div Nephrol & Hypertens, 1161 21st Ave S,B-3113 Med Ctr N, Nashville, TN 37232 USA. EM roberto.vanacore@vanderbilt.edu RI Vega-Montoto, Lorenzo/B-9035-2017 OI Vega-Montoto, Lorenzo/0000-0002-4096-1100 FU NIDDK, National Institutes of Health [R01 DK099467, R01 DK18381, R01 DK051265]; Vanderbilt Division of Nephrology; Chilean Government FX This work was supported in part by the NIDDK, National Institutes of Health Grants R01 DK099467, R01 DK18381, and R01 DK051265 and Vanderbilt Division of Nephrology faculty development funds. The authors declare that they have no conflicts of interest with the contents of this article. The content is solely the responsibility of the authors and does not necessarily represent the official views of the National Institutes of Health.; Supported in part by "Becas-Chile" scholarship provided by the Chilean Government. NR 62 TC 0 Z9 0 U1 6 U2 6 PU AMER SOC BIOCHEMISTRY MOLECULAR BIOLOGY INC PI BETHESDA PA 9650 ROCKVILLE PIKE, BETHESDA, MD 20814-3996 USA SN 0021-9258 EI 1083-351X J9 J BIOL CHEM JI J. Biol. Chem. PD DEC 9 PY 2016 VL 291 IS 50 BP 25999 EP 26012 DI 10.1074/jbc.M116.738856 PG 14 WC Biochemistry & Molecular Biology SC Biochemistry & Molecular Biology GA EF5BH UT WOS:000390345200020 PM 27770022 ER PT J AU Bertini, B Essler, FHL Groha, S Robinson, NJ AF Bertini, Bruno Essler, Fabian H. L. Groha, Stefan Robinson, Neil J. TI Thermalization and light cones in a model with weak integrability breaking SO PHYSICAL REVIEW B LA English DT Article ID ISING FIELD-THEORY; MANY-BODY SYSTEM; STATISTICAL-MECHANICS; QUANTUM-SYSTEMS; CHAIN; PRETHERMALIZATION; RENORMALIZATION; QUENCHES; CHAOS AB We employ equation-of-motion techniques to study the nonequilibrium dynamics in a lattice model of weakly interacting spinless fermions. Our model provides a simple setting for analyzing the effects of weak integrability-breaking perturbations on the time evolution after a quantum quench. We establish the accuracy of the method by comparing results at short and intermediate times to time-dependent density matrix renormalization group computations. For sufficiently weak integrability-breaking interactions we always observe prethermalization plateaus, where local observables relax to nonthermal values at intermediate time scales. At later times a crossover towards thermal behavior sets in. We determine the associated time scale, which depends on the initial state, the band structure of the noninteracting theory, and the strength of the integrability-breaking perturbation. Our method allows us to analyze in some detail the spreading of correlations and in particular the structure of the associated light cones in our model. We find that the interior and exterior of the light cone are separated by an intermediate region, the temporal width of which appears to scale with a universal power law t(1/3). C1 [Bertini, Bruno; Essler, Fabian H. L.; Groha, Stefan] Univ Oxford, Rudolf Peierls Ctr Theoret Phys, Oxford OX1 3NP, England. [Bertini, Bruno] SISSA, Via Bonomea 265, I-34136 Trieste, Italy. [Bertini, Bruno] Ist Nazl Fis Nucl, Via Bonomea 265, I-34136 Trieste, Italy. [Robinson, Neil J.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Div, Upton, NY 11973 USA. RP Bertini, B (reprint author), Univ Oxford, Rudolf Peierls Ctr Theoret Phys, Oxford OX1 3NP, England.; Bertini, B (reprint author), SISSA, Via Bonomea 265, I-34136 Trieste, Italy.; Bertini, B (reprint author), Ist Nazl Fis Nucl, Via Bonomea 265, I-34136 Trieste, Italy. FU EPSRC [EP/I032487/1, EP/J014885/1]; Isaac Newton Institute for Mathematical Sciences [EP/K032208/1]; ERC [279391 EDEQS]; US Department of Energy [DE-SC0012704]; Clarendon Scholarship fund FX We thank John Cardy, Maurizio Fagotti, Stefan Kehrein, Robert Konik, and Wei Ku for useful discussions surrounding this work. F.E. and N.R. thank Salvatore Manmana for the previous collaboration [67] on this problem. This work was supported by the EPSRC under Grants No. EP/I032487/1 (B.B. and F.H.L.E.) and No. EP/J014885/1 (F.H.L.E.), the Isaac Newton Institute for Mathematical Sciences under Grant No. EP/K032208/1, the ERC under Starting Grant No. 279391 EDEQS (B.B.), the US Department of Energy under Contract No. DE-SC0012704 (N.J.R.), and the Clarendon Scholarship fund (S.G.). NR 136 TC 1 Z9 1 U1 8 U2 8 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 9 PY 2016 VL 94 IS 24 AR 245117 DI 10.1103/PhysRevB.94.245117 PG 30 WC Physics, Condensed Matter SC Physics GA EE4LW UT WOS:000389574600003 ER PT J AU Blancard, C Colgan, J Cosse, P Faussurier, G Fontes, CJ Gilleron, F Golovkin, I Hansen, SB Iglesias, CA Kilcrease, DP MacFarlane, JJ More, RM Pain, JC Sherrill, M Wilson, BG AF Blancard, C. Colgan, J. Cosse, Ph. Faussurier, G. Fontes, C. J. Gilleron, F. Golovkin, I. Hansen, S. B. Iglesias, C. A. Kilcrease, D. P. MacFarlane, J. J. More, R. M. Pain, J. -C. Sherrill, M. Wilson, B. G. TI Comment on "Large Enhancement in High-Energy Photoionization of Fe XVII and Missing Continuum Plasma Opacity" SO PHYSICAL REVIEW LETTERS LA English DT Editorial Material C1 [Blancard, C.; Cosse, Ph.; Faussurier, G.; Gilleron, F.; Pain, J. -C.] Commissariat Energie Atom & Energies Alternat, F-91297 Arpajon, France. [Colgan, J.; Fontes, C. J.; Kilcrease, D. P.; Sherrill, M.] Los Alamos Natl Lab, Bikini Atoll Rd, Los Alamos, NM 87545 USA. [Golovkin, I.; MacFarlane, J. J.] Prism Computat Sci, 455 Sci Dr,Suite 140, Madison, WI 53711 USA. [Hansen, S. B.; More, R. M.] Sandia Natl Labs, 1515 Eubank SE, Albuquerque, NM 87185 USA. [Iglesias, C. A.; Wilson, B. G.] Lawrence Livermore Natl Lab, POB 808, Livermore, CA 94550 USA. RP Hansen, SB (reprint author), Sandia Natl Labs, 1515 Eubank SE, Albuquerque, NM 87185 USA. EM sbhansen@sandia.gov OI Kilcrease, David/0000-0002-2319-5934 NR 10 TC 2 Z9 2 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 9 PY 2016 VL 117 IS 24 AR 249501 DI 10.1103/PhysRevLett.117.249501 PG 2 WC Physics, Multidisciplinary SC Physics GA EE4MO UT WOS:000389576600018 PM 28009220 ER PT J AU Calci, A Navratil, P Roth, R Dohet-Eraly, J Quaglioni, S Hupin, G AF Calci, Angelo Navratil, Petr Roth, Robert Dohet-Eraly, Jeremy Quaglioni, Sofia Hupin, Guillaume TI Can Ab Initio Theory Explain the Phenomenon of Parity Inversion in Be-11? SO PHYSICAL REVIEW LETTERS LA English DT Article ID EFFECTIVE-FIELD THEORY; FEW-NUCLEON FORCES; CHIRAL LAGRANGIANS; LIGHT-NUCLEI; ENERGY-LEVELS; MODEL; SPIN AB The weakly bound exotic Be-11 nucleus, famous for its ground-state parity inversion and distinct n + Be-10 halo structure, is investigated from first principles using chiral two-and three-nucleon forces. An explicit treatment of continuum effects is found to be indispensable. We study the sensitivity of the Be-11 spectrum to the details of the three-nucleon force and demonstrate that only certain chiral interactions are capable of reproducing the parity inversion. With such interactions, the extremely large E1 transition between the bound states is reproduced. We compare our photodisintegration calculations to conflicting experimental data and predict a distinct dip around the 3/2(1)(-) resonance energy. Finally, we predict low-lying 3/2(+) and 9/2(+) resonances that are not or not sufficiently measured in experiments. C1 [Calci, Angelo; Navratil, Petr; Dohet-Eraly, Jeremy] TRIUMF, 4004 Wesbrook Mall, Vancouver, BC V6T 2A3, Canada. [Roth, Robert] Tech Univ Darmstadt, Inst Kernphys, D-64289 Darmstadt, Germany. [Quaglioni, Sofia] Lawrence Livermore Natl Lab, POB 808,L-414, Livermore, CA 94551 USA. [Hupin, Guillaume] Univ Paris 11, Inst Phys Nucl, CNRS, IN2P3, F-91406 Orsay, France. [Hupin, Guillaume] CEA, DAM, DIF, F-91297 Arpajon, France. [Dohet-Eraly, Jeremy] Ist Nazl Fis Nucl, Sez Pisa, Largo B Pontecorvo 3, I-56127 Pisa, Italy. RP Calci, A (reprint author), TRIUMF, 4004 Wesbrook Mall, Vancouver, BC V6T 2A3, Canada. EM calci@triumf.ca; navratil@triumf.ca RI Roth, Robert/B-6502-2008 FU LLNL [DE-AC52-07NA27344]; U.S. Department of Energy, Office of Science, Office of Nuclear Physics [SCW1158]; NSERC [SAPIN-2016-00033]; Deutsche Forschungsgemeinschaft [SFB 1245]; National Research Council of Canada FX This work was prepared in part by LLNL under Contract No. DE-AC52-07NA27344 and supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under Work Proposal No. SCW1158, by the NSERC Grant No. SAPIN-2016-00033, and by the Deutsche Forschungsgemeinschaft through SFB 1245. TRIUMF receives federal funding via a contribution agreement with the National Research Council of Canada. Computing support came from the LLNL institutional Computing Grand Challenge Program, from an INCITE Award on the Titan supercomputer of the Oak Ridge Leadership Computing Facility (OLCF) at ORNL, the LOEWE-CSC Frankfurt, the computing center of the TU Darmstadt (LICHTENBERG), and from Calcul Quebec and Compute Canada. NR 62 TC 1 Z9 1 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 9 PY 2016 VL 117 IS 24 AR 242501 DI 10.1103/PhysRevLett.117.242501 PG 6 WC Physics, Multidisciplinary SC Physics GA EE4MO UT WOS:000389576600006 PM 28009211 ER PT J AU Chen, Y Lykken, J Spiropulu, M Stolarski, D Vega-Morales, R AF Chen, Yi Lykken, Joe Spiropulu, Maria Stolarski, Daniel Vega-Morales, Roberto TI Golden Probe of Electroweak Symmetry Breaking SO PHYSICAL REVIEW LETTERS LA English DT Article ID HIGGS-BOSON DECAYS; STANDARD-MODEL; LHC; TRIPLETS; SPIN; MASS AB The ratio of the Higgs couplings to WW and ZZ pairs, lambda(WZ), is a fundamental parameter in electroweak symmetry breaking as well as a measure of the (approximate) custodial symmetry possessed by the gauge boson mass matrix. We show that Higgs decays to four leptons are sensitive, via tree level or one-loop interference effects, to both the magnitude and, in particular, overall sign of lambda(WZ). Determining this sign requires interference effects, as it is nearly impossible to measure with rate information. Furthermore, simply determining the sign effectively establishes the custodial representation of the Higgs boson. We find that h -> 4l (4l = 2e2 mu, 4e, 4 mu) decays have excellent prospects of directly establishing the overall sign at a high luminosity 13 TeV LHC. We also examine the ultimate LHC sensitivity in h -> 4l to the magnitude of lambda(WZ). Our results are independent of other measurements of the Higgs boson couplings and, in particular, largely free of assumptions about the top quark Yukawa couplings which also enter at one loop. This makes h -> 4l a unique and independent probe of electroweak symmetry breaking and custodial symmetry. C1 [Chen, Yi] CERN, European Org Nucl Res, CH-1211 Geneva, Switzerland. [Chen, Yi; Spiropulu, Maria] CALTECH, Lauritsen Lab High Energy Phys, Pasadena, CA 92115 USA. [Lykken, Joe] Fermilab Natl Accelerator Lab, Dept Theoret Phys, POB 500, Batavia, IL 60510 USA. [Stolarski, Daniel] Carleton Univ, Ottawa Carleton Inst Phys, 1125 Colonel By Dr, Ottawa, ON K1S 5B6, Canada. [Vega-Morales, Roberto] Univ Granada, Dept Fis Teor & Cosmos, Campus Fuentenueva, E-18071 Granada, Spain. [Vega-Morales, Roberto] Univ Granada, CAFPE, Campus Fuentenueva, E-18071 Granada, Spain. RP Chen, Y (reprint author), CERN, European Org Nucl Res, CH-1211 Geneva, Switzerland.; Chen, Y (reprint author), CALTECH, Lauritsen Lab High Energy Phys, Pasadena, CA 92115 USA. EM yi.chen@cern.ch; lykken@fnal.gov; smaria@caltech.edu; stolar@physics.carleton.ca; rvegamorales@ugr.es FU Fermilab; Mainz Institute for Theoretical Physics (MITP); Weston Havens Foundation; DOE [DE-FG02-92-ER-40701]; Natural Sciences and Engineering Research Council of Canada (NSERC); MINECO [FPA2013-47836-C3-2-P] FX We would like to thank Francisco del Aguila, Adam Falkowski, Heather Logan, Ian Low, Jose Santiago, and Martin Schmaltz for useful discussions. R. V. M. also thanks Fermilab and the Mainz Institute for Theoretical Physics (MITP) for their hospitality and partial support during the completion of this work as well as Tilman Plehn and the participants of the FIRSTRESULTS workshop for useful discussions. The work of Y. C. is supported by the Weston Havens Foundation and DOE Grant No. DE-FG02-92-ER-40701. D. S. is supported in part by the Natural Sciences and Engineering Research Council of Canada (NSERC). R. V. M. is supported by MINECO, under Grant No. FPA2013-47836-C3-2-P. NR 66 TC 0 Z9 0 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 9 PY 2016 VL 117 IS 24 AR 241801 DI 10.1103/PhysRevLett.117.241801 PG 6 WC Physics, Multidisciplinary SC Physics GA EE4MO UT WOS:000389576600003 PM 28009184 ER PT J AU Kattke, MD Chan, AH Duong, A Sexton, DL Sawaya, MR Cascio, D Elliot, MA Clubb, RT AF Kattke, Michele D. Chan, Albert H. Duong, Andrew Sexton, Danielle L. Sawaya, Michael R. Cascio, Duilio Elliot, Marie A. Clubb, Robert T. TI Crystal Structure of the Streptomyces coelicolor Sortase E1 Transpeptidase Provides Insight into the Binding Mode of the Novel Class E Sorting Signal SO PLOS ONE LA English DT Article ID STAPHYLOCOCCUS-AUREUS SORTASE; GRAM-POSITIVE BACTERIA; SURFACE-PROTEINS; CELL-WALL; SUBSTRATE COMPLEX; ANTIINFECTIVE THERAPY; KINETIC MECHANISM; ACCURATE DOCKING; SRTA; LIGATION AB Many species of Gram-positive bacteria use sortase transpeptidases to covalently affix proteins to their cell wall or to assemble pili. Sortase-displayed proteins perform critical and diverse functions for cell survival, including cell adhesion, nutrient acquisition, and morphological development, among others. Based on their amino acid sequences, there are at least six types of sortases (class A to F enzymes); however, class E enzymes have not been extensively studied. Class E sortases are used by soil and freshwater-dwelling Actinobacteria to display proteins that contain a non-canonical LAXTG sorting signal, which differs from 90% of known sorting signals by substitution of alanine for proline. Here we report the first crystal structure of a class E sortase, the 1.93 angstrom resolution structure of the SrtE1 enzyme from Streptomyces coelicolor. The active site is bound to a tripeptide, providing insight into the mechanism of substrate binding. SrtE1 possesses beta 3/beta 4 and beta 6/beta 7 active site loops that contact the LAXTG substrate and are structurally distinct from other classes. We propose that SrtE1 and other class E sortases employ a conserved tyrosine residue within their beta 3/beta 4 loop to recognize the amide nitrogen of alanine at position P3 of the sorting signal through a hydrogen bond, as seen here. Incapability of hydrogen-bonding with canonical proline-containing sorting signals likely contributes to class E substrate specificity. Furthermore, we demonstrate that surface anchoring of proteins involved in aerial hyphae formation requires an N-terminal segment in SrtE1 that is presumably positioned within the cytoplasm. Combined, our results reveal unique features within class E enzymes that enable them to recognize distinct sorting signals, and could facilitate the development of substrate-based inhibitors of this important enzyme family. C1 [Kattke, Michele D.; Sawaya, Michael R.; Cascio, Duilio] Univ Calif Los Angeles, Inst Mol Biol, Los Angeles, CA 90024 USA. [Kattke, Michele D.] Univ Calif Los Angeles, Mol Biol Interdept Program, Los Angeles, CA USA. [Chan, Albert H.] Yale Univ, Sch Med, Dept Pharmacol, New Haven, CT 06510 USA. [Duong, Andrew; Sexton, Danielle L.; Elliot, Marie A.] McMaster Univ, Dept Biol, Hamilton, ON, Canada. [Duong, Andrew; Sexton, Danielle L.; Elliot, Marie A.] McMaster Univ, Michael G DeGroote Inst Infect Dis Res, Hamilton, ON, Canada. [Clubb, Robert T.] Univ Calif Los Angeles, Dept Chem & Biochem, 405 Hilgard Ave, Los Angeles, CA 90024 USA. [Clubb, Robert T.] Univ Calif Los Angeles, UCLA DOE Inst Genom & Prote, Los Angeles, CA USA. RP Clubb, RT (reprint author), Univ Calif Los Angeles, Dept Chem & Biochem, 405 Hilgard Ave, Los Angeles, CA 90024 USA.; Clubb, RT (reprint author), Univ Calif Los Angeles, UCLA DOE Inst Genom & Prote, Los Angeles, CA USA. EM rclubb@mbi.ucla.edu OI Sawaya, Michael/0000-0003-0874-9043 FU Canadian Institutes of Health Research [MOP-137004]; National Institutes of Health [R01 AI52217, P41 GM103403, S10 RR029205, AI52217]; U.S. Department of Energy Office of Science, Office of Biological and Environmental Research [DE-FC02-02ER63421, DE-AC02-06CH11357]; UCLA Eugene V. Cota-Robles Fellowship; UCLA Philip Whitcome Pre-doctoral Fellowship in Molecular Biology through the UCLA Molecular Biology Institute; National Center for Research Resources [5P41RR015301-10]; National Institute of General Medical Sciences from the National Institutes of Health [P41 GM103403]; National Institutes of Health Office of Research Infrastructure Programs High-End Instrumentation Grant Program [S10 RR029205]; DOE Office of Science [DE-AC02-06CH11357]; Eugene V. Cota-Robles Fellowship through the UCLA Graduate Division FX This work was supported by the Canadian Institutes of Health Research (http://www.cihr-irsc.gc.ca/e/193.html) under award number MOP-137004 and the National Institutes of Health (https://www.nih.gov/) under award number R01 AI52217, P41 GM103403 and S10 RR029205. This work was also partially supported by the U.S. Department of Energy Office of Science, Office of Biological and Environmental Research program under award number DE-FC02-02ER63421 and DE-AC02-06CH11357. MDK was supported by a UCLA Eugene V. Cota-Robles Fellowship and a UCLA Philip Whitcome Pre-doctoral Fellowship in Molecular Biology through the UCLA Molecular Biology Institute. The funders had no role in study design, data collection and analysis, decision to publish, or preparation of the manuscript.; We would like to acknowledge Michael Collazo from the UCLA-DOE Institute Macromolecular Crystallization Core Technology Facility, as well as M. Capel, K. Rajashankar, N. Sukumar, J. Schuermann, I. Kourinov, F. Murphy, S. Banerjee, K. Perry, and D. Neau at NECAT beamline 24-ID-C of the Argonne National Laboratory APS for assistance with X-ray data collection. The Pilatus 6M detector on 24-ID-C beam line is supported by grants from the National Center for Research Resources (5P41RR015301-10), the National Institute of General Medical Sciences (P41 GM103403) from the National Institutes of Health, and the National Institutes of Health Office of Research Infrastructure Programs High-End Instrumentation Grant Program (S10 RR029205). This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. This material is based upon work supported by the U.S. Department of Energy Office of Science, Office of Biological and Environmental Research under award number DE-FC02-02ER63421, the National Institutes of Health under award number AI52217, and the Canadian Institutes of Health Research under award number MOP-137004. We would also like to thank David Capstick, Christina Di Berardo, and Kanishk Jain for their technical assistance. M.D.K. was supported by the Eugene V. Cota-Robles Fellowship through the UCLA Graduate Division and the Philip Whitcome Pre-doctoral Fellowship in Molecular Biology through the UCLA Molecular Biology Institute. NR 60 TC 0 Z9 0 U1 5 U2 5 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 9 PY 2016 VL 11 IS 12 AR e0167763 DI 10.1371/journal.pone.0167763 PG 21 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4PU UT WOS:000389587100179 PM 27936128 ER PT J AU Thi, VHD Coriton, O Le Clainche, I Arnaud, D Gordon, SP Linc, G Catalan, P Hasterok, R Vogel, JP Jahier, J Chalhoub, B AF Vinh Ha Dinh Thi Coriton, Olivier Le Clainche, Isabelle Arnaud, Dominique Gordon, Sean P. Linc, Gabriella Catalan, Pilar Hasterok, Robert Vogel, John P. Jahier, Joseph Chalhoub, Boulos TI Recreating Stable Brachypodium hybridum Allotetraploids by Uniting the Divergent Genomes of B. distachyon and B. stacei SO PLOS ONE LA English DT Article ID MODEL GRASS; INTERSPECIFIC HYBRIDIZATION; GENE-EXPRESSION; BRASSICA-NAPUS; REPRODUCTIVE ISOLATION; SYNTHETIC POLYPLOIDS; FLOW-CYTOMETRY; EVOLUTION; ARABIDOPSIS; PLANTS AB Brachypodium hybridum (2n = 30) is a natural allopolyploid with highly divergent subgenomes derived from two extant diploid species, B. distachyon (2n = 10) and B. stacei (2n = 20) that differ in chromosome evolution and number. We created synthetic B. hybridum allotetraploids by hybridizing various lines of B. distachyon and B. stacei. The initial amphihaploid F1 interspecific hybrids were obtained at low frequencies when B. distachyon was used as the maternal parent (0.15% or 0.245% depending on the line used) and were sterile. No hybrids were obtained from reciprocal crosses or when autotetraploids of the parental species were crossed. Colchicine treatment was used to double the genome of the F1 amphihaploid lines leading to allotetraploids. The genome-doubled F1 plants produced a few S1 (first selfed generation) seeds after self-pollination. S1 plants from one parental combination (Bd3-1xBsta5) were fertile and gave rise to further generations whereas those of another parental combination (Bd21xABR114) were sterile, illustrating the importance of the parental lineages crossed. The synthetic allotetraploids were stable and resembled the natural B. hybridum at the phenotypic, cytogenetic and genomic levels. The successful creation of synthetic B. hybridum offers the possibility to study changes in genome structure and regulation at the earliest stages of allopolyploid formation in comparison with the parental species and natural B. hybridum. C1 [Vinh Ha Dinh Thi; Le Clainche, Isabelle; Arnaud, Dominique; Chalhoub, Boulos] Univ Evry Val dEssonne, Org & Evolut Complex Genomes, Inst Natl Rech Agron, Evry, France. [Coriton, Olivier; Jahier, Joseph] Univ Rennes 1, Unite Mixte Rech INRA, Agrocampus Rennes, Inst Genet Environm & Protect Plantes, Le Rheu, France. [Gordon, Sean P.; Vogel, John P.] DOE Joint Genome Inst, Walnut Creek, CA USA. [Linc, Gabriella] Hungarian Acad Sci, Inst Agr, Agr Res Ctr, Brunszv U 2, Martonvasar, Hungary. [Catalan, Pilar] Univ Zaragoza, Dept Agr & Environm Sci, High Polytech Sch Huesca, Huesca, Spain. [Catalan, Pilar] Tomsk State Univ, Inst Biol, Dept Bot, Tomsk, Russia. [Hasterok, Robert] Univ Silesia, Fac Biol & Environm Protect, Dept Plant Anat & Cytol, Katowice, Poland. [Vogel, John P.] Univ Calif Berkeley, Dept Plant & Microbial Biol, Berkeley, CA 94720 USA. [Chalhoub, Boulos] Univ Paris Saclay, Univ Evry Val dEssonne, Inst Syst & Synthet Biol, Genopole,Ctr Natl Rech Sci, Evry, France. RP Chalhoub, B (reprint author), Univ Evry Val dEssonne, Org & Evolut Complex Genomes, Inst Natl Rech Agron, Evry, France.; Chalhoub, B (reprint author), Univ Paris Saclay, Univ Evry Val dEssonne, Inst Syst & Synthet Biol, Genopole,Ctr Natl Rech Sci, Evry, France. EM chalhoub@evry.inra.fr RI Catalan, Pilar/N-7641-2014 FU French ANR (Agence Nationale de la Recherche) [ANR-11-BSV5-0015]; Vietnamese International Education Development (VIED); Ministry of Education and Training Vietnam (MOET) FX This project was funded by the French ANR (Agence Nationale de la Recherche, www.agence-nationale-recherche.fr) 2011 (Ploid-ploid-Wheat, ANR-11-BSV5-0015). Vinh Ha Dinh Thi was support by a PhD fellowship from the Vietnamese International Education Development (VIED) and Ministry of Education and Training Vietnam (MOET). The funders had no role in study design, data collection and analysis, decision to publish, or preparation of the manuscript. NR 85 TC 0 Z9 0 U1 7 U2 7 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 9 PY 2016 VL 11 IS 12 AR e0167171 DI 10.1371/journal.pone.0167171 PG 27 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4PU UT WOS:000389587100070 ER PT J AU Stodden, V McNutt, M Bailey, DH Deelman, E Gil, Y Hanson, B Heroux, MA Ioannidis, JPA Taufer, M AF Stodden, Victoria McNutt, Marcia Bailey, David H. Deelman, Ewa Gil, Yolanda Hanson, Brooks Heroux, Michael A. Ioannidis, John P. A. Taufer, Michela TI Enhancing reproducibility for computational methods SO SCIENCE LA English DT Editorial Material C1 [Stodden, Victoria] Univ Illinois, Urbana, IL 61801 USA. [McNutt, Marcia] Natl Acad Sci, 2101 Constitut Ave Nw, Washington, DC 20418 USA. [Bailey, David H.] Univ Calif Davis, Davis, CA 95616 USA. [Deelman, Ewa; Gil, Yolanda] Univ Southern Calif, Los Angeles, CA 90007 USA. [Hanson, Brooks] Amer Geophys Union, Washington, DC 20009 USA. [Heroux, Michael A.] Sandia Natl Labs, Avon, MN 56310 USA. [Ioannidis, John P. A.] Stanford Univ, Stanford, CA 94305 USA. [Taufer, Michela] Univ Delaware, Newark, DE 19716 USA. RP Stodden, V (reprint author), Univ Illinois, Urbana, IL 61801 USA. EM vcs@stodden.net NR 16 TC 0 Z9 0 U1 6 U2 6 PU AMER ASSOC ADVANCEMENT SCIENCE PI WASHINGTON PA 1200 NEW YORK AVE, NW, WASHINGTON, DC 20005 USA SN 0036-8075 EI 1095-9203 J9 SCIENCE JI Science PD DEC 9 PY 2016 VL 354 IS 6317 BP 1240 EP 1241 DI 10.1126/science.aah6168 PG 2 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4TS UT WOS:000389598800044 PM 27940837 ER PT J AU Reid, NM Proestou, DA Clark, BW Warren, WC Colbourne, JK Shaw, JR Karchner, SI Hahn, ME Nacci, D Oleksiak, MF Crawford, DL Whitehead, A AF Reid, Noah M. Proestou, Dina A. Clark, Bryan W. Warren, Wesley C. Colbourne, John K. Shaw, Joseph R. Karchner, Sibel I. Hahn, Mark E. Nacci, Diane Oleksiak, Marjorie F. Crawford, Douglas L. Whitehead, Andrew TI The genomic landscape of rapid repeated evolutionary adaptation to toxic pollution in wild fish SO SCIENCE LA English DT Article ID KILLIFISH FUNDULUS-HETEROCLITUS; ATLANTIC KILLIFISH; GENETIC-VARIATION; CRUDE-OIL; RECEPTOR; POPULATIONS; TOLERANCE; GROWTH; PCBS; LOCI AB Atlantic killifish populations have rapidly adapted to normally lethal levels of pollution in four urban estuaries. Through analysis of 384 whole killifish genome sequences and comparative transcriptomics in four pairs of sensitive and tolerant populations, we identify the aryl hydrocarbon receptor-based signaling pathway as a shared target of selection. This suggests evolutionary constraint on adaptive solutions to complex toxicant mixtures at each site. However, distinct molecular variants apparently contribute to adaptive pathway modification among tolerant populations. Selection also targets other toxicity-mediating genes and genes of connected signaling pathways; this indicates complex tolerance phenotypes and potentially compensatory adaptations. Molecular changes are consistent with selection on standing genetic variation. In killifish, high nucleotide diversity has likely been a crucial substrate for selective sweeps to propel rapid adaptation. C1 [Reid, Noah M.; Whitehead, Andrew] Univ Calif Davis, Dept Environm Toxicol, Davis, CA 95616 USA. [Proestou, Dina A.] USDA ARS, Kingston, RI 02881 USA. [Clark, Bryan W.] US EPA, Oak Ridge Inst Sci & Educ, Off Res & Dev, Narragansett, RI 02882 USA. [Warren, Wesley C.] Washington Univ, Sch Med, McDonnell Genome Inst, St Louis, MO 63108 USA. [Colbourne, John K.; Shaw, Joseph R.] Univ Birmingham, Sch Biosci, Birmingham B15 2TT, W Midlands, England. [Shaw, Joseph R.] Indiana Univ, Sch Publ & Environm Affairs, Bloomington, IN 47405 USA. [Karchner, Sibel I.; Hahn, Mark E.] Woods Hole Oceanog Inst, Dept Biol, Woods Hole, MA 02543 USA. [Karchner, Sibel I.; Hahn, Mark E.] Boston Univ, Superfund Res Program, Boston, MA 02118 USA. [Nacci, Diane] US EPA, Off Res & Dev, Narragansett, RI 02882 USA. [Oleksiak, Marjorie F.; Crawford, Douglas L.] Univ Miami, Rosenstiel Sch Marine & Atmospher Sci, Dept Marine Biol & Ecol, 4600 Rickenbacker Causeway, Miami, FL 33149 USA. RP Whitehead, A (reprint author), Univ Calif Davis, Dept Environm Toxicol, Davis, CA 95616 USA. EM awhitehead@ucdavis.edu FU National Center for Biotechnology Information [PRJNA323589]; NSF [DEB-1265282, DEB-112052, DEB-1120013, DEB-1120263, DEB-1120333, DEB-1120398]; National Institutes of Environmental Health Sciences [1R01ES021934-01, P42ES007381, R01ES019324]; National Science Foundation [OCE-1314567]; Postdoctoral Research Program at the U.S. Environmental Protection Agency (EPA) [DW92429801] FX Sequence data are archived at the National Center for Biotechnology Information (BioProject PRJNA323589). Phylogenetic tree data are archived at Dryad (doi: 10.5061/dryad.68n87). We thank G. Coop, B. Counterman, D. Champlin, I. Kirby, and A. Bertrand for their valuable input. Primary support was from the NSF (collaborative research grants DEB-1265282, DEB-112052, DEB-1120013, DEB-1120263, DEB-1120333, DEB-1120398 to J.K.C., D.L.C., M.E.H., S.I.K., M.F.O., J.R.S., W.C.W. and A.W.). Further support was provided by the National Institutes of Environmental Health Sciences (1R01ES021934-01 to A.W.; P42ES007381 to M.E.H.; R01ES019324 to J.R.S.), and the National Science Foundation (OCE-1314567 to A.W.). B.W.C. as supported by the Postdoctoral Research Program at the U.S. Environmental Protection Agency (EPA) administered by the Oak Ridge Institute for Science and Education (agreement DW92429801). The views expressed in this article are those of the authors and do not necessarily represent the views or policies of the EPA. NR 24 TC 3 Z9 3 U1 45 U2 45 PU AMER ASSOC ADVANCEMENT SCIENCE PI WASHINGTON PA 1200 NEW YORK AVE, NW, WASHINGTON, DC 20005 USA SN 0036-8075 EI 1095-9203 J9 SCIENCE JI Science PD DEC 9 PY 2016 VL 354 IS 6317 BP 1305 EP 1308 DI 10.1126/science.aah4993 PG 4 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4TS UT WOS:000389598800064 PM 27940876 ER PT J AU Jacobsen, JL Scullard, CR Guttmann, AJ AF Jacobsen, Jesper Lykke Scullard, Christian R. Guttmann, Anthony J. TI On the growth constant for square-lattice self-avoiding walks SO JOURNAL OF PHYSICS A-MATHEMATICAL AND THEORETICAL LA English DT Article DE self-avoiding walks; connective constant; topological transfer matrix ID POLYGONS AB The growth constant for two-dimensional self-avoiding walks on the honeycomb lattice was conjectured by Nienhuis in 1982, and since that time the corresponding results for the square and triangular lattices have been sought. For the square lattice, a possible conjecture was advanced by one of us (AJG) more than 20 years ago, based on the six significant digit estimate available at the time. This estimate has improved by a further six digits over the intervening decades, and the conjectured value continued to agree with the increasingly precise estimates. We discuss the three most successful methods for estimating the growth constant, including the most recently developed topological transfer-matrix method, due to another of us (JLJ). We show this to be the most computationally efficient of the three methods, and by parallelising the algorithm we have estimated the growth constant significantly more precisely, incidentally ruling out the conjecture, which fails in the 12th digit. Our new estimate of the growth constant is mu(square) = 2.63815853032790 (3). C1 [Jacobsen, Jesper Lykke] PSL Res Univ, Ecole Normale Super, LPTENS, 24 Rue Lhomond, F-75231 Paris 05, France. [Jacobsen, Jesper Lykke] UPMC Univ Paris 6, Sorbonne Univ, CNRS UMR 8549, F-75005 Paris, France. [Jacobsen, Jesper Lykke] CEA Saclay, Inst Phys Theor, F-91191 Gif Sur Yvette, France. [Scullard, Christian R.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Guttmann, Anthony J.] Univ Melbourne, Dept Math & Stat, ARC Ctr Excellence Math & Stat Complex Syst, Melbourne, Vic 3010, Australia. RP Jacobsen, JL (reprint author), PSL Res Univ, Ecole Normale Super, LPTENS, 24 Rue Lhomond, F-75231 Paris 05, France.; Jacobsen, JL (reprint author), UPMC Univ Paris 6, Sorbonne Univ, CNRS UMR 8549, F-75005 Paris, France.; Jacobsen, JL (reprint author), CEA Saclay, Inst Phys Theor, F-91191 Gif Sur Yvette, France. OI Jacobsen, Jesper Lykke/0000-0002-7615-2874 FU Institut Universitaire de France; European Research Council through Advanced Grant NuQFT; US Department of Energy at Lawrence Livermore National Laboratory [DE-AC52-07NA27344]; Australian Research Council [DP120100939] FX JLJ is grateful for the hospitality of the Centre of Excellence for Mathematics and Statistics of Complex Systems (Melbourne University) where part of this work was accomplished. He also acknowledges the support of the Institut Universitaire de France, and of the European Research Council through the Advanced Grant NuQFT. The work of CRS was performed under the auspices of the US Department of Energy at the Lawrence Livermore National Laboratory under Contract No. DE-AC52-07NA27344. AJG acknowledges the support of the Australian Research Council through grant DP120100939. We thank Mireille Bousquet-Melou for the provision of a figure. NR 17 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1751-8113 EI 1751-8121 J9 J PHYS A-MATH THEOR JI J. Phys. A-Math. Theor. PD DEC 9 PY 2016 VL 49 IS 49 AR 494004 DI 10.1088/1751-8113/49/49/494004 PG 18 WC Physics, Multidisciplinary; Physics, Mathematical SC Physics GA ED4JY UT WOS:000388815100002 ER PT J AU Di Giorgio, C Bobba, F Cucolo, AM Scarfato, A Moore, SA Karapetrov, G D'Agostino, D Novosad, V Yefremenko, V Iavarone, M AF Di Giorgio, C. Bobba, F. Cucolo, A. M. Scarfato, A. Moore, S. A. Karapetrov, G. D'Agostino, D. Novosad, V. Yefremenko, V. Iavarone, M. TI Observation of superconducting vortex clusters in S/F hybrids SO SCIENTIFIC REPORTS LA English DT Article ID MAGNETIC FORCE MICROSCOPY; ANISOTROPIC SUPERCONDUCTORS; VORTICES; FILMS; LATTICE; ARRAYS; LAYER; DOTS AB While Abrikosov vortices repel each other and form a uniform vortex lattice in bulk type-II superconductors, strong confinement potential profoundly affects their spatial distribution eventually leading to vortex cluster formation. The confinement could be induced by the geometric boundaries in mesoscopic-size superconductors or by the spatial modulation of the magnetic field in superconductor/ ferromagnet (S/F) hybrids. Here we study the vortex confinement in S/F thin film heterostructures and we observe that vortex clusters appear near magnetization inhomogeneities in the ferromagnet, called bifurcations. We use magnetic force microscopy to image magnetic bifurcations and superconducting vortices, while high resolution scanning tunneling microscopy is used to obtain detailed information of the local electronic density of states outside and inside the vortex cluster. We find an intervortex spacing at the bifurcation shorter than the one predicted for the same superconductor in a uniform magnetic field equal to the thermodynamical upper critical field H-c2. This result is due to a local enhanced stray field and a competition between vortex-vortex repulsion and Lorentz force. Our findings suggest that special magnetic topologies could result in S/F hybrids that support superconductivity even when locally the vortex density exceeds the thermodynamic critical threshold value beyond which the superconductivity is destroyed. C1 [Di Giorgio, C.; Bobba, F.; Cucolo, A. M.; Scarfato, A.; D'Agostino, D.] Univ Salerno, ER Caianiello Phys Dept, I-84084 Fisciano, SA, Italy. [Di Giorgio, C.; Moore, S. A.; Iavarone, M.] Temple Univ, Phys Dept, Philadelphia, PA 19122 USA. [Bobba, F.; Cucolo, A. M.] CNR SPIN Salerno, I-84084 Fisciano, SA, Italy. [Karapetrov, G.] Drexel Univ, Phys Dept, Philadelphia, PA 19104 USA. [Novosad, V.; Yefremenko, V.] Argonne Natl Lab, Mat Sci Div, 9700 S Cass Ave, Argonne, IL 60439 USA. [Novosad, V.] Natl Univ Sci & Technol MISiS, Moscow 119049, Russia. [Scarfato, A.] Univ Geneva, Dept Condensed Matter Phys, Geneva, Switzerland. RP Di Giorgio, C (reprint author), Univ Salerno, ER Caianiello Phys Dept, I-84084 Fisciano, SA, Italy.; Di Giorgio, C (reprint author), Temple Univ, Phys Dept, Philadelphia, PA 19122 USA. EM cdigiorgio@unisa.it RI Novosad, V /J-4843-2015 FU US. Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES), Division of Materials Sciences and Engineering [DE-SC0004556]; US. Department of Energy (DOE), Office of Sciences, Basic Energy Sciences (BES) [DE-AC02-06CH11357]; MIUR (Italian Ministry for Higher Education and Research) under the project "Rientro dei Cervelli"; MIUR (Ministry of Education, Universities and Research of the Italian Government); Ministry of Education and Science of the Russian Federation [K3-2016-034, 211] FX Work done at Temple University was supported by the US. Department of Energy (DOE), Office of Science, Basic Energy Sciences (BES), Division of Materials Sciences and Engineering, under Grant No. DE-SC0004556. Work at Argonne National Laboratory was supported by the US. Department of Energy (DOE), Office of Sciences, Basic Energy Sciences (BES), under Grant No. DE-AC02-06CH11357. We also acknowledge the support of the MIUR (Italian Ministry for Higher Education and Research) under the project "Rientro dei Cervelli". C.D.G and D.D.A. would like to acknowledge the financial support from MIUR (Ministry of Education, Universities and Research of the Italian Government). The support of the Ministry of Education and Science of the Russian Federation in the framework of Increase Competitiveness Program of NUST "MISiS" (NoK3-2016-034), implemented by a governmental decree dated 16th of March 2013, N 211 is gratefully acknowledged. We acknowledge useful discussion with A. Buzdin (University of Bordeaux, France) and M. Velez (Universidad de Oviedo-CINN, Spain) and we are grateful to A. Aladyshkin (Institute for Physics of Microstructures RAS, Nizhny Novgorod, Russia) for careful reading of the manuscript. NR 69 TC 0 Z9 0 U1 27 U2 27 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 9 PY 2016 VL 6 AR 38557 DI 10.1038/srep38557 PG 11 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE3ZK UT WOS:000389541100001 PM 27934898 ER PT J AU Ziatdinov, M Fujii, S Kiguchi, M Enoki, T Jesse, S Kalinin, SV AF Ziatdinov, Maxim Fujii, Shintaro Kiguchi, Manabu Enoki, Toshiaki Jesse, Stephen Kalinin, Sergei V. TI Data mining graphene: correlative analysis of structure and electronic degrees of freedom in graphenic monolayers with defects SO NANOTECHNOLOGY LA English DT Article DE scanning probe microscopy; direct data mining; graphene; correlative analysis ID CANONICAL CORRELATION-ANALYSIS; TRANSITION-TEMPERATURE; OXIDE AB The link between changes in the material crystal structure and its mechanical, electronic, magnetic and optical functionalities-known as the structure-property relationship-is the cornerstone of modern materials science research. The recent advances in scanning transmission electron and scanning probe microscopies (STEM and SPM) have opened an unprecedented path towards examining the structure-property relationships of materials at the single-impurity and atomic-configuration levels. However, there are no statistics-based approaches for cross-correlation of structure and property variables obtained from the different information channels of STEM and SPM experiments. Here we have designed an approach based on a combination of sliding window fast Fourier transform, Pearson correlation matrix and linear and kernel canonical correlation methods to study the relationship between lattice distortions and electron scattering from SPM data on graphene with defects. Our analysis revealed that the strength of coupling to strain is altered between different scattering channels, which can explain the coexistence of several quasiparticle interference patterns in nanoscale regions of interest. In addition, the application of kernel functions allowed us to extract a non-linear component of the relationship between the lattice strain and scattering intensity in graphene. The outlined approach can be further used to analyze correlations in various multi-modal imaging techniques where the information of interest is spatially distributed and generally has a complex multi-dimensional nature. C1 [Ziatdinov, Maxim; Jesse, Stephen; Kalinin, Sergei V.] Oak Ridge Natl Lab, Inst Funct Imaging Mat, Oak Ridge, TN 37831 USA. [Ziatdinov, Maxim; Jesse, Stephen; Kalinin, Sergei V.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. [Fujii, Shintaro; Kiguchi, Manabu; Enoki, Toshiaki] Tokyo Inst Technol, Dept Chem, Tokyo 1528551, Japan. RP Ziatdinov, M (reprint author), Oak Ridge Natl Lab, Inst Funct Imaging Mat, Oak Ridge, TN 37831 USA.; Ziatdinov, M (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. EM ziatdinovma@ornl.gov; sergei2@ornl.gov RI Kiguchi, Manabu/F-2856-2013 FU Division of Materials Sciences and Engineering, Office of Science, Basic Energy Sciences, US Department of Energy; Center for Nanophase Materials Sciences; Ministry of Education, Culture, Sports, Science and Technology of Japan [20001006, 23750150, 25790002]; UT-Battelle, LLC [DE-AC0500OR22725]; US Department of Energy; United States Government FX This research was sponsored by the Division of Materials Sciences and Engineering, Office of Science, Basic Energy Sciences, US Department of Energy (MZ and SVK). Research was conducted at the Center for Nanophase Materials Sciences, which also provided support (SJ) and is a DOE Office of Science User Facility. SF, MK and TE acknowledge support from Grants-in-Aid for Scientific Research (nos 20001006, 23750150 and 25790002) from the Ministry of Education, Culture, Sports, Science and Technology of Japan. MZ thanks Rama K Vasudevan (ORNL) for proofreading the manuscript. Notice: This manuscript has been authored by UT-Battelle, LLC, under contract no. DE-AC0500OR22725 with the US Department of Energy. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a non-exclusive, paid-up, irrevocable, world-wide license to publish or reproduce the published form of this manuscript, or allow others to do so, for the United States Government purposes. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan (http://energy.gov/downloads/doe-public-access-plan). NR 36 TC 0 Z9 0 U1 15 U2 15 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0957-4484 EI 1361-6528 J9 NANOTECHNOLOGY JI Nanotechnology PD DEC 9 PY 2016 VL 27 IS 49 AR 495703 DI 10.1088/0957-4484/27/49/495703 PG 9 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied SC Science & Technology - Other Topics; Materials Science; Physics GA EC6GJ UT WOS:000388234200002 PM 27827348 ER PT J AU Khachatryan, V Sirunyan, AM Tumasyan, A Adam, W Asilar, E Bergauer, T Brandstetter, J Brondolin, E Dragicevic, M Ero, J Flechl, M Friedl, M Fruhwirth, R Ghete, VM Hartl, C Hormann, N Hrubec, J Jeitler, M Konig, A Kratschmer, I Liko, D Matsushita, T Mikulec, I Rabady, D Rad, N Rahbaran, B Rohringer, H Schieck, J Strauss, J Treberer-Treberspurg, W Waltenberger, W Wulz, CE Mossolov, V Shumeiko, N Gonzalez, JS Alderweireldt, S De Wolf, EA Janssen, X Lauwers, J Van de Klundert, M Van Haevermaet, H Van Mechelen, P Van Remortel, N Van 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Roberts, J. Rorie, J. Tu, Z. Zabel, J. Betchart, B. Bodek, A. de Barbaro, P. Demina, R. Duh, Y. T. Ferbel, T. Galanti, M. Garcia-Bellido, A. Han, J. Hindrichs, O. Khukhunaishvili, A. Lo, K. H. Tan, P. Verzetti, M. Chou, J. P. Contreras-Campana, E. Gershtein, Y. Espinosa, T. A. Gomez Halkiadakis, E. Heindl, M. Hidas, D. Hughes, E. Kaplan, S. Elayavalli, R. Kunnawalkam Kyriacou, S. Lath, A. Nash, K. Saka, H. Salur, S. Schnetzer, S. Sheffield, D. Somalwar, S. Stone, R. Thomas, S. Thomassen, P. Walker, M. Foerster, M. Heideman, J. Riley, G. Rose, K. Spanier, S. Thapa, K. Bouhali, O. Celik, A. Dalchenko, M. De Mattia, M. Delgado, A. Dildick, S. Eusebi, R. Gilmore, J. Huang, T. Juska, E. Kamon, T. Mueller, R. Pakhotin, Y. Patel, R. Perloff, A. Pernie, L. Rathjens, D. Rose, A. Safonov, A. Tatarinov, A. Ulmer, K. A. Akchurin, N. Cowden, C. Damgov, J. Dragoiu, C. Dudero, P. R. Faulkner, J. Kunori, S. Lamichhane, K. Lee, S. W. Libeiro, T. Undleeb, S. Volobouev, I. Wang, Z. Delannoy, A. G. Greene, S. Gurrola, A. Janjam, R. Johns, W. Maguire, C. Melo, A. Ni, H. Sheldon, P. Tuo, S. Velkovska, J. Xu, Q. Arenton, M. W. Barria, P. Cox, B. Goodell, J. Hirosky, R. Ledovskoy, A. Li, H. Neu, C. Sinthuprasith, T. Sun, X. Wang, Y. Wolfe, E. Xia, F. Clarke, C. Harr, R. Karchin, P. E. Lamichhane, P. Sturdy, J. Belknap, D. A. Dasu, S. Dodd, L. Duric, S. Gomber, B. Grothe, M. Herndon, M. Herve, A. Klabbers, P. Lanaro, A. Levine, A. Long, K. Loveless, R. Ojalvo, I. Perry, T. Pierro, G. A. Polese, G. Ruggles, T. Savin, A. Sharma, A. Smith, N. Smith, W. H. Taylor, D. Woods, N. CA CMS Collaboration TI Studies of inclusive four-jet production with two b-tagged jets in proton-proton collisions at 7 TeV SO PHYSICAL REVIEW D LA English DT Article AB Measurements are presented of the cross section for the production of at least four jets, of which at least two originate from b quarks, in proton-proton collisions. Data collected with the CMS detector at the LHC at a center-of-mass energy of 7 TeV are used, corresponding to an integrated luminosity of 3 pb(-1). The cross section is measured as a function of the jet transverse momentum for p(T) > 20 GeV, and of the jet pseudorapidity for |eta| < 2.4 (b jets), 4.7 (untagged jets). The correlations in azimuthal angle and pT between the jets are also studied. The inclusive cross section is measured to be sigma(pp -> 2b + 2j + X) = 69 +/- 3(stat) +/- 24(syst) nb. The eta and p(T) distributions of the four jets and the correlations between them are well reproduced by event generators that combine perturbative QCD calculations at next-to-leading-order accuracy with contributions from parton showers and multiparton interactions. C1 [Khachatryan, V.; Sirunyan, A. M.; Tumasyan, A.; Abdulsalam, A.] Yerevan Phys Inst, Yerevan, Armenia. 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L.; Ujvari, B.] Univ Debrecen, Debrecen, Hungary. [Bahinipati, S.; Choudhury, S.; Mal, P.; Mandal, K.; Nayak, A.; Sahoo, D. K.; Sahoo, N.; Swain, S. K.] Natl Inst Sci Educ & Res, Bhubaneswar, Orissa, India. [Bansal, S.; Beri, S. B.; Bhatnagar, V.; Chawla, R.; Bhawandeep, U.; Kalsi, A. K.; Kaur, A.; Kaur, M.; Kumar, R.; Mehta, A.; Mittal, M.; Singh, J. B.; Walia, G.] Panjab Univ, Chandigarh, India. [Kumar, Ashok; Bhardwaj, A.; Choudhary, B. C.; Garg, R. B.; Keshri, S.; Kumar, A.; Malhotra, S.; Naimuddin, M.; Nishu, N.; Ranjan, K.; Sharma, R.; Sharma, V.] Univ Delhi, Delhi, India. [Bhattacharya, R.; Bhattacharya, S.; Chatterjee, K.; Dey, S.; Dutt, S.; Dutta, S.; Ghosh, S.; Majumdar, N.; Modak, A.; Mondal, K.; Mukhopadhyay, S.; Nandan, S.; Purohit, A.; Roy, A.; Roy, D.; Chowdhury, S. Roy; Sarkar, S.; Sharan, M.; Thakur, S.] Saha Inst Nucl Phys, Kolkata, India. [Behera, P. K.] Indian Inst Technol Madras, Madras, Tamil Nadu, India. [Chudasama, R.; Dutta, D.; Jha, V.; Kumar, V.; Mohanty, A. K.; Netrakanti, P. K.; Pant, L. M.; Shukla, P.; Topkar, A.] Bhabha Atom Res Ctr, Mumbai, Maharashtra, India. [Aziz, T.; Dugad, S.; Kole, G.; Mahakud, B.; Mitra, S.; Mohanty, G. B.; Sur, N.; Sutar, B.] Tata Inst Fundamental Res A, Mumbai, Maharashtra, India. [Banerjee, S.; Bhowmik, S.; Dewanjee, R. K.; Ganguly, S.; Guchait, M.; Jain, Sa.; Kumar, S.; Maity, M.; Majumder, G.; Mazumdar, K.; Parida, B.; Sarkar, T.; Wickramage, N.] Tata Inst Fundamental Res B, Mumbai, Maharashtra, India. [Chauhan, S.; Dube, S.; Kapoor, A.; Kothekar, K.; Rane, A.; Sharma, S.] IISER, Pune, Maharashtra, India. [Behnamian, H.; Chenarani, S.; Tadavani, E. Eskandari; Etesami, S. M.; Fahim, A.; Khakzad, M.; Najafabadi, M. Mohammadi; Naseri, M.; Mehdiabadi, S. Paktinat; Hosseinabadi, F. Rezaei; Safarzadeh, B.; Zeinali, M.] Inst Res Fundamental Sci IPM, Tehran, Iran. [Felcini, M.; Grunewald, M.] Univ Coll Dublin, Dublin, Ireland. [Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iaselli, G.; Maggi, G.; Maggi, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Silvestris, L.; Venditti, R.; Verwilligen, P.] Politecn Bari, Ist Nazl Fis Nucl, Sez Bari, Bari, Italy. [Abbrescia, M.; Calabria, C.; Caputo, C.; Cristella, L.; De Palma, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Radogna, R.; Selvaggi, G.; Venditti, R.] Univ Bari, Politecn Bari, Bari, Italy. [Creanza, D.; De Filippis, N.; Iaselli, G.; Maggi, G.; Pugliese, G.] Politecn Bari, Bari, Italy. [Abbiendi, G.; Battilana, C.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Ist Nazl Fis Nucl, Sez Bologna, Bologna, Italy. [Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Fanfani, A.; Fasanella, D.; Guiducci, L.; Navarria, F. L.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Univ Bologna, Bologna, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Ist Nazl Fis Nucl, Sez Catania, Catania, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Univ Catania, Catania, Italy. [Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Meschini, M.; Paoletti, S.; Sguazzoni, G.; Viliani, L.] Ist Nazl Fis Nucl, Sez Firenze, Florence, Italy. [Ciulli, V.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Viliani, L.] Univ Florence, Florence, Italy. [Benussi, L.; Bianco, S.; Fabbri, F.; Piccolo, D.; Primavera, F.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Calvelli, V.; Ferro, F.; Lo Vetere, M.; Monge, M. R.; Robutti, E.; Tosi, S.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Calvelli, V.; Lo Vetere, M.; Monge, M. R.; Tosi, S.] Univ Genoa, Genoa, Italy. [Brianza, L.; Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Ghezzi, A.; Govoni, P.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Pigazzini, S.; Ragazzi, S.; de Fatis, T. Tabarelli] Ist Nazl Fis Nucl, Sez Milano Bicocca, Milan, Italy. [Dinardo, M. E.; Fiorendi, S.; Ghezzi, A.; Govoni, P.; Manzoni, R. A.; Marzocchi, B.; Paganoni, M.; Ragazzi, S.; de Fatis, T. Tabarelli] Univ Milano Bicocca, Milan, Italy. [Buontempo, S.; Cavallo, N.; De Nardo, G.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Paolucci, P.; Sciacca, C.; Thyssen, F.] Ist Nazl Fis Nucl, Sez Napoli, Naples, Italy. [Esposito, M.; Iorio, A. O. M.; Sciacca, C.] Univ Naples Federico II, Naples, Italy. [Cavallo, N.; Fabozzi, F.] Univ Basilicata, Potenza, Italy. [Cavallo, N.; Di Guida, S.; Fabozzi, F.; Meola, S.] Univ G Marconi, Rome, Italy. [Di Guida, S.; Meola, S.] Univ G Marconi, Potenza, Italy. [Azzi, P.; Bacchetta, N.; Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; De Oliveira, A. Carvalho Antunes; Checchia, P.; Dall'Osso, M.; Manzano, P. De Castro; Dorigo, T.; Dosselli, U.; Gasparini, F.; Gasparini, U.; Gozzelino, A.; Lacaprara, S.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Torassa, E.; Zanetti, M.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Ist Nazl Fis Nucl, Sez Padova, Padua, Italy. [Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; De Oliveira, A. Carvalho Antunes; Dall'Osso, M.; Gasparini, F.; Gasparini, U.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Univ Padua, Padua, Italy. Univ Trento, Trento, Italy. [Braghieri, A.; Magnani, A.; Montagna, P.; Ratti, S. P.; Re, V.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Univ Pavia, Pavia, Italy. [Solestizi, L. Alunni; Bilei, G. M.; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Menichelli, M.; Saha, A.; Santocchia, A.] Ist Nazl Fis Nucl, Sez Perugia, Perugia, Italy. [Solestizi, L. Alunni; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Santocchia, A.] Univ Perugia, Perugia, Italy. [Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Donato, S.; Fedi, G.; Giassi, A.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Tonelli, G.] Univ Pisa, Pisa, Italy. [Donato, S.; Ligabue, F.] Scuola Normale Super Pisa, Pisa, Italy. [Barone, L.; Cavallari, F.; Cipriani, M.; D'imperio, G.; Del Re, D.; Diemoz, M.; Gelli, S.; Jorda, C.; Longo, E.; Margaroli, F.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Barone, L.; Cipriani, M.; D'imperio, G.; Del Re, D.; Gelli, S.; Longo, E.; Margaroli, F.; Organtini, G.; Preiato, F.; Rahatlou, S.; Santanastasio, F.] Univ Rome, Rome, Italy. [Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bartosik, N.; Bellan, R.; Biino, C.; Cartiglia, N.; Costa, M.; Covarelli, R.; De Remigis, P.; Degano, A.; Demaria, N.; Finco, L.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Shchelina, K.; Sola, V.; Solano, A.; Staiano, A.; Traczyk, P.] Ist Nazl Fis Nucl, Sez Torino, Turin, Italy. [Amapane, N.; Argiro, S.; Bellan, R.; Costa, M.; Covarelli, R.; Degano, A.; Finco, L.; Kiani, B.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Sacchi, R.; Shchelina, K.; Solano, A.; Traczyk, P.] Univ Turin, Turin, Italy. [Arcidiacono, R.; Arneodo, M.; Ruspa, M.] Univ Piemonte Orientale, Novara, Italy. [Belforte, S.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; La Licata, C.; Schizzi, A.; Zanetti, A.] Ist Nazl Fis Nucl, Sez Trieste, Trieste, Italy. [Della Ricca, G.; La Licata, C.; Schizzi, A.] Univ Trieste, Trieste, Italy. [Kim, D. H.; Kim, G. N.; Kim, M. S.; Lee, S.; Lee, S. W.; Oh, Y. D.; Sekmen, S.; Son, D. C.; Yang, Y. C.] Kyungpook Natl Univ, Daegu, South Korea. [Lee, A.] Chonbuk Natl Univ, Jeonju, South Korea. [Cifuentes, J. A. Brochero; Kim, T. J.] Hanyang Univ, Seoul, South Korea. [Cho, S.; Choi, S.; Go, Y.; Gyun, D.; Ha, S.; Hong, B.; Jo, Y.; Kim, Y.; Lee, B.; Lee, K.; Lee, K. S.; Lee, S.; Lim, J.; Park, S. K.; Roh, Y.] Korea Univ, Seoul, South Korea. [Almond, J.; Kim, J.; Oh, S. B.; Seo, S. H.; Yang, U. K.; Yoo, H. D.; Yu, G. B.] Seoul Natl Univ, Seoul, South Korea. [Choi, M.; Kim, H.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.] Univ Seoul, Seoul, South Korea. [Choi, Y.; Goh, J.; Hwang, C.; Lee, J.; Yu, I.] Sungkyunkwan Univ, Suwon, South Korea. [Dudenas, V.; Juodagalvis, A.; Vaitkus, J.] Vilnius Univ, Vilnius, Lithuania. [Ahmed, I.; Ibrahim, Z. A.; Komaragiri, J. R.; Ali, M. A. B. Md; Idris, F. Mohamad; Abdullah, W. A. T. Wan; Yusli, M. N.; Zolkapli, Z.] Univ Malaya, Natl Ctr Particle Phys, Kuala Lumpur, Malaysia. [Castilla-Valdez, H.; De La Cruz-Burelo, E.; Heredia-De La Cruz, I.; Hernandez-Almada, A.; Lopez-Fernandez, R.; Mejia Guisao, J.; Sanchez-Hernandez, A.] IPN, Ctr Invest & Estudios Avanzados, Mexico City, DF, Mexico. [Carrillo Moreno, S.; Oropeza Barrera, C.; Vazquez Valencia, F.] Univ Iberoamer, Mexico City, DF, Mexico. [Carpinteyro, S.; Pedraza, I.; Salazar Ibarguen, H. A.; Uribe Estrada, C.] Benemerita Univ Autonoma Puebla, Puebla, Mexico. [Morelos Pineda, A.] Univ Autonoma San Luis Potosi, San Luis Potosi, Mexico. [Krofcheck, D.] Univ Auckland, Auckland, New Zealand. [Butler, P. H.] Univ Canterbury, Christchurch, New Zealand. [Ahmad, A.; Ahmad, M.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Shah, M. A.; Shoaib, M.; Waqas, M.] Quaid I Azam Univ, Natl Ctr Phys, Islamabad, Pakistan. [Bialkowska, H.; Bluj, M.; Boimska, B.; Frueboes, T.; Gorski, M.; Kazana, M.; Nawrocki, K.; Romanowska-Rybinska, K.; Szleper, M.; Zalewski, P.] Natl Ctr Nucl Res, Otwock, Poland. [Bunkowski, K.; Byszuk, A.; Doroba, K.; Kalinowski, A.; Konecki, M.; Krolikowski, J.; Misiura, M.; Olszewski, M.; Walczak, M.] Univ Warsaw, Fac Phys, Inst Expt Phys, Warsaw, Poland. [Bargassa, P.; Da Cruz E Silva, C. Beirao; Di Francesco, A.; Faccioli, P.; Ferreira Parracho, P. G.; Gallinaro, M.; Hollar, J.; Leonardo, N.; Lloret Iglesias, L.; Nemallapudi, M. V.; Rodrigues Antunes, J.; Seixas, J.; Toldaiev, O.; Vadruccio, D.; Varela, J.; Vischia, P.] Lab Instrumentacao & Fis Expt Particulas, Lisbon, Portugal. [Afanasiev, S.; Gavrilenko, M.; Golutvin, I.; Karjavin, V.; Korenkov, V.; Lanev, A.; Malakhov, A.; Matveev, V.; Mitsyn, V. V.; Moisenz, P.; Palichik, V.; Perelygin, V.; Shmatov, S.; Skatchkov, N.; Smirnov, V.; Tikhonenko, E.; Voytishin, N.; Yuldashev, B. S.; Zarubin, A.] Joint Inst Nucl Res, Dubna, Russia. [Chtchipounov, L.; Golovtsov, V.; Ivanov, Y.; Kim, V.; Kuznetsova, E.; Murzin, V.; Oreshkin, V.; Sulimov, V.; Vorobyev, A.] Petersburg Nucl Phys Inst, St Petersburg, Russia. [Andreev, Yu.; Dermenev, A.; Gninenko, S.; Golubev, N.; Karneyeu, A.; Kirsanov, M.; Krasnikov, N.; Pashenkov, A.; Tlisov, D.; Toropin, A.] Inst Nucl Res, Moscow, Russia. [Epshteyn, V.; Gavrilov, V.; Lychkovskaya, N.; Popov, V.; Pozdnyakov, I.; Safronov, G.; Spiridonov, A.; Toms, M.; Vlasov, E.; Zhokin, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Chistov, R.; Rusinov, V.; Tarkovskii, E.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Andreev, V.; Azarkin, M.; Dremin, I.; Kirakosyan, M.; Leonidov, A.; Rusakov, S. V.; Terkulov, A.] PN Lebedev Phys Inst, Moscow, Russia. [Baskakov, A.; Belyaev, A.; Boos, E.; Ershov, A.; Gribushin, A.; Khein, L.; Klyukhin, V.; Kodolova, O.; Lokhtin, I.; Lukina, O.; Miagkov, I.; Obraztsov, S.; Petrushanko, S.; Savrin, V.; Snigirev, A.; Musella, P.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Azhgirey, I.; Bayshev, I.; Bitioukov, S.; Elumakhov, D.; Kachanov, V.; Kalinin, A.; Konstantinov, D.; Krychkine, V.; Petrov, V.; Ryutin, R.; Sobol, A.; Troshin, S.; Tyurin, N.; Uzunian, A.; Volkov, A.] State Res Ctr Russian Federat, Inst High Energy Phys, Protvino, Russia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Milosevic, J.; Rekovic, V.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Milosevic, J.; Rekovic, V.] Vinca Inst Nucl Sci, Belgrade, Serbia. [Alcaraz Maestre, J.; Calvo, E.; Cerrada, M.; Chamizo Llatas, M.; Colino, N.; De La Cruz, B.; Delgado Peris, A.; Escalante Del Valle, A.; Fernandez Bedoya, C.; Fernandez Ramos, J. P.; Flix, J.; Fouz, M. C.; Garcia-Abia, P.; Gonzalez Lopez, O.; Goy Lopez, S.; Hernandez, J. M.; Josa, M. I.; Navarro De Martino, E.; Perez-Calero Yzquierdo, A.; Puerta Pelayo, J.; Quintario Olmeda, A.; Redondo, I.; Romero, L.; Soares, M. S.] CIEMAT, Madrid, Spain. [de Troconiz, J. F.; Missiroli, M.; Moran, D.] Univ Autonoma Madrid, Madrid, Spain. [Cuevas, J.; Fernandez Menendez, J.; Gonzalez Caballero, I.; Gonzalez Fernandez, J. R.; Palencia Cortezon, E.; Sanchez Cruz, S.; Suarez Andres, I.; Garcia, J. M. Vizan] Univ Oviedo, Oviedo, Spain. [Cabrillo, I. J.; Calderon, A.; Castineiras De Saa, J. R.; Curras, E.; Fernandez, M.; Garcia-Ferrero, J.; Gomez, G.; Lopez Virto, A.; Marco, J.; Martinez Rivero, C.; Matorras, F.; Piedra Gomez, J.; Rodrigo, T.; Ruiz-Jimeno, A.; Scodellaro, L.; Trevisani, N.; Vila, I.; Vilar Cortabitarte, R.] Univ Cantabria, CSIC, Inst Fis Cantabria IFCA, Santander, Spain. [Abbaneo, D.; Auffray, E.; Auzinger, G.; Bachtis, M.; Baillon, P.; Ball, A. H.; Barney, D.; Bloch, P.; Bocci, A.; Bonato, A.; Botta, C.; Camporesi, T.; Castello, R.; Cepeda, M.; Cerminara, G.; D'Alfonso, M.; d'Enterria, D.; Dabrowski, A.; Daponte, V.; David, A.; De Gruttola, M.; De Guio, F.; De Roeck, A.; Di Marco, E.; Dobson, M.; Dordevic, M.; Dorney, B.; Du Pree, T.; Duggan, D.; Dunser, M.; Dupont, N.; Elliott-Peisert, A.; Fartoukh, S.; Franzoni, G.; Fulcher, J.; Funk, W.; Gigi, D.; Gill, K.; Girone, M.; Glege, F.; Gulhan, D.; Gundacker, S.; Guthoff, M.; Hammer, J.; Harris, P.; Hegeman, J.; Innocente, V.; Janot, P.; Kirschenmann, H.; Knunz, V.; Kornmayer, A.; Kortelainen, M. J.; Kousouris, K.; Krammer, M.; Lecoq, P.; Lourenco, C.; Lucchini, M. T.; Malgeri, L.; Mannelli, M.; Martelli, A.; Meijers, F.; Mersi, S.; Meschi, E.; Moortgat, F.; Morovic, S.; Mulders, M.; Neugebauer, H.; Orfanelli, S.; Orsini, L.; Pape, L.; Perez, E.; Peruzzi, M.; Petrilli, A.; Petrucciani, G.; Pfeiffer, A.; Pierini, M.; Racz, A.; Reis, T.; Rolandi, G.; Rovere, M.; Ruan, M.; Sakulin, H.; Sauvan, J. B.; Schafer, C.; Schwick, C.; Seidel, M.; Sharma, A.; Silva, P.; Simon, M.; Sphicas, P.; Steggemann, J.; Stoye, M.; Takahashi, Y.; Tosi, M.; Treille, D.; Triossi, A.; Tsirou, A.; Veckalns, V.; Veres, G. I.; Wardle, N.; Zagozdzinska, A.; Zeuner, W. D.] CERN, European Org Nucl Res, Geneva, Switzerland. [Bertl, W.; Deiters, K.; Erdmann, W.; Horisberger, R.; Ingram, Q.; Kaestli, H. C.; Kotlinski, D.; Langenegger, U.; Rohe, T.] Paul Scherrer Inst, Villigen, Switzerland. [Bachmair, F.; Bani, L.; Bianchini, L.; Casal, B.; Dissertori, G.; Dittmar, M.; Donega, M.; Eller, P.; Grab, C.; Heidegger, C.; Hits, D.; Hoss, J.; Kasieczka, G.; Lecomte, P.; Lustermann, W.; Mangano, B.; Marionneau, M.; del Arbol, P. Martinez Ruiz; Masciovecchio, M.; Meinhard, M. T.; Meister, D.; Micheli, F.; Musella, P.; Nessi-Tedaldi, F.; Pandolfi, F.; Pata, J.; Pauss, F.; Perrin, G.; Perrozzi, L.; Quittnat, M.; Rossini, M.; Schonenberger, M.; Starodumov, A.; Takahashi, M.; Tavolaro, V. R.; Theofilatos, K.; Wallny, R.; Aarrestad, T. K.] Swiss Fed Inst Technol, Inst Particle Phys, Zurich, Switzerland. [Amsler, C.; Caminada, L.; Canelli, M. F.; Chiochia, V.; De Cosa, A.; Galloni, C.; Hinzmann, A.; Hreus, T.; Kilminster, B.; Lange, C.; Ngadiuba, J.; Pinna, D.; Rauco, G.; Robmann, P.; Salerno, D.; Yang, Y.] Univ Zurich, Zurich, Switzerland. [Candelise, V.; Doan, T. H.; Jain, Sh.; Khurana, R.; Konyushikhin, M.; Kuo, C. M.; Lin, W.; Lu, Y. J.; Pozdnyakov, A.; Yu, S. S.] Natl Cent Univ, Chungli, Taiwan. [Kumar, Arun; Chang, P.; Chang, Y. H.; Chang, Y. W.; Chao, Y.; Chen, K. F.; Chen, P. H.; Dietz, C.; Fiori, F.; Hou, W. -S.; Hsiung, Y.; Liu, Y. F.; Lu, R. -S.; Minano Moya, M.; Paganis, E.; Psallidas, A.; Tsai, J. F.; Tzeng, Y. M.] NTU, Taipei, Taiwan. [Asavapibhop, B.; Singh, G.; Srimanobhas, N.; Suwonjandee, N.] Chulalongkorn Univ, Fac Sci, Dept Phys, Bangkok, Thailand. [Adiguzel, A.; Damarseckin, S.; Demiroglu, Z. S.; Dozen, C.; Eskut, E.; Girgis, S.; Gokbulut, G.; Guler, Y.; Gurpinar, E.; Hos, I.; Kangal, E. E.; Kara, O.; Topaksu, A. Kayis; Kiminsu, U.; Oglakci, M.; Onengut, G.; Ozdemir, K.; Ozturk, S.; Polatoz, A.; Tali, B.; Turkcapar, S.; Zorbakir, I. S.; Zorbilmez, C.] Cukurova Univ, Adana, Turkey. [Bilin, B.; Bilmis, S.; Isildak, B.; Karapinar, G.; Yalvac, M.; Zeyrek, M.] Middle East Tech Univ, Dept Phys, Ankara, Turkey. [Gulmez, E.; Kaya, M.; Kaya, O.; Yetkin, E. A.; Yetkin, T.] Bogazici Univ, Istanbul, Turkey. [Cakir, A.; Cankocak, K.; Sen, S.] Istanbul Tech Univ, Istanbul, Turkey. [Grynyov, B.] Natl Acad Sci Ukraine, Inst Scintillat Mat, Kharkov, Ukraine. [Levchuk, L.; Sorokin, P.] Kharkov Inst Phys & Technol, Natl Sci Ctr, Kharkov, Ukraine. [Aggleton, R.; Ball, F.; Beck, L.; Brooke, J. J.; Burns, D.; Clement, E.; Cussans, D.; Flacher, H.; Goldstein, J.; Grimes, M.; Heath, G. P.; Heath, H. F.; Jacob, J.; Kreczko, L.; Lucas, C.; Newbold, D. M.; Paramesvaran, S.; Poll, A.; Sakuma, T.; El Nasr-storey, S. Seif; Smith, D.; Smith, V. J.] Univ Bristol, Bristol, Avon, England. [Bell, K. W.; Belyaev, A.; Brew, C.; Brown, R. M.; Calligaris, L.; Cieri, D.; Cockerill, D. J. A.; Coughlan, J. A.; Harder, K.; Harper, S.; Olaiya, E.; Petyt, D.; Shepherd-Themistocleous, C. H.; Thea, A.; Tomalin, I. R.; Williams, T.] Rutherford Appleton Lab, Didcot, Oxon, England. [Baber, M.; Bainbridge, R.; Buchmuller, O.; Bundock, A.; Burton, D.; Casasso, S.; Citron, M.; Colling, D.; Corpe, L.; Dauncey, P.; Davies, G.; De Wit, A.; Della Negra, M.; Dunne, P.; Elwood, A.; Futyan, D.; Haddad, Y.; Hall, G.; Iles, G.; Lane, R.; Laner, C.; Lucas, R.; Lyons, L.; Magnan, A. -M.; Malik, S.; Mastrolorenzo, L.; Nash, J.; Nikitenko, A.; Pela, J.; Penning, B.; Pesaresi, M.; Raymond, D. M.; Richards, A.; Rose, A.; Seez, C.; Tapper, A.; Uchida, K.; Acosta, M. Vazquez; Virdee, T.; Zenz, S. C.] Imperial Coll, London, England. [Cole, J. E.; Hobson, P. R.; Khan, A.; Kyberd, P.; Leslie, D.; Reid, I. D.; Symonds, P.; Teodorescu, L.; Turner, M.] Brunel Univ, Uxbridge, Middx, England. [Borzou, A.; Call, K.; Dittmann, J.; Hatakeyama, K.; Liu, H.; Pastika, N.] Baylor Univ, Waco, TX 76798 USA. [Charaf, O.; Cooper, S. I.; Henderson, C.; Rumerio, P.] Univ Alabama, Tuscaloosa, AL 35487 USA. [Arcaro, D.; Avetisyan, A.; Bose, T.; Gastler, D.; Rankin, D.; Richardson, C.; Rohlf, J.; Sulak, L.; Zou, D.] Boston Univ, Boston, MA 02215 USA. [Benelli, G.; Berry, E.; Cutts, D.; Garabedian, A.; Hakala, J.; Heintz, U.; Hogan, J. M.; Jesus, O.; Laird, E.; Landsberg, G.; Mao, Z.; Narain, M.; Piperov, S.; Sagir, S.; Spencer, E.; Syarif, R.] Brown Univ, Providence, RI 02912 USA. [Breedon, R.; Breto, G.; Burns, D.; Sanchez, M. Calderon De La Barca; Chauhan, S.; Chertok, M.; Conway, J.; Conway, R.; Cox, P. T.; Erbacher, R.; Flores, C.; Funk, G.; Gardner, M.; Ko, W.; Lander, R.; Mclean, C.; Mulhearn, M.; Pellett, D.; Pilot, J.; Ricci-Tam, F.; Shalhout, S.; Smith, J.; Squires, M.; Stolp, D.; Tripathi, M.; Wilbur, S.; Yohay, R.] Univ Calif Davis, Davis, CA 95616 USA. [Cousins, R.; Everaerts, P.; Florent, A.; Hauser, J.; Ignatenko, M.; Saltzberg, D.; Takasugi, E.; Valuev, V.; Weber, M.] Univ Calif Los Angeles, Los Angeles, CA 90095 USA. [Burt, K.; Clare, R.; Ellison, J.; Gary, J. W.; Hanson, G.; Heilman, J.; Jandir, P.; Kennedy, E.; Lacroix, F.; Long, O. R.; Malberti, M.; Negrete, M. Olmedo; Paneva, M. I.; Shrinivas, A.; Wei, H.; Wimpenny, S.; Yates, B. R.] Univ Calif Riverside, Riverside, CA 92521 USA. [Branson, J. G.; Cerati, G. B.; Cittolin, S.; Derdzinski, M.; Gerosa, R.; Holzner, A.; Klein, D.; Krutelyov, V.; Letts, J.; Macneill, I.; Olivito, D.; Padhi, S.; Pieri, M.; Sani, M.; Sharma, V.; Simon, S.; Tadel, M.; Vartak, A.; Wasserbaech, S.; Welke, C.; Wood, J.; Wurthwein, F.; Yagil, A.; Della Porta, G. Zevi] Univ Calif San Diego, La Jolla, CA 92093 USA. [Bhandari, R.; Bradmiller-Feld, J.; Campagnari, C.; Dishaw, A.; Dutta, V.; Flowers, K.; Sevilla, M. Franco; Geffert, P.; George, C.; Golf, F.; Gouskos, L.; Gran, J.; Heller, R.; Incandela, J.; Mccoll, N.; Mullin, S. D.; Ovcharova, A.; Richman, J.; Stuart, D.; Suarez, I.; West, C.; Yoo, J.] Univ Calif Santa Barbara, Dept Phys, Santa Barbara, CA 93106 USA. [Anderson, D.; Apresyan, A.; Bendavid, J.; Bornheim, A.; Bunn, J.; Chen, Y.; Duarte, J.; Mott, A.; Newman, H. B.; Pena, C.; Spiropulu, M.; Vlimant, J. R.; Xie, S.; Zhu, R. Y.] CALTECH, Pasadena, CA 91125 USA. [Andrews, M. B.; Azzolini, V.; Carlson, B.; Ferguson, T.; Paulini, M.; Russ, J.; Sun, M.; Vogel, H.; Vorobiev, I.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Cumalat, J. P.; Ford, W. T.; Jensen, F.; Johnson, A.; Krohn, M.; Mulholland, T.; Stenson, K.; Wagner, S. R.] Univ Colorado, Boulder, CO 80309 USA. [Alexander, J.; Chaves, J.; Chu, J.; Dittmer, S.; Mcdermott, K.; Mirman, N.; Kaufman, G. Nicolas; Patterson, J. R.; Rinkevicius, A.; Ryd, A.; Skinnari, L.; Soffi, L.; Tan, S. M.; Tao, Z.; Thom, J.; Tucker, J.; Wittich, P.; Zientek, M.] Cornell Univ, Ithaca, NY 14853 USA. [Winn, D.] Fairfield Univ, Fairfield, CT 06430 USA. [Abdullin, S.; Albrow, M.; Apollinari, G.; Banerjee, S.; Bauerdick, L. A. T.; Beretvas, A.; Berryhill, J.; Bhat, P. C.; Bolla, G.; Burkett, K.; Butler, J. N.; Cheung, H. W. K.; Chlebana, F.; Cihangir, S.; Cremonesi, M.; Elvira, V. D.; Fisk, I.; Freeman, J.; Gottschalk, E.; Gray, L.; Green, D.; Grunendahl, S.; Gutsche, O.; Hare, D.; Harris, R. M.; Hasegawa, S.; Hirschauer, J.; Hu, Z.; Jayatilaka, B.; Jindariani, S.; Johnson, M.; Joshi, U.; Klima, B.; Kreis, B.; Lammel, S.; Linacre, J.; Lincoln, D.; Lipton, R.; Liu, T.; De Sa, R. Lopes; Lykken, J.; Maeshima, K.; Magini, N.; Marraffino, J. M.; Maruyama, S.; Mason, D.; McBride, P.; Merkel, P.; Mrenna, S.; Nahn, S.; Newman-Holmes, C.; O'Dell, V.; Pedro, K.; Prokofyev, O.; Rakness, G.; Ristori, L.; Sexton-Kennedy, E.; Soha, A.; Spalding, W. J.; Spiegel, L.; Stoynev, S.; Strobbe, N.; Taylor, L.; Tkaczyk, S.; Tran, N. V.; Uplegger, L.; Vaandering, E. W.; Vernieri, C.; Verzocchi, M.; Vidal, R.; Wang, M.; Weber, H. A.; Whitbeck, A.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Acosta, D.; Avery, P.; Bortignon, P.; Bourilkov, D.; Brinkerhoff, A.; Carnes, A.; Carver, M.; Curry, D.; Das, S.; Field, R. D.; Furic, I. K.; Konigsberg, J.; Korytov, A.; Ma, P.; Matchev, K.; Mei, H.; Milenovic, P.; Mitselmakher, G.; Rank, D.; Shchutska, L.; Sperka, D.; Thomas, L.; Wang, J.; Wang, S.; Yelton, J.] Univ Florida, Gainesville, FL 32611 USA. [Linn, S.; Markowitz, P.; Martinez, G.; Rodriguez, J. L.] Florida Int Univ, Miami, FL 33199 USA. [Ackert, A.; Adams, J. R.; Adams, T.; Askew, A.; Bein, S.; Diamond, B.; Hagopian, S.; Hagopian, V.; Johnson, K. F.; Khatiwada, A.; Prosper, H.; Santra, A.; Weinberg, M.] Florida State Univ, Tallahassee, FL 32306 USA. [Baarmand, M. M.; Bhopatkar, V.; Colafranceschi, S.; Hohlmann, M.; Noonan, D.; Roy, T.; Yumiceva, F.] Florida Inst Technol, Melbourne, FL 32901 USA. [Adams, M. R.; Apanasevich, L.; Berry, D.; Betts, R. R.; Bucinskaite, I.; Cavanaugh, R.; Evdokimov, O.; Gauthier, L.; Gerber, C. E.; Hofman, D. J.; Kurt, P.; O'Brien, C.; Gonzalez, I. D. Sandoval; Turner, P.; Varelas, N.; Wang, H.; Wu, Z.; Zakaria, M.; Zhang, J.] UIC, Chicago, IL 60607 USA. [Bilki, B.; Clarida, W.; Dilsiz, K.; Durgut, S.; Gandrajula, R. P.; Haytmyradov, M.; Khristenko, V.; Merlo, J. -P.; Mermerkaya, H.; Mestvirishvili, A.; Moeller, A.; Nachtman, J.; Ogul, H.; Onel, Y.; Ozok, F.; Penzo, A.; Snyder, C.; Tiras, E.; Wetzel, J.; Yi, K.] Univ Iowa, Iowa City, IA 52242 USA. [Anderson, I.; Blumenfeld, B.; Cocoros, A.; Eminizer, N.; Fehling, D.; Feng, L.; Gritsan, A. V.; Maksimovic, P.; Osherson, M.; Roskes, J.; Sarica, U.; Swartz, M.; Xiao, M.; Xin, Y.; You, C.] Johns Hopkins Univ, Baltimore, MD 21218 USA. [Al-bataineh, A.; Baringer, P.; Bean, A.; Bowen, J.; Bruner, C.; Castle, J.; Kenny, R. P., III; Kropivnitskaya, A.; Majumder, D.; Mcbrayer, W.; Murray, M.; Sanders, S.; Stringer, R.; Takaki, J. D. Tapia; Wang, Q.] Univ Kansas, Lawrence, KS 66045 USA. [Ivanov, A.; Kaadze, K.; Khalil, S.; Makouski, M.; Maravin, Y.; Mohammadi, A.; Saini, L. K.; Skhirtladze, N.; Toda, S.] Kansas State Univ, Manhattan, KS 66506 USA. [Lange, D.; Rebassoo, F.; Wright, D.] Lawrence Livermore Natl Lab, Livermore, CA 94551 USA. [Anelli, C.; Baden, A.; Baron, O.; Belloni, A.; Calvert, B.; Eno, S. C.; Ferraioli, C.; Gomez, J. A.; Hadley, N. J.; Jabeen, S.; Kellogg, R. G.; Kolberg, T.; Kunkle, J.; Lu, Y.; Mignerey, A. C.; Shin, Y. H.; Skuja, A.; Tonjes, M. B.; Tonwar, S. C.] Univ Maryland, College Pk, MD 20742 USA. [Abercrombie, D.; Allen, B.; Apyan, A.; Barbieri, R.; Baty, A.; Bi, R.; Bierwagen, K.; Brandt, S.; Busza, W.; Cali, I. A.; Demiragli, Z.; Di Matteo, L.; Ceballos, G. Gomez; Goncharov, M.; Hsu, D.; Iiyama, Y.; Innocenti, G. M.; Klute, M.; Kovalskyi, D.; Krajczar, K.; Lai, Y. S.; Lee, Y. -J.; Levin, A.; Luckey, P. D.; Marini, A. C.; Mcginn, C.; Mironov, C.; Narayanan, S.; Niu, X.; Paus, C.; Roland, C.; Roland, G.; Salfeld-Nebgen, J.; Stephans, G. S. F.; Sumorok, K.; Tatar, K.; Varma, M.; Velicanu, D.; Veverka, J.; Wang, J.; Wang, T. W.; Wyslouch, B.; Yang, M.; Zhukova, V.] MIT, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Benvenuti, A. C.; Chatterjee, R. M.; Evans, A.; Finkel, A.; Gude, A.; Hansen, P.; Kalafut, S.; Kao, S. C.; Kubota, Y.; Lesko, Z.; Mans, J.; Nourbakhsh, S.; Ruckstuhl, N.; Rusack, R.; Tambe, N.; Turkewitz, J.] Univ Minnesota, Minneapolis, MN 55455 USA. [Acosta, J. G.; Oliveros, S.] Univ Mississippi, Oxford, MS 38677 USA. [Avdeeva, E.; Bartek, R.; Bloom, K.; Bose, S.; Claes, D. R.; Dominguez, A.; Fangmeier, C.; Suarez, R. Gonzalez; Kamalieddin, R.; Knowlton, D.; Kravchenko, I.; Rodrigues, A. Malta; Meier, F.; Monroy, J.; Siado, J. E.; Snow, G. R.; Stieger, B.] Univ Nebraska, Lincoln, NE 68588 USA. [Alyari, M.; Dolen, J.; George, J.; Godshalk, A.; Harrington, C.; Iashvili, I.; Kaisen, J.; Kharchilava, A.; Kumar, A.; Parker, A.; Rappoccio, S.; Roozbahani, B.] SUNY Buffalo, Buffalo, NY 14260 USA. [Alverson, G.; Barberis, E.; Baumgartel, D.; Hortiangtham, A.; Massironi, A.; Morse, D. M.; Nash, D.; Orimoto, T.; De Lima, R. Teixeira; Trocino, D.; Wang, R. -J.; Wood, D.] Northeastern Univ, Boston, MA 02115 USA. [Bhattacharya, S.; Hahn, K. A.; Kubik, A.; Low, J. F.; Mucia, N.; Odell, N.; Pollack, B.; Schmitt, M. H.; Sung, K.; Trovato, M.; Velasco, M.] Northwestern Univ, Evanston, IL 60208 USA. [Dev, N.; Hildreth, M.; Anampa, K. Hurtado; Jessop, C.; Karmgard, D. J.; Kellams, N.; Lannon, K.; Marinelli, N.; Meng, F.; Mueller, C.; Musienko, Y.; Planer, M.; Reinsvold, A.; Ruchti, R.; Smith, G.; Taroni, S.; Valls, N.; Wayne, M.; Wolf, M.; Woodard, A.] Univ Notre Dame, Notre Dame, IN 46556 USA. [Alimena, J.; Antonelli, L.; Brinson, J.; Bylsma, B.; Durkin, L. S.; Flowers, S.; Francis, B.; Hart, A.; Hill, C.; Hughes, R.; Ji, W.; Liu, B.; Luo, W.; Puigh, D.; Winer, B. L.; Wulsin, H. W.] Ohio State Univ, Columbus, OH 43210 USA. [Cooperstein, S.; Driga, O.; Elmer, P.; Hardenbrook, J.; Hebda, P.; Luo, J.; Marlow, D.; Medvedeva, T.; Mooney, M.; Olsen, J.; Palmer, C.; Piroue, P.; Stickland, D.; Tully, C.; Zuranski, A.] Princeton Univ, Princeton, NJ 08542 USA. [Malik, S.] Univ Puerto Rico, Mayaguez, PR 00681 USA. [Barker, A.; Barnes, V. E.; Benedetti, D.; Folgueras, S.; Gutay, L.; Jha, M. K.; Jones, M.; Jung, A. W.; Jung, K.; Miller, D. H.; Neumeister, N.; Radburn-Smith, B. C.; Shi, X.; Sun, J.; Svyatkovskiy, A.; Wang, F.; Xie, W.; Xu, L.] Purdue Univ, W Lafayette, IN 47907 USA. [Parashar, N.; Stupak, J.] Purdue Univ Calumet, Hammond, IN 46323 USA. [Adair, A.; Akgun, B.; Chen, Z.; Ecklund, K. M.; Geurts, F. J. M.; Guilbaud, M.; Li, W.; Michlin, B.; Northup, M.; Padley, B. P.; Redjimi, R.; Roberts, J.; Rorie, J.; Tu, Z.; Zabel, J.] Rice Univ, Houston, TX 77251 USA. [Betchart, B.; Bodek, A.; de Barbaro, P.; Demina, R.; Duh, Y. T.; Ferbel, T.; Galanti, M.; Garcia-Bellido, A.; Han, J.; Hindrichs, O.; Khukhunaishvili, A.; Lo, K. H.; Tan, P.; Verzetti, M.] Univ Rochester, 601 Elmwood Ave, Rochester, NY 14627 USA. [Chou, J. P.; Contreras-Campana, E.; Gershtein, Y.; Espinosa, T. A. Gomez; Halkiadakis, E.; Heindl, M.; Hidas, D.; Hughes, E.; Kaplan, S.; Elayavalli, R. Kunnawalkam; Kyriacou, S.; Lath, A.; Nash, K.; Saka, H.; Salur, S.; Schnetzer, S.; Sheffield, D.; Somalwar, S.; Stone, R.; Thomas, S.; Thomassen, P.; Walker, M.] Rutgers State Univ, Piscataway, NJ 08854 USA. [Foerster, M.; Heideman, J.; Riley, G.; Rose, K.; Spanier, S.; Thapa, K.] Univ Tennessee, Knoxville, TN 37996 USA. [Bouhali, O.; Celik, A.; Dalchenko, M.; De Mattia, M.; Delgado, A.; Dildick, S.; Eusebi, R.; Gilmore, J.; Huang, T.; Juska, E.; Kamon, T.; Mueller, R.; Pakhotin, Y.; Patel, R.; Perloff, A.; Pernie, L.; Rathjens, D.; Rose, A.; Safonov, A.; Tatarinov, A.; Ulmer, K. A.] Texas A&M Univ, College Stn, TX 77843 USA. [Akchurin, N.; Cowden, C.; Damgov, J.; Dragoiu, C.; Dudero, P. R.; Faulkner, J.; Kunori, S.; Lamichhane, K.; Lee, S. W.; Libeiro, T.; Undleeb, S.; Volobouev, I.; Wang, Z.] Texas Tech Univ, Lubbock, TX 79409 USA. [Delannoy, A. G.; Greene, S.; Gurrola, A.; Janjam, R.; Johns, W.; Maguire, C.; Melo, A.; Ni, H.; Sheldon, P.; Tuo, S.; Velkovska, J.; Xu, Q.] Vanderbilt Univ, 221 Kirkland Hall, Nashville, TN 37235 USA. [Arenton, M. W.; Barria, P.; Cox, B.; Goodell, J.; Hirosky, R.; Ledovskoy, A.; Li, H.; Neu, C.; Sinthuprasith, T.; Sun, X.; Wang, Y.; Wolfe, E.; Xia, F.] Univ Virginia, Charlottesville, VA 22904 USA. [Clarke, C.; Harr, R.; Karchin, P. E.; Lamichhane, P.; Sturdy, J.] Wayne State Univ, Detroit, MI 48202 USA. [Belknap, D. A.; Dasu, S.; Dodd, L.; Duric, S.; Gomber, B.; Grothe, M.; Herndon, M.; Herve, A.; Klabbers, P.; Lanaro, A.; Levine, A.; Long, K.; Loveless, R.; Ojalvo, I.; Perry, T.; Pierro, G. A.; Polese, G.; Ruggles, T.; Savin, A.; Sharma, A.; Smith, N.; Smith, W. H.; Taylor, D.; Woods, N.] Univ Wisconsin, Madison, WI 53706 USA. [Fruehwirth, R.; Jeitler, M.; Schieck, J.; Wulz, C. -E.; Krammer, M.] Vienna Univ Technol, Vienna, Austria. [Zhang, F.] Peking Univ, State Key Lab Nucl Phys & Technol, Beijing, Peoples R China. [Beluffi, C.] Univ Haute Alsace Mulhouse, Univ Strasbourg, Inst Pluridisciplinaire Hubert Curien, CNRS,IN2P3, Strasbourg, France. [Chinellato, J.; Tonelli Manganote, E. J.] Univ Estadual Campinas, Campinas, SP, Brazil. [Fang, W.] Univ Libre Bruxelles, Brussels, Belgium. [Chen, Y.] DESY, Hamburg, Germany. [Finger, M.; Finger, M., Jr.; Tsamalaidze, Z.] Joint Inst Nucl Res, Dubna, Russia. [Abdelalim, A. A.] Helwan Univ, Cairo, Egypt. [Abdelalim, A. A.] Zewail City Sci & Technol, Zewail, Egypt. [El-Khateeb, E.; Radi, A.] Ain Shams Univ, Cairo, Egypt. [Mahmoud, M. A.] Fayoum Univ, Al Fayyum, Egypt. [Mahmoud, M. A.; Radi, A.] British Univ Egypt, Cairo, Egypt. [Agram, J. -L.; Conte, E.; Fontaine, J. -C.] Univ Haute Alsace, Mulhouse, France. [Merlin, J. A.; Stahl, A.; Hartmann, F.; Mohanty, A. K.; Silvestris, L.; Tosi, N.; Viliani, L.; Primavera, F.; Manzoni, R. A.; Di Guida, S.; Meola, S.; Paolucci, P.; Azzi, P.; Pazzini, J.; Azzurri, P.; D'imperio, G.; Del Re, D.; Arcidiacono, R.; Kornmayer, A.; Virdee, T.] CERN, European Org Nucl Res, Geneva, Switzerland. [Popov, A.; Zhukov, V.; Katkov, I.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Toriashvili, T.] Tbilisi State Univ, Tbilisi, Rep of Georgia. [Borras, K.] Rhein Westfal TH Aachen, Phys Inst A3, Aachen, Germany. [Gallo, E.] Univ Hamburg, Hamburg, Germany. [Hempel, M.; Karacheban, O.; Lohmann, W.] Brandenburg Tech Univ Cottbus, Cottbus, Germany. [Horvath, D.] Inst Nucl Res ATOMKI, Debrecen, Hungary. [Vesztergombi, G.; Bartok, M.; Veres, G. I.] Eotvos Lorand Univ, MTA ELTE Lendulet CMS Particle & Nucl Phys Grp, Budapest, Hungary. [Karancsi, J.] Univ Debrecen, Debrecen, Hungary. [Choudhury, S.] Indian Inst Sci Educ & Res, Bhopal, India. [Nayak, A.] Inst Phys, Bhubaneswar, Orissa, India. [Bhowmik, S.; Maity, M.; Sarkar, T.] Visva Bharati Univ, Santini Ketan, W Bengal, India. [Wickramage, N.] Univ Ruhuna, Matara, Sri Lanka. [Chenarani, S.; Etesami, S. M.] Isfahan Univ Technol, Esfahan, Iran. [Fahim, A.] Univ Tehran, Dept Engn Sci, Tehran, Iran. [Safarzadeh, B.] Islamic Azad Univ, Sci & Res Branch, Plasma Phys Res Ctr, Tehran, Iran. [Androsov, K.; Castaldi, R.; Grippo, M. T.] Univ Siena, Siena, Italy. [Savoy-Navarro, A.] Purdue Univ, W Lafayette, IN 47907 USA. [Ali, M. A. B. Md] Int Islamic Univ Malaysia, Kuala Lumpur, Malaysia. [Idris, F. Mohamad] Agensi Nuklear Malaysia, MOSTI, Kajang, Malaysia. [Heredia-De La Cruz, I.] Consejo Nacl Ciencia & Technol, Mexico City, DF, Mexico. [Byszuk, A.; Zagozdzinska, A.] Warsaw Univ Technol, Inst Elect Syst, Warsaw, Poland. [Matveev, V.; Musienko, Y.] Inst Nucl Res, Moscow, Russia. [Matveev, V.; Azarkin, M.; Dremin, I.; Leonidov, A.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Yuldashev, B. S.] Uzbek Acad Sci, Inst Nucl Phys, Tashkent, Uzbekistan. [Kim, V.] St Petersburg State Polytech Univ, St Petersburg, Russia. [Kuznetsova, E.] Univ Florida, Gainesville, FL USA. [Chistov, R.] PN Lebedev Phys Inst, Moscow, Russia. [Adzic, P.; Milenovic, P.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Di Marco, E.] Univ Roma, Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Orfanelli, S.] Natl Tech Univ Athens, Athens, Greece. [Rolandi, G.] Scuola Normale, Pisa, Italy. [Rolandi, G.] Sezione Ist Nazl Fis Nucl, Pisa, Italy. [Sphicas, P.] Univ Athens, Athens, Greece. [Veckalns, V.] Riga Tech Univ, Riga, Latvia. [Starodumov, A.; Nikitenko, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Caminada, L.] Albert Einstein Ctr Fundamental Phys, Bern, Switzerland. [Kangal, E. E.] Mersin Univ, Mersin, Turkey. [Onengut, G.] Cag Univ, Mersin, Turkey. [Ozdemir, K.] Piri Reis Univ, Istanbul, Turkey. [Ozturk, S.] Gaziosmanpasa Univ, Tokat, Turkey. [Tali, B.] Adiyaman Univ, Adiyaman, Turkey. [Isildak, B.] Ozyegin Univ, Istanbul, Turkey. [Karapinar, G.] Izmir Inst Technol, Izmir, Turkey. [Kaya, M.] Marmara Univ, Istanbul, Turkey. [Kaya, O.] Kafkas Univ, Kars, Turkey. [Yetkin, E. A.] Istanbul Bilgi Univ, Istanbul, Turkey. [Yetkin, T.] Yildiz Tech Univ, Istanbul, Turkey. [Sen, S.] Hacettepe Univ, Ankara, Turkey. [Newbold, D. M.; Lucas, R.] Rutherford Appleton Lab, Didcot, Oxon, England. [Belyaev, A.] Univ Southampton, Sch Phys & Astron, Southampton, Hants, England. [Acosta, M. Vazquez] Inst Astrofis Canarias, San Cristobal la Laguna, Spain. [Wasserbaech, S.] Utah Valley Univ, Orem, UT USA. [Milenovic, P.] Vinca Inst Nucl Sci, Belgrade, Serbia. [Colafranceschi, S.] Univ Roma, Fac Ingn, Rome, Italy. [Bilki, B.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Mermerkaya, H.] Erzincan Univ, Erzincan, Turkey. [Ozok, F.] Mimar Sinan Univ, Istanbul, Turkey. [Bouhali, O.] Texas A&M Univ Qatar, Doha, Qatar. [Kamon, T.] Kyungpook Natl Univ, Daegu, South Korea. RP Khachatryan, V (reprint author), Yerevan Phys Inst, Yerevan, Armenia. RI Lokhtin, Igor/D-7004-2012; Manganote, Edmilson/K-8251-2013; Della Ricca, Giuseppe/B-6826-2013; Konecki, Marcin/G-4164-2015; Puljak, Ivica/D-8917-2017; Fernandez Menendez, Javier/B-6550-2014; TUVE', Cristina/P-3933-2015; Terkulov, Adel/M-8581-2015; Goh, Junghwan/Q-3720-2016; OI Della Ricca, Giuseppe/0000-0003-2831-6982; Konecki, Marcin/0000-0001-9482-4841; Fernandez Menendez, Javier/0000-0002-5213-3708; TUVE', Cristina/0000-0003-0739-3153; Goh, Junghwan/0000-0002-1129-2083; Hurtado Anampa, Kenyi/0000-0002-9779-3566; ORTONA, Giacomo/0000-0001-8411-2971; Reis, Thomas/0000-0003-3703-6624; Luukka, Panja/0000-0003-2340-4641; Jacob, Jeson/0000-0001-6895-5493 FU BMWFW (Austria); FWF (Austria); FNRS (Belgium); FWO (Belgium); CNPq (Brazil); CAPES (Brazil); FAPERJ (Brazil); FAPESP (Brazil); MES (Bulgaria); CERN; CAS (China); MoST (China); NSFC (China); COLCIENCIAS (Colombia); MSES (Croatia); CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER (Estonia); ERC IUT (Estonia); ERDF (Estonia); Academy of Finland (Finland); CEA (France); CNRS/IN2P3 (France); BMBF (Germany); DFG (Germany); HGF (Germany); GSRT (Greece); OTKA (Hungary); NIH (Hungary); DAE (India); DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP (Republic of Korea); NRF (Republic of Korea); LAS (Lithuania); MOE (Malaysia); UM (Malaysia); BUAP (Mexico); CINVESTAV (Mexico); CONACYT (Mexico); LNS (Mexico); SEP (Mexico); UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE (Poland); NSC (Poland); FCT (Portugal); JINR (Dubna); MON (Russia); RosAtom (Russia); RAS (Russia); RFBR (Russia); MESTD (Serbia); SEIDI (Spain); CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter (Thailand); IPST (Thailand); STAR (Thailand); NSTDA (Thailand); TUBITAK (Turkey); TAEK (Turkey); NASU (Ukraine); SFFR (Ukraine); STFC (United Kingdom); DOE (USA); NSF (USA); Marie-Curie program (European Union); European Research Council (European Union); EPLANET (European Union); Leventis Foundation; A. P. Sloan Foundation; Alexander von Humboldt Foundation; Belgian Federal Science Policy Office; Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; Council of Science and Industrial Research, India; HOMING PLUS program of the Foundation for Polish Science; European Union, Regional Development Fund; Mobility Plus program of the Ministry of Science and Higher Education; National Science Center (Poland) [2014/14/M/ST2/00428, 2013/11/B/ST2/04202, 2014/13/B/ST2/02543, 2014/15/B/ST2/03998, 2012/07/E/ST2/01406]; Thalis program - EU-ESF; Aristeia program - EU-ESF; Greek NSRF; National Priorities Research Program by Qatar National Research Fund; Programa Clarin-COFUND del Principado de Asturias; Rachadapisek Sompot Fund for Postdoctoral Fellowship (Thailand); Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); Welch Foundation [C-1845]; Chulalongkorn University (Thailand); MEC (Finland); HIP (Finland) FX We congratulate our colleagues in the CERN accelerator departments for the excellent performance of the LHC and thank the technical and administrative staffs at CERN and at other CMS institutes for their contributions to the success of the CMS effort. In addition, we gratefully acknowledge the computing centers and personnel of the Worldwide LHC Computing Grid for delivering so effectively the computing infrastructure essential to our analyses. Finally, we acknowledge the enduring support for the construction and operation of the LHC and the CMS detector provided by the following funding agencies: BMWFW and FWF (Austria); FNRS and FWO (Belgium); CNPq, CAPES, FAPERJ, and FAPESP (Brazil); MES (Bulgaria); CERN; CAS, MoST, and NSFC (China); COLCIENCIAS (Colombia); MSES and CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER, ERC IUT and ERDF (Estonia); Academy of Finland, MEC, and HIP (Finland); CEA and CNRS/IN2P3 (France); BMBF, DFG, and HGF (Germany); GSRT (Greece); OTKA and NIH (Hungary); DAE and DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP and NRF (Republic of Korea); LAS (Lithuania); MOE and UM (Malaysia); BUAP, CINVESTAV, CONACYT, LNS, SEP, and UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE and NSC (Poland); FCT (Portugal); JINR (Dubna); MON, RosAtom, RAS and RFBR (Russia); MESTD (Serbia); SEIDI and CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter, IPST, STAR and NSTDA (Thailand); TUBITAK and TAEK (Turkey); NASU and SFFR (Ukraine); STFC (United Kingdom); DOE and NSF (USA). Individuals have received support from the Marie-Curie program and the European Research Council and EPLANET (European Union); the Leventis Foundation; the A. P. Sloan Foundation; the Alexander von Humboldt Foundation; the Belgian Federal Science Policy Office; the Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); the Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); the Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; the Council of Science and Industrial Research, India; the HOMING PLUS program of the Foundation for Polish Science, cofinanced by the European Union, Regional Development Fund, the Mobility Plus program of the Ministry of Science and Higher Education, the National Science Center (Poland), contracts Harmonia Grant No. 2014/14/M/ST2/00428, Opus Grants No. 2013/11/B/ST2/04202, No. 2014/13/B/ST2/02543 and No. 2014/15/B/ST2/03998, Sonata-bis Grant No. 2012/07/E/ST2/01406; the Thalis and Aristeia programs cofinanced by EU-ESF and the Greek NSRF; the National Priorities Research Program by Qatar National Research Fund; the Programa Clarin-COFUND del Principado de Asturias; the Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University and the Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); and the Welch Foundation, Contract No. C-1845. NR 52 TC 0 Z9 0 U1 27 U2 27 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 8 PY 2016 VL 94 IS 11 AR 112005 DI 10.1103/PhysRevD.94.112005 PG 24 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EE3PO UT WOS:000389505300002 ER PT J AU Ramsay, JW Hancock, CL O'Donovan, MP Brown, TN AF Ramsay, John W. Hancock, Clifford L. O'Donovan, Meghan P. Brown, Tyler N. TI Soldier-relevant body borne loads increase knee joint contact force during a run-to-stop maneuver SO JOURNAL OF BIOMECHANICS LA English DT Article DE Load carriage; Knee contact force; Run to stop; OpenSim; Leg stiffness ID MEASURED IN-VIVO; LEG STIFFNESS; MUSCULOSKELETAL STIFFNESS; GENDER-DIFFERENCES; COORDINATE SYSTEM; DROP LANDINGS; WALKING GAIT; INJURY; MILITARY; BIOMECHANICS AB The purpose of this study was to understand the effects of load carriage on human performance, specifically during a run-to-stop (RTS) task. Using OpenSim analysis tools, knee joint contact force, grounds reaction force, leg stiffness and lower extremity joint angles and moments were determined for nine male military personnel performing a RTS under three load configurations (light, similar to 6 kg, medium, similar to 20 kg, and heavy, similar to 40 kg). Subject-based means for each biomechanical variable were submitted to repeated measures ANOVA to test the effects of load. During the RTS, body borne load significantly increased peak knee joint contact force by 1.2 BW (p < 0.001) and peak vertical (p < 0.001) and anterior posterior (p= 0.002) ground reaction forces by 0.6 BW and 0.3 BW, respectively. Body borne load also had a significant effect on hip (p = 0.026) posture with the medium load and knee (p= 0.046) posture with the heavy load. With the heavy load, participants exhibited a substantial, albeit non-significant increase in leg stiffness (p =0.073 and d=0.615). Increases in joint contact force exhibited during the RTS were primarily due to greater GRF5 that impact the soldier with each incremental addition of body borne load. The stiff leg, extended knee and large braking force the soldiers exhibited with the heavy load suggests their injury risk may be greatest with that specific load configuration. Further work is needed to determine if the biomechanical profile exhibited with the heavy load configuration translates to unsafe shear forces at the knee joint and consequently, a higher likelihood of injury. Published by Elsevier Ltd. C1 [Ramsay, John W.; Hancock, Clifford L.; O'Donovan, Meghan P.] Natick Soldier Res Dev & Engn Ctr, Natick, MA 01760 USA. [Brown, Tyler N.] Boise State Univ, Boise, ID 83725 USA. [Brown, Tyler N.] ORISE, Belcamp, MD USA. RP Ramsay, JW (reprint author), US Army, Natick Soldier Res Dev & Engn Ctr, 15 Gen Greene Ave, Natick, MA 01760 USA. EM john.w.ramsay4.civ@mail.mil FU Department of the Army, Office of the Assistant Secretary of the Army - Acquisition Logistics and Technology FX This work was supported by a FY 2012-2014 Competitive Inhouse Laboratory Independent Research (ILIR) Award program from the Department of the Army, Office of the Assistant Secretary of the Army - Acquisition Logistics and Technology. NR 56 TC 0 Z9 0 U1 3 U2 3 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0021-9290 EI 1873-2380 J9 J BIOMECH JI J. Biomech. PD DEC 8 PY 2016 VL 49 IS 16 BP 3868 EP 3874 DI 10.1016/j.jbiomech.2016.10.022 PG 7 WC Biophysics; Engineering, Biomedical SC Biophysics; Engineering GA EG3UX UT WOS:000390971300016 PM 27789034 ER PT J AU Mounfield, WP Han, C Pang, SH Tumuluri, U Jiao, Y Bhattacharyya, S Dutzer, MR Nair, S Wu, Z Lively, RP Sholl, DS Walton, KS AF Mounfield, William P., III Han, Chu Pang, Simon H. Tumuluri, Uma Jiao, Yang Bhattacharyya, Souryadeep Dutzer, Michael R. Nair, Sankar Wu, Zili Lively, Ryan P. Sholl, David S. Walton, Krista S. TI Synergistic Effects of Water and SO2 on Degradation of MIL-125 in the Presence of Acid Gases SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID METAL-ORGANIC FRAMEWORKS; TOTAL-ENERGY CALCULATIONS; WAVE BASIS-SET; OXIDE COMPOSITES; SULFUR-DIOXIDE; ADSORPTION; STABILITY; DEFECTS; MOFS; COORDINATION AB The behavior of metal-organic frameworks (MOFs) in the presence of acid gases may be decisive in their suitability for industrial applications. In this study, MIL-125 and MIL-12S-NH2 were investigated with SO2 exposure in dry, humid, and aqueous environments. MIL-125 was found to be unstable in both humid and aqueous acidic environments, while MIL-125-NH2 was stable under these exposure conditions, showing no change in textural properties or visual degradation, as observed through SEM. Both materials were stable in the presence of water and dry SOD suggesting that the reaction of these molecules to form an acidic species is likely a key factor in the degradation of MIL-125. In situ IR experiments confirmed the presence of sulfite species, supporting the hypothesis that the presence of an acidic sulfur species likely leads to the degradation of the MIL-125 structure. Computational investigation of several potential reaction mechanisms in MIL-125 indicated reactions involving the bisulfite ion are favored over reactions with water or SO2. DFT simulations support the observation that MIL-125-NH2 is stable in humid conditions, as all reactions are less favorable with the functionalized framework compared to the unfunctionalized framework. This combined experimental and computational study advances the fundamental understanding of MOF degradation mechanisms during acid gas exposure. C1 [Mounfield, William P., III; Han, Chu; Pang, Simon H.; Jiao, Yang; Bhattacharyya, Souryadeep; Dutzer, Michael R.; Nair, Sankar; Lively, Ryan P.; Sholl, David S.; Walton, Krista S.] Georgia Inst Technol, Sch Chem & Biomol Engn, Atlanta, GA 30332 USA. [Han, Chu] Georgia Inst Technol, Sch Chem & Biochem, Atlanta, GA 30332 USA. [Tumuluri, Uma; Wu, Zili] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. RP Walton, KS (reprint author), Georgia Inst Technol, Sch Chem & Biomol Engn, Atlanta, GA 30332 USA. EM krista.walton@chbe.gatech.edu FU Center for Understanding and Control of Acid Gas-Induced Evolution of Materials for Energy (UNCAGE-ME), an Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Basic Energy Sciences [DE-SC0012577] FX This work was supported as part of the Center for Understanding and Control of Acid Gas-Induced Evolution of Materials for Energy (UNCAGE-ME), an Energy Frontier Research Center funded by U.S. Department of Energy, Office of Science, Basic Energy Sciences under Award #DE-SC0012577. Research at Oak Ridge National Laboratory, including the IR spectroscopy, was conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility. NR 49 TC 2 Z9 2 U1 21 U2 21 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 8 PY 2016 VL 120 IS 48 BP 27230 EP 27240 DI 10.1021/acs.jpcc.6b09264 PG 11 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EE5DF UT WOS:000389624400016 ER PT J AU Dreger, ZA Stash, AI Yu, ZG Chen, YS Tao, YC Gupta, YM AF Dreger, Zbigniew A. Stash, Adam I. Yu, Zhi-Gang Chen, Yu-Sheng Tao, Yuchuan Gupta, Yogendra M. TI High-Pressure Structural Response of an Insensitive Energetic Crystal: 1,1-Diamino-2,2-dinitroethene (FOX-7) SO JOURNAL OF PHYSICAL CHEMISTRY C LA English DT Article ID FUNCTIONAL THEORY CALCULATIONS; DENSITY MATERIAL; SINGLE-CRYSTALS; PHASE-DIAGRAM; DECOMPOSITION; COMPRESSION; RANGE; STATE; DFT AB High-pressure structural response of an insensitive energetic crystal-1,1-diamino-2,2-dinitroethene (FOX-7)-was examined to gain insight into its structural and chemical stability and to obtain isothermal compression data. Using synchrotron single-crystal X-ray diffraction measurements, details of pressure-induced structural changes to 12.8 GPa were determined across three FOX-7 phases: alpha (P2(1)/n), alpha '(P2(1)/n), and epsilon (P1). We found that the C-NO2 bond is the most compressible chemical bond, and high pressure significantly reduces and homogenizes the length of H bonds in the hydrogen-bond network. The alpha '-epsilon phase transition, at 4.5 GPa, significantly affects all molecular and crystal properties, whereas the alpha-alpha ' transition, at 2 GPa, is associated with subtle 95 molecular and intermolecular changes. Anisotropic compressibility was observed over the entire pressure range, consistent with the layered structure of the crystal. The equation-of-state parameters were obtained using the third-order Birch Murnaghan equation below and above the alpha '-epsilon phase transition. It is shown that dispersion-corrected DFT-D calculations reproduce well pressure-induced changes in the unit cell parameters. The findings of this work provide new insights into the molecular and structural mechanisms governing the high-pressure stability/insensitivity of insensitive energetic crystals. C1 [Dreger, Zbigniew A.; Yu, Zhi-Gang; Tao, Yuchuan; Gupta, Yogendra M.] Washington State Univ, Inst Shock Phys, Pullman, WA 99164 USA. [Dreger, Zbigniew A.; Yu, Zhi-Gang; Tao, Yuchuan; Gupta, Yogendra M.] Washington State Univ, Dept Phys & Astron, Pullman, WA 99164 USA. [Stash, Adam I.] Karpov Inst Phys Chem, State Sci Ctr Russian Federat, Moscow 103064, Russia. [Chen, Yu-Sheng] Univ Chicago, Adv Photon Source, ChemMatCARS, Argonne, IL 60439 USA. RP Dreger, ZA (reprint author), Washington State Univ, Inst Shock Phys, Pullman, WA 99164 USA.; Dreger, ZA (reprint author), Washington State Univ, Dept Phys & Astron, Pullman, WA 99164 USA. EM dreger@wsu.edu FU DOE/NNSA [DE-NA0002007]; ONR [N000014-16-1-2088]; Divisions of Chemistry (CHE) and Materials Research (DMR), National Science Foundation [NSF/CHE-1346572]; U.S. DOE [DE-AC02-06CH11357] FX Dr. Joel R. Carney from Naval Surface Warfare Center-Indian Head Division (NSWC-IHD) is thanked for providing the FOX-7 powder. Dr. Przemyslaw Dera from the University of Hawaii at Manoa is thanked for helping in the initial experimental and analytical efforts on the FOX-7 structure. Z.A.D., Y.T., and Y.M.G. acknowledge support from DOE/NNSA (DE-NA0002007) and ONR (N000014-16-1-2088). Experiments were performed at the ChemMatCARS Sector 15 of the Advanced Photon Source, Argonne National Laboratory. The ChemMatCARS Sector 15 is principally supported by the Divisions of Chemistry (CHE) and Materials Research (DMR), National Science Foundation, under grant number NSF/CHE-1346572. Use of the Advanced Photon Source, an Office of Science User Facility operated for the U.S. Department of Energy (DOE) Office of Science by Argonne National Laboratory, was supported by the U.S. DOE under Contract No. DE-AC02-06CH11357. NR 31 TC 1 Z9 1 U1 6 U2 6 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1932-7447 J9 J PHYS CHEM C JI J. Phys. Chem. C PD DEC 8 PY 2016 VL 120 IS 48 BP 27600 EP 27607 DI 10.1021/acs.jpcc.6b10010 PG 8 WC Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Chemistry; Science & Technology - Other Topics; Materials Science GA EE5DF UT WOS:000389624400055 ER PT J AU Helms, BA Russell, TP AF Helms, Brett A. Russell, Thomas P. TI Reaction: Polymer Chemistries Enabling Cradle-to-Cradle Life Cycles for Plastics SO CHEM LA English DT Editorial Material ID NETWORKS C1 [Helms, Brett A.] Lawrence Berkeley Natl Lab, Mol Foundry, One Cyclotron Rd, Berkeley, CA 94720 USA. [Helms, Brett A.; Russell, Thomas P.] Lawrence Berkeley Natl Lab, Div Mat Sci, One Cyclotron Rd, Berkeley, CA 94720 USA. [Russell, Thomas P.] Univ Massachusetts, Conte Ctr Polymer Res, Dept Polymer Sci & Engn, 120 Governors Dr, Amherst, MA 01003 USA. [Russell, Thomas P.] Beijing Univ Chem Technol, Beijing Adv Innovat Ctr Soft Matter Sci & Engn, Beijing 100029, Peoples R China. RP Helms, BA (reprint author), Lawrence Berkeley Natl Lab, Mol Foundry, One Cyclotron Rd, Berkeley, CA 94720 USA.; Helms, BA; Russell, TP (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, One Cyclotron Rd, Berkeley, CA 94720 USA.; Russell, TP (reprint author), Univ Massachusetts, Conte Ctr Polymer Res, Dept Polymer Sci & Engn, 120 Governors Dr, Amherst, MA 01003 USA.; Russell, TP (reprint author), Beijing Univ Chem Technol, Beijing Adv Innovat Ctr Soft Matter Sci & Engn, Beijing 100029, Peoples R China. EM bahelms@lbl.gov; tom.p.russell@gmail.com OI Helms, Brett/0000-0003-3925-4174 NR 6 TC 0 Z9 0 U1 7 U2 7 PU CELL PRESS PI CAMBRIDGE PA 600 TECHNOLOGY SQUARE, 5TH FLOOR, CAMBRIDGE, MA 02139 USA SN 2451-9294 J9 CHEM JI Chem PD DEC 8 PY 2016 VL 1 IS 6 BP 816 EP 818 DI 10.1016/j.chempr.2016.11.016 PG 3 WC Chemistry, Multidisciplinary SC Chemistry GA EE7MH UT WOS:000389801600002 ER PT J AU Chatterley, AS Lackner, F Pemmaraju, CD Neumark, DM Leone, SR Gessner, O AF Chatterley, Adam S. Lackner, Florian Pemmaraju, C. D. Neumark, Daniel M. Leone, Stephen R. Gessner, Oliver TI Dissociation Dynamics and Electronic Structures of Highly Excited Ferrocenium Ions Studied by Femtosecond XUV Absorption Spectroscopy SO JOURNAL OF PHYSICAL CHEMISTRY A LA English DT Article ID WAVELENGTH-DEPENDENT COMPETITION; DENSITY-FUNCTIONAL THEORY; MULTIPHOTON IONIZATION; BASIS-SETS; 248 NM; TRANSITION; SPECTRUM; PHOTOIONIZATION; VANADOCENE; EXCITATION AB The dissociation dynamics of ferrocene are explored following strong field ionization using femtosecond time-resolved extreme ultraviolet (XUV) transient absorption spectroscopy. Employing transitions in the vicinity of the iron 3p (M-2,M-3) edge, the dissociation is monitored from the point of view of the iron atom. With low strong field pump intensities (approximate to 2 x 10(13) W cm(-2)), only ferrocenium cations are produced, and their iron 3p absorption spectrum is reported. It very closely resembles the 3p spectrum of atomic Fe+ ions but is red-shifted by 0.8 eV. With the aid of time-dependent density functional theory calculations, the spectrum is assigned to a combination of doublet and quartet spin states of ferrocenium ions. Ionization with more intense strong field pump pulses (>= 6 X 10(13) W cm(-2)) leads predominantly to the prompt production of ferrocenium ions that dissociate to give the spectral signature of bare Fe+ ions within 240 +/- 80 fs. Within the temporal resolution of the experiment (approximate to 40 fs), no spectral intermediates are observed, suggesting that the dissociation process occurs directly from the excited ferrocenium ion and that the bonds between the iron center and both cyclopentadienyl rings are broken almost simultaneously in an asynchronous concerted decay process. No evidence of slower dissociation channels is observed at a pump-probe delay of 250 ps, suggesting that all energy is very rapidly routed into dissociative states. C1 [Chatterley, Adam S.; Lackner, Florian; Pemmaraju, C. D.; Neumark, Daniel M.; Leone, Stephen R.; Gessner, Oliver] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Chatterley, Adam S.; Lackner, Florian; Neumark, Daniel M.; Leone, Stephen R.] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Leone, Stephen R.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Chatterley, Adam S.] Aarhus Univ, Dept Chem, DK-8000 Aarhus C, Denmark. [Lackner, Florian] Graz Univ Technol, Inst Expt Phys, A-8010 Graz, Austria. RP Gessner, O (reprint author), Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. EM ogessner@lbl.gov FU U.S. Department of Energy, Office of Basic Energy Sciences, Chemical Sciences, Geosciences and Biosciences Division [DE-AC02-05CH11231]; Austrian Science Fund (FWF) [J 3580-N20] FX This work was supported by the U.S. Department of Energy, Office of Basic Energy Sciences, Chemical Sciences, Geosciences and Biosciences Division, through Contract No. DE-AC02-05CH11231. F.L. would like to acknowledge support by the Austrian Science Fund (FWF, Erwin Schrodinger Fellowship Grant No. J 3580-N20). NR 57 TC 0 Z9 0 U1 6 U2 6 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1089-5639 J9 J PHYS CHEM A JI J. Phys. Chem. A PD DEC 8 PY 2016 VL 120 IS 48 BP 9509 EP 9518 DI 10.1021/acs.jpca.6b09724 PG 10 WC Chemistry, Physical; Physics, Atomic, Molecular & Chemical SC Chemistry; Physics GA EE5CQ UT WOS:000389622700001 PM 27933918 ER PT J AU Bierman, PR Shakun, JD Corbett, LB Zimmerman, SR Rood, DH AF Bierman, Paul R. Shakun, Jeremy D. Corbett, Lee B. Zimmerman, Susan R. Rood, Dylan H. TI A persistent and dynamic East Greenland Ice Sheet over the past 7.5 million years SO NATURE LA English DT Article ID COSMOGENIC NUCLIDE PRODUCTION; LATE PLIOCENE GREENLAND; DEEP-SEA-TEMPERATURE; SOUTHERN GREENLAND; HALF-LIFE; NORTHEAST GREENLAND; EARLY PLEISTOCENE; PRODUCTION-RATES; RAFTED DETRITUS; WEST GREENLAND AB Climate models show that ice-sheet melt will dominate sea-level rise over the coming centuries, but our understanding of ice-sheet variations before the last interglacial 125,000 years ago remains fragmentary. This is because terrestrial deposits of ancient glacial and interglacial periods(1-3) are overrun and eroded by more recent glacial advances, and are therefore usually rare, isolated and poorly dated(4). In contrast, material shed almost continuously from continents is preserved as marine sediment that can be analysed to infer the time-varying state of major ice sheets. Here we show that the East Greenland Ice Sheet existed over the past 7.5 million years, as indicated by beryllium and aluminium isotopes (Be-10 and Al-26) in quartz sand removed by deep, ongoing glacial erosion on land and deposited offshore in the marine sedimentary record(5,6.) During the early Pleistocene epoch, ice cover in East Greenland was dynamic; in contrast, East Greenland was mostly ice-covered during the mid-to-late Pleistocene. The isotope record we present is consistent with distinct signatures of changes in ice sheet behaviour coincident with major climate transitions. Although our data are continuous, they are from low-deposition-rate sites and sourced only from East Greenland. Consequently, the signal of extensive deglaciation during short, intense interglacials could be missed or blurred, and we cannot distinguish between a remnant ice sheet in the East Greenland highlands and a diminished continent-wide ice sheet. A clearer constraint on the behaviour of the ice sheet during past and, ultimately, future interglacial warmth could be produced by Be-10 and Al-26 records from a coring site with a higher deposition rate. Nonetheless, our analysis challenges the possibility of complete and extended deglaciation over the past several million years. C1 [Bierman, Paul R.; Corbett, Lee B.] Univ Vermont, Dept Geol, Burlington, VT 05405 USA. [Bierman, Paul R.; Corbett, Lee B.] Univ Vermont, Rubenstein Sch Environm & Nat Resources, Burlington, VT 05405 USA. [Shakun, Jeremy D.] Boston Coll, Dept Earth & Environm Sci, Chestnut Hill, MA 02467 USA. [Zimmerman, Susan R.] Lawrence Livermore Natl Lab, Ctr Accelerator Mass Spectrometry, Livermore, CA 94550 USA. [Rood, Dylan H.] Imperial Coll London, Dept Earth Sci & Engn, South Kensington Campus, London SW7 2AZ, England. [Rood, Dylan H.] Scottish Univ Environm Res Ctr, E Kilbride G75 0QF, Lanark, Scotland. RP Bierman, PR (reprint author), Univ Vermont, Dept Geol, Burlington, VT 05405 USA.; Bierman, PR (reprint author), Univ Vermont, Rubenstein Sch Environm & Nat Resources, Burlington, VT 05405 USA. EM pbierman@uvm.edu FU NSF [ARC-1023191] FX Research supported by NSF ARC-1023191. A. Nelson prepared some samples. W. Hale and the Bremen Core Repository facilitated core sampling. G. Balco provided input on muon production. We thank K. St John for providing ODP site 918 mass accumulation rate data, B. de Boer for ice sheet model output W. Huang for running foraminifer stable isotope samples, and S. Xu and the staff of the SUERC AMS laboratory for support during 26Al measurements. This is LLNL-JRNL-701099. NR 87 TC 2 Z9 2 U1 23 U2 23 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 0028-0836 EI 1476-4687 J9 NATURE JI Nature PD DEC 8 PY 2016 VL 540 IS 7632 BP 256 EP + DI 10.1038/nature20147 PG 14 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4CF UT WOS:000389548700054 PM 27929005 ER PT J AU Davis, MJ Janke, R Taxon, TN AF Davis, Michael J. Janke, Robert Taxon, Thomas N. TI Assessing Inhalation Exposures Associated with Contamination Events in Water Distribution Systems SO PLOS ONE LA English DT Article ID VOLATILE ORGANIC-COMPOUNDS; CHLORINATED TAP WATER; DRINKING-WATER; SIZE DISTRIBUTION; DISTRIBUTION NETWORK; CHLOROFORM EXPOSURE; ESCHERICHIA-COLI; SENSOR PLACEMENT; HOME HUMIDIFIERS; SHOWER WATER AB When a water distribution system (WDS) is contaminated, short-term inhalation exposures to airborne contaminants could occur as the result of domestic water use. The most important domestic sources of such exposures are likely to be showering and the use of aerosol-producing humidifiers, i.e., ultrasonic and impeller (cool-mist) units. A framework is presented for assessing the potential effects of short-term, system-wide inhalation exposures that could result from such activities during a contamination event. This framework utilizes available statistical models for showering frequency and duration, available exposure models for showering and humidifier use, and experimental results on both aerosol generation and the volatilization of chemicals during showering. New models for the times when showering occurs are developed using time-use data for the United States. Given a lack of similar models for how humidifiers are used, or the information needed to develop them, an analysis of the sensitivity of results to assumptions concerning humidifier use is presented. The framework is applied using network models for three actual WDSs. Simple models are developed for estimating upper bounds on the potential effects of system-wide inhalation exposures associated with showering and humidifier use. From a system-wide, population perspective, showering could result in significant inhalation doses of volatile chemical contaminants, and humidifier use could result in significant inhalation doses of microbial contaminants during a contamination event. From a system-wide perspective, showering is unlikely to be associated with significant doses of microbial contaminants. Given the potential importance of humidifiers as a source of airborne contaminants during a contamination event, an improved understanding of the nature of humidifier use is warranted. C1 [Davis, Michael J.] Argonne Natl Lab, Div Environm Sci, Argonne Associate Seville, 9700 S Cass Ave, Argonne, IL 60439 USA. [Janke, Robert] US EPA, Natl Homeland Secur Res Ctr, Cincinnati, OH 45268 USA. [Taxon, Thomas N.] Argonne Natl Lab, Global Secur Sci Div, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Davis, MJ (reprint author), Argonne Natl Lab, Div Environm Sci, Argonne Associate Seville, 9700 S Cass Ave, Argonne, IL 60439 USA.; Janke, R (reprint author), US EPA, Natl Homeland Secur Res Ctr, Cincinnati, OH 45268 USA. EM mike_davis@anl.gov; janke.robert@epa.gov FU U.S. Environmental Protection Agency through U.S. Department of Energy [DE-AC02-06CH11357] FX Work at Argonne National Laboratory was sponsored by the U.S. Environmental Protection Agency under interagency agreement through U.S. Department of Energy Contract DE-AC02-06CH11357. The funders had no role in study design, data collection and analysis, decision to publish, or preparation of the manuscript. NR 72 TC 0 Z9 0 U1 3 U2 3 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 8 PY 2016 VL 11 IS 12 AR e0168051 DI 10.1371/journal.pone.0168051 PG 41 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE4OA UT WOS:000389580900074 PM 27930709 ER PT J AU Han, LL Meng, QP Wang, DL Zhu, YM Wang, J Du, XW Stach, EA Xin, HL AF Han, Lili Meng, Qingping Wang, Deli Zhu, Yimei Wang, Jie Du, Xiwen Stach, Eric A. Xin, Huolin L. TI Interrogation of bimetallic particle oxidation in three dimensions at the nanoscale SO Nature Communications LA English DT Article ID CATION SELF-DIFFUSION; LITHIUM-ION BATTERIES; NICKEL-COBALT ALLOYS; OXYGEN REDUCTION; CONCENTRATION-DEPENDENCE; CO NANOPARTICLES; OXIDE; ELECTROCATALYST; SUPERCAPACITORS; TEMPERATURE AB An understanding of bimetallic alloy oxidation is key to the design of hollow-structured binary oxides and the optimization of their catalytic performance. However, one roadblock encountered in studying these binary oxide systems is the difficulty in describing the heterogeneities that occur in both structure and chemistry as a function of reaction coordinate. This is due to the complexity of the three-dimensional mosaic patterns that occur in these heterogeneous binary systems. By combining real-time imaging and chemical-sensitive electron tomography, we show that it is possible to characterize these systems with simultaneous nanoscale and chemical detail. We find that there is oxidation-induced chemical segregation occurring on both external and internal surfaces. Additionally, there is another layer of complexity that occurs during the oxidation, namely that the morphology of the initial oxide surface can change the oxidation modality. This work characterizes the pathways that can control the morphology in binary oxide materials. C1 [Han, Lili; Stach, Eric A.; Xin, Huolin L.] Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA. [Han, Lili; Du, Xiwen] Tianjin Univ, Sch Mat Sci & Engn, Minist Educ, Inst New Energy Mat,Key Lab Adv Ceram & Machining, Tianjin 300072, Peoples R China. [Meng, Qingping; Zhu, Yimei] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Wang, Deli; Wang, Jie] Huazhong Univ Sci & Technol, Sch Chem & Chem Engn, Hubei Key Lab Mat Chem & Serv Failure, Key Lab Mat Chem Energy Convers & Storage,Minist, Wuhan 430074, Peoples R China. RP Xin, HL (reprint author), Brookhaven Natl Lab, Ctr Funct Nanomat, Upton, NY 11973 USA.; Du, XW (reprint author), Tianjin Univ, Sch Mat Sci & Engn, Minist Educ, Inst New Energy Mat,Key Lab Adv Ceram & Machining, Tianjin 300072, Peoples R China. EM xwdu@tju.edu.cn; hxin@bnl.gov RI Stach, Eric/D-8545-2011; Wang, Jie/H-3638-2015; Wang, Deli/K-5029-2012 OI Stach, Eric/0000-0002-3366-2153; Wang, Jie/0000-0002-7188-3053; FU Center for Functional Nanomaterials, U.S. DOE Office of Science Facility, at Brookhaven National Laboratory [DE-SC0012704]; China Scholarship Council (CSC) [201406250041]; DOE-BES, Materials Sciences and Engineering Division [DESC0012704] FX This research is supported by the Center for Functional Nanomaterials, which is a U.S. DOE Office of Science Facility, at Brookhaven National Laboratory under Contract No DE-SC0012704. L.H. was supported by a scholarship from the China Scholarship Council (CSC) (201406250041). Q.M. and Y.Z. were supported by DOE-BES, Materials Sciences and Engineering Division under Contract DESC0012704. NR 42 TC 0 Z9 0 U1 38 U2 38 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 8 PY 2016 VL 7 AR 13335 DI 10.1038/ncomms13335 PG 9 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE3MB UT WOS:000389492100001 PM 27928998 ER PT J AU Knap, M Babadi, M Refael, G Martin, I Demler, E AF Knap, Michael Babadi, Mehrtash Refael, Gil Martin, Ivar Demler, Eugene TI Dynamical Cooper pairing in nonequilibrium electron-phonon systems SO PHYSICAL REVIEW B LA English DT Article ID RADIATION-STIMULATED SUPERCONDUCTIVITY; LIGHT-INDUCED SUPERCONDUCTIVITY; ANGLE-RESOLVED PHOTOEMISSION; DENSITY-WAVE; LATTICE; FIELD; YBA2CU3O6.5; TRANSITION; BEHAVIOR; CUPRATE AB We analyze Cooper pairing instabilities in strongly driven electron-phonon systems. The light-induced nonequilibrium state of phonons results in a simultaneous increase of the superconducting coupling constant and the electron scattering. We demonstrate that the competition between these effects leads to an enhanced superconducting transition temperature in a broad range of parameters. Our results may explain the observed transient enhancement of superconductivity in several classes of materials upon irradiation with high intensity pulses of terahertz light, and may pave newways for engineering high-temperature light-induced superconducting states. C1 [Knap, Michael] Tech Univ Munich, Dept Phys, Walter Schottky Inst, D-85748 Garching, Germany. [Knap, Michael] Tech Univ Munich, Inst Adv Study, D-85748 Garching, Germany. [Babadi, Mehrtash; Refael, Gil] CALTECH, Inst Quantum Informat & Matter, Pasadena, CA 91125 USA. [Martin, Ivar] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. [Demler, Eugene] Harvard Univ, Dept Phys, Cambridge, MA 02138 USA. RP Knap, M (reprint author), Tech Univ Munich, Dept Phys, Walter Schottky Inst, D-85748 Garching, Germany.; Knap, M (reprint author), Tech Univ Munich, Inst Adv Study, D-85748 Garching, Germany. RI Knap, Michael/H-3344-2011 OI Knap, Michael/0000-0002-7093-9502 FU Technical University of Munich-Institute for Advanced Study; German Excellence Initiative; European Union [291763]; Deutsche Forschungsgemeinschaft [KN 1254/1-1]; Harvard-MIT CUA; NSF [DMR-1308435, DMR-1410435]; AFOSR Quantum Simulation MURI; ARO-MURI on Atomtronics; Humboldt foundation; Walter Haefner Foundation; ETH Foundation; Simons foundation; Institute for Quantum Information and Matter; NSF Physics Frontiers Center; Gordon and Betty Moore Foundation; US Department of Energy, Office of Science, Materials Sciences and Engineering Division FX We thank E. Berg, A. Cavalleri, I. Cirac, U. Eckern, D. Fausti, A. Georges, S. Gopalakrishnan, B. I. Halperin, A. Imamoglu, S. Kaiser, C. Kollath, M. Norman, and T. Shi for useful discussions. We acknowledge support from the Technical University of Munich-Institute for Advanced Study, funded by the German Excellence Initiative and the European Union FP7 under Grant No. 291763, Deutsche Forschungsgemeinschaft Grant No. KN 1254/1-1, Harvard-MIT CUA, NSF Grants No. DMR-1308435 and No. DMR-1410435, AFOSR Quantum Simulation MURI, the ARO-MURI on Atomtronics, Humboldt foundation, Dr. Max Rossler, the Walter Haefner Foundation, the ETH Foundation, the Simons foundation, as well as the Institute for Quantum Information and Matter, an NSF Physics Frontiers Center with support of the Gordon and Betty Moore Foundation. This work was supported by the US Department of Energy, Office of Science, Materials Sciences and Engineering Division. NR 51 TC 4 Z9 4 U1 12 U2 12 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 8 PY 2016 VL 94 IS 21 DI 10.1103/PhysRevB.94.214504 PG 13 WC Physics, Condensed Matter SC Physics GA EE3OR UT WOS:000389501500004 ER PT J AU Singleton, J Kim, JW Topping, CV Hansen, A Mun, ED Chikara, S Lakis, I Ghannadzadeh, S Goddard, P Luo, X Oh, YS Cheong, SW Zapf, VS AF Singleton, John Kim, Jae Wook Topping, Craig V. Hansen, Anders Mun, Eun-Deok Chikara, S. Lakis, I. Ghannadzadeh, Saman Goddard, Paul Luo, Xuan Oh, Yoon Seok Cheong, Sang-Wook Zapf, Vivien S. TI Magnetic properties of Sr3NiIrO6 and Sr3CoIrO6: Magnetic hysteresis with coercive fields of up to 55 T SO PHYSICAL REVIEW B LA English DT Article ID ONE-DIMENSIONAL OXIDES; COMPOUND; CA3CORHO6; IRIDATE; LATTICE AB We report extraordinarily large magnetic hysteresis loops in the iridates Sr3NiIrO5 and Sr3CoIrO6. We find coercive magnetic fields of up to 55 T with switched magnetic moments approximate to 1 mu(B) per formula unit in Sr3NiIrO6 and coercive fields of up to 52 T with switched moments approximate to 3 mu(B) per formula unit in Sr3CoIrO6. We propose that the magnetic hysteresis involves the field- induced evolution of quasi-one-dimensional chains in a frustrated triangular configuration. The striking magnetic behavior is likely to be linked to the unusual spin-orbit-entangled local state of the Ir4+ ion and its potential for anisotropic exchange interactions. C1 [Singleton, John; Kim, Jae Wook; Topping, Craig V.; Hansen, Anders; Mun, Eun-Deok; Chikara, S.; Lakis, I.; Zapf, Vivien S.] Los Alamos Natl Lab, NHMFL, MS E536, Los Alamos, NM 87545 USA. [Singleton, John; Topping, Craig V.; Ghannadzadeh, Saman] Univ Oxford, Dept Phys, Clarendon Lab, Parks Rd, Oxford OX1 3PU, England. [Topping, Craig V.] Univ Edinburgh, Dept Chem, Edinburgh EH8 9YL, Midlothian, Scotland. [Mun, Eun-Deok] Simon Fraser Univ, Dept Phys, Burnaby, BC V5A 1S6, Canada. [Goddard, Paul] Univ Warwick, Dept Phys, Gibbet Hill Rd, Coventry CV4 7AL, W Midlands, England. [Luo, Xuan; Oh, Yoon Seok; Cheong, Sang-Wook] Rutgers State Univ, RCEM, Piscataway, NJ 08854 USA. [Luo, Xuan; Oh, Yoon Seok; Cheong, Sang-Wook] Rutgers State Univ, Dept Phys & Astron, Piscataway, NJ 08854 USA. [Luo, Xuan; Cheong, Sang-Wook] Pohang Univ Sci & Technol, POSTECH, San 31 Hyoja Dong, Pohang Si 790784, Gyungbuk, South Korea. RP Singleton, J (reprint author), Los Alamos Natl Lab, NHMFL, MS E536, Los Alamos, NM 87545 USA.; Singleton, J (reprint author), Univ Oxford, Dept Phys, Clarendon Lab, Parks Rd, Oxford OX1 3PU, England. RI Chikara, Shalinee/E-4654-2017; OI Goddard, Paul/0000-0002-0666-5236 FU U.S. Department of Energy, Basic Energy Sciences program "Science at 100 Tesla"; U.S. National Science Foundation [DMR-1157490]; State of Florida; U.S. Department of Energy; EPSRC; NSF [NSF-DMREF-1233349]; Max Planck POSTECH/KOREA Research Initiative Program through NRF of Korea - MEST [2011-031558]; University of Oxford FX This work is funded by the U.S. Department of Energy, Basic Energy Sciences program "Science at 100 Tesla". The NHMFL Pulsed Field Facility is funded by the U.S. National Science Foundation through Cooperative Grant No. DMR-1157490, the State of Florida, and the U.S. Department of Energy. P.G. and S.G. would like to thank the EPSRC for support. Data presented in this paper resulting from the UK effort will be made available at http://wrap.warwick.ac.uk/84051. P.G. and J.S. would like to thank the University of Oxford for the provision of visiting fellowships, which enabled much of the low-field data in this work to be acquired. We are grateful to Daniel Haskel for early communication of x-ray magnetic circular dichroism data [26] prior to publication. The work at Rutgers was supported by the NSF under Grant No. NSF-DMREF-1233349, and the work at Postech was supported by the Max Planck POSTECH/KOREA Research Initiative Program (Grant No. 2011-031558) through NRF of Korea funded by MEST. NR 49 TC 0 Z9 0 U1 16 U2 16 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 8 PY 2016 VL 94 IS 22 AR 224408 DI 10.1103/PhysRevB.94.224408 PG 10 WC Physics, Condensed Matter SC Physics GA EE3OX UT WOS:000389502700005 ER PT J AU Bazow, D Denicol, GS Heinz, U Martinez, M Noronha, J AF Bazow, D. Denicol, G. S. Heinz, U. Martinez, M. Noronha, J. TI Nonlinear dynamics from the relativistic Boltzmann equation in the Friedmann-Lemaitre-Robertson-Walker spacetime SO PHYSICAL REVIEW D LA English DT Article ID HEAVY-ION COLLISIONS; GLUON TRANSPORT-THEORY; NON-ABELIAN PLASMAS; KINETIC-THEORY; FIELD-THEORY; MODEL; THERMALIZATION; SIMULATIONS; RELAXATION AB The dissipative dynamics of an expanding massless gas with constant cross section in a spatially flat Friedmann-Lemaitre-Robertson-Walker (FLRW) universe is studied. The mathematical problem of solving the full nonlinear relativistic Boltzmann equation is recast into an infinite set of nonlinear ordinary differential equations for the moments of the one-particle distribution function. Momentum-space resolution is determined by the number of nonhydrodynamic modes included in the moment hierarchy, i.e., by the truncation order. We show that in the FLRW spacetime the nonhydrodynamic modes decouple completely from the hydrodynamic degrees of freedom. This results in the system flowing as an ideal fluid while at the same time producing entropy. The solutions to the nonlinear Boltzmann equation exhibit transient tails of the distribution function with nontrivial momentum dependence. The evolution of this tail is not correctly captured by the relaxation time approximation nor by the linearized Boltzmann equation. However, the latter probes additional high-momentum details unresolved by the relaxation time approximation. While the expansion of the FLRW spacetime is slow enough for the system to move towards (and not away from) local thermal equilibrium, it is not sufficiently slow for the system to actually ever reach complete local equilibrium. Equilibration is fastest in the relaxation time approximation, followed, in turn, by kinetic evolution with a linearized and a fully nonlinear Boltzmann collision term. C1 [Bazow, D.; Heinz, U.; Martinez, M.] Ohio State Univ, Dept Phys, Columbus, OH 43210 USA. [Denicol, G. S.] Univ Fed Fluminense, Inst Fis, BR-24210346 Niteroi, RJ, Brazil. [Denicol, G. S.] Brookhaven Natl Lab, Dept Phys, Upton, NY 11973 USA. [Noronha, J.] Univ Sao Paulo, Inst Fis, CP 66318, BR-05315970 Sao Paulo, SP, Brazil. RP Bazow, D (reprint author), Ohio State Univ, Dept Phys, Columbus, OH 43210 USA. OI Martinez Guerrero, Mauricio/0000-0003-2343-738X FU Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq); Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (FAPESP); DOE [DE-SC0012704]; U. S. Department of Energy, Office of Science, Office for Nuclear Physics [DE-SC0004286]; FAPESP; Ohio State University FX We gratefully acknowledge inspiring discussions with S. Schlichting, S. Konig, Y. Mehtar-Tani, S. Ozonder, and A. Dumitru. M. M thanks C. Plumberg for pointing out Ref. [77] on combinatorial identities. J. N thanks Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq) and Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (FAPESP) for financial support. U. H and M. M express their gratitude to the Institute for Nuclear Theory, where part of this work was realized, for its hospitality. G. S. D was supported by DOE Contract No. DE-SC0012704. D. B, U. H and M. M are supported by the U. S. Department of Energy, Office of Science, Office for Nuclear Physics under Award No. DE-SC0004286. U. H, M. M, and J. N acknowledge support through a bilateral travel grant from FAPESP and The Ohio State University. NR 88 TC 0 Z9 0 U1 1 U2 1 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 8 PY 2016 VL 94 IS 12 AR 125006 DI 10.1103/PhysRevD.94.125006 PG 24 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EE3PR UT WOS:000389505800005 ER PT J AU Lee, HJ Lee, SS Kwak, JH Kim, YM Jeong, HY Borisevich, AY Lee, SY Noh, DY Kwon, O Kim, Y Jo, JY AF Lee, Hyeon Jun Lee, Sung Su Kwak, Jeong Hun Kim, Young-Min Jeong, Hu Young Borisevich, Albina Y. Lee, Su Yong Noh, Do Young Kwon, Owoong Kim, Yunseok Jo, Ji Young TI Depth resolved lattice-charge coupling in epitaxial BiFeO3 thin film SO Scientific Reports LA English DT Article ID STRAIN RELAXATION; POLARIZATION; THICKNESS; INTERFACE; FERROELECTRICITY; GRADIENTS; FIELD AB For epitaxial films, a critical thickness (t(c)) can create a phenomenological interface between a strained bottom layer and a relaxed top layer. Here, we present an experimental report of how the t(c) in BiFeO3 thin films acts as a boundary to determine the crystalline phase, ferroelectricity, and piezoelectricity in 60 nm thick BiFeO3/SrRuO3/SrTiO3 substrate. We found larger Fe cation displacement of the relaxed layer than that of strained layer. In the time-resolved X-ray microdiffraction analyses, the piezoelectric response of the BiFeO3 film was resolved into a strained layer with an extremely low piezoelectric coefficient of 2.4 pm/V and a relaxed layer with a piezoelectric coefficient of 32 pm/V. The difference in the Fe displacements between the strained and relaxed layers is in good agreement with the differences in the piezoelectric coefficient due to the electromechanical coupling. C1 [Lee, Hyeon Jun; Lee, Sung Su; Kwak, Jeong Hun; Jo, Ji Young] Gwangju Inst Sci & Technol, Sch Mat Sci & Engn, Gwangju 61005, South Korea. [Kim, Young-Min] Sungkyunkwan Univ SKKU, Dept Energy Sci, Suwon 16419, South Korea. [Kim, Young-Min] IBS, Ctr Integrated Nanostruct Phys, Suwon 16419, South Korea. [Jeong, Hu Young] Ulsan Natl Inst Sci & Technol, UNIST Cent Res Facil, Ulsan 44919, South Korea. [Borisevich, Albina Y.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Lee, Su Yong] Pohang Accelerator Lab, Pohang 37673, South Korea. [Kwon, Owoong] Gwangju Inst Sci & Technol, Dept Phys & Photon Sci, Gwangju 61005, South Korea. [Kwon, Owoong; Kim, Yunseok] Sungkyunkwan Univ, Sch Adv Mat Sci & Engn, Suwon 16419, South Korea. RP Jo, JY (reprint author), Gwangju Inst Sci & Technol, Sch Mat Sci & Engn, Gwangju 61005, South Korea. EM jyjo@gist.ac.kr RI Kim, Young-Min/B-7338-2012 OI Kim, Young-Min/0000-0003-3220-9004 FU National Research Foundation of Korea (NRF) - Korean government [NRF-2014R1A1A3053111, NRF-2016R1D1A1A02937051]; GRI (GIST Research Institute) project by GIST; TJ Park Science Fellowship of the POSCO TJ Park Foundation; MSIO PAL, Korea; Institute for Basic Science [IBS-R011-D1] FX J.Y.J. acknowledges support through grants from the National Research Foundation of Korea (NRF) funded by the Korean government (NRF-2014R1A1A3053111 and NRF-2016R1D1A1A02937051), the GRI (GIST Research Institute) project by GIST, the TJ Park Science Fellowship of the POSCO TJ Park Foundation, and MSIO & PAL, Korea. Y.M.K. was financially supported by the Institute for Basic Science (IBS-R011-D1). D.Y.N acknowledges the Center for Advanced X-ray Science (NRF-2015R1A5A1009962). NR 31 TC 0 Z9 0 U1 17 U2 17 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 8 PY 2016 VL 6 AR 38724 DI 10.1038/srep38724 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE3LJ UT WOS:000389490300001 PM 27929103 ER PT J AU Khalil, M Poirel, D Sarkar, A AF Khalil, Mohammad Poirel, Dominique Sarkar, Abhijit TI Bayesian analysis of the flutter margin method in aeroelasticity SO JOURNAL OF SOUND AND VIBRATION LA English DT Article DE Aeroelasticity; Coalescence Flutter; Bayesian estimation; Metropolis-Hastings algorithm; Non-Gaussian; Parameter Estimation AB A Bayesian statistical framework is presented for Zimmerman and Weissenburger flutter margin method which considers the uncertainties in aeroelastic modal parameters. The proposed methodology overcomes the limitations of the previously developed least square based estimation technique which relies on the Gaussian approximation of the flutter margin probability density function (pdf). Using the measured free-decay responses at subcritical (preflutter) airspeeds, the joint non-Gaussain posterior pdf of the modal parameters is sampled using the Metropolis-Hastings (MH)Markov chain Monte Carlo (MCMC) algorithm. The posterior MCMC samples of the modal parameters are then used to obtain the flutter margin pdfs and finally the flutter speed pdf. The usefulness of the Bayesian flutter margin method is demonstrated using synthetic data generated from a two-degree-of-freedom pitch-plunge aeroelastic model. The robustness of the statistical framework is demonstrated using different sets of measurement data. It will be shown that the probabilistic (Bayesian) approach reduces the number of test points required in providing a flutter speed estimate for a given accuracy and precision. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Khalil, Mohammad; Sarkar, Abhijit] Carleton Univ, Dept Civil & Environm Engn, Mackenzie Bldg,Colonel By Dr, Ottawa, ON K1S 5B6, Canada. [Poirel, Dominique] Royal Mil Coll Canada, Dept Mech & Aerosp Engn, Kingston, ON K7K 7B4, Canada. [Khalil, Mohammad] Sandia Natl Labs, POB 969 MS 9051, Livermore, CA 94551 USA. RP Sarkar, A (reprint author), Carleton Univ, Dept Civil & Environm Engn, Mackenzie Bldg,Colonel By Dr, Ottawa, ON K1S 5B6, Canada. EM abhijit_sarkar@carleton.ca RI Sarkar, Abhijit/E-6918-2012 OI Sarkar, Abhijit/0000-0002-8427-8901 FU Natural Sciences and Engineering Research Council of Canada through the award of a Canada Graduate Scholarship; Canadian Department of National Defence; Canadian Department of National Defence and a Discovery Grant from Natural Sciences and Engineering Research Council of Canada; Canada Research Chair Program; Canada Foundation for Innovation (CFI); Ontario Innovation Trust (OIT); Natural Sciences and Engineering Research Council of Canada FX The first author acknowledges the support of the Natural Sciences and Engineering Research Council of Canada through the award of a Canada Graduate Scholarship and the Canadian Department of National Defence. The second author acknowledges the support of the Canadian Department of National Defence and a Discovery Grant from Natural Sciences and Engineering Research Council of Canada. The third author acknowledges the support of a Discovery Grant from Natural Sciences and Engineering Research Council of Canada and the Canada Research Chair Program. The computing infrastructure is supported by the Canada Foundation for Innovation (CFI) and the Ontario Innovation Trust (OIT). NR 36 TC 0 Z9 0 U1 10 U2 10 PU ACADEMIC PRESS LTD- ELSEVIER SCIENCE LTD PI LONDON PA 24-28 OVAL RD, LONDON NW1 7DX, ENGLAND SN 0022-460X EI 1095-8568 J9 J SOUND VIB JI J. Sound Vibr. PD DEC 8 PY 2016 VL 384 BP 56 EP 74 DI 10.1016/j.jsv.2016.07.016 PG 19 WC Acoustics; Engineering, Mechanical; Mechanics SC Acoustics; Engineering; Mechanics GA DY1JH UT WOS:000384850800005 ER PT J AU Shi, SB Liao, QG Tang, YM Guo, H Zhou, X Wang, YL Yang, TB Liang, YY Cheng, X Liu, F Guo, XG AF Shi, Shengbin Liao, Qiaogan Tang, Yumin Guo, Han Zhou, Xin Wang, Yulun Yang, Tingbin Liang, Yongye Cheng, Xing Liu, Feng Guo, Xugang TI Head-to-Head Linkage Containing Bithiophene-Based Polymeric Semiconductors for Highly Efficient Polymer Solar Cells SO ADVANCED MATERIALS LA English DT Article ID CIRCUIT CURRENT-DENSITY; HIGH FILL FACTOR; CONJUGATED POLYMERS; HIGH-PERFORMANCE; CONVERSION EFFICIENCY; BUILDING-BLOCK; MORPHOLOGY; DONOR; TRANSISTORS; ENHANCEMENT AB Narrow bandgap (1.37-1.46 eV) polymers incorporating a head-to-head linkage containing 3-alkoxy-3'-alkyl-2,2'-bithiophene are synthesized. The head-to-head linkage enables polymers with sufficient solubility and the noncovalent sulfur-oxygen interaction affords polymers with high degree of backbone planarity and film ordering. When integrated into polymer solar cells, the polymers show a promising power conversion efficiency approaching 10%. C1 [Shi, Shengbin; Liao, Qiaogan; Tang, Yumin; Guo, Han; Zhou, Xin; Wang, Yulun; Yang, Tingbin; Liang, Yongye; Cheng, Xing; Guo, Xugang] South Univ Sci & Technol China, Dept Mat Sci & Engn, 1088 Xueyuan Rd, Shenzhen 518055, Guangdong, Peoples R China. [Liu, Feng] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. [Liu, Feng] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. RP Guo, XG (reprint author), South Univ Sci & Technol China, Dept Mat Sci & Engn, 1088 Xueyuan Rd, Shenzhen 518055, Guangdong, Peoples R China.; Liu, F (reprint author), Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China.; Liu, F (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. EM fengliu82@sjtu.edu.cn; guoxg@sustc.edu.cn RI Liu, Feng/J-4361-2014 OI Liu, Feng/0000-0002-5572-8512 FU Basic Research Fund of Shenzhen City [JCYJ20140714151402769, JCYJ20150630145302236]; Shenzhen Peacock Plan project [KQTD20140630110339343]; National Science Foundation of China (NSFC) [51573076]; Shenzhen Key Lab [ZDSYS201505291525382]; Guangdong Natural Science Foundation [2015A030313900]; South University of Science and Technology of China [FRG-SUSTC1501A-72] FX S.S. and Q.L. contributed equally to this work. X.G. thanks financial support by the Basic Research Fund of Shenzhen City (JCYJ20140714151402769), Shenzhen Peacock Plan project (KQTD20140630110339343), the National Science Foundation of China (NSFC, No. 51573076), the Shenzhen Key Lab funding (ZDSYS201505291525382), the Guangdong Natural Science Foundation (2015A030313900), and South University of Science and Technology of China (FRG-SUSTC1501A-72). T.Y. acknowledges support from the Basic Research Fund of Shenzhen City (JCYJ20150630145302236). NR 59 TC 4 Z9 4 U1 14 U2 14 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0935-9648 EI 1521-4095 J9 ADV MATER JI Adv. Mater. PD DEC 7 PY 2016 VL 28 IS 45 BP 9969 EP 9977 DI 10.1002/adma.201603112 PG 9 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EI8AA UT WOS:000392725200007 PM 27717205 ER PT J AU Wilkerson, RP Gludovatz, B Watts, J Tomsia, AP Hilmas, GE Ritchie, RO AF Wilkerson, Ryan P. Gludovatz, Bernd Watts, Jeremy Tomsia, Antoni P. Hilmas, Gregory E. Ritchie, Robert O. TI A Novel Approach to Developing Biomimetic ("Nacre-Like") Metal-Compliant-Phase (Nickel-Alumina) Ceramics through Coextrusion SO ADVANCED MATERIALS LA English DT Article ID FIBROUS MONOLITHIC CERAMICS; EXCEPTIONAL MECHANICAL-PROPERTIES; FRACTURE-TOUGHNESS; HYBRID MATERIALS; INDENTATION BEHAVIOR; MATRIX COMPOSITES; STRENGTH; MICROSTRUCTURE; DESIGN; RESISTANCE AB Bioinspired "brick-and-mortar" alumina ceramics containing a nickel compliant phase are synthesized by coextrusion of alumina and nickel oxide. Results show that these structures are coarser yet exhibit exceptional resistance-curve behavior with a fracture toughness three or more times higher than that of alumina, consistent with significant extrinsic toughening, from crack bridging and "brick" pull-out, in the image of natural nacre. C1 [Wilkerson, Ryan P.; Ritchie, Robert O.] Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA. [Wilkerson, Ryan P.; Gludovatz, Bernd; Tomsia, Antoni P.; Ritchie, Robert O.] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Watts, Jeremy; Hilmas, Gregory E.] Missouri Univ Sci & Technol, Dept Mat Sci & Engn, Rolla, MO 65409 USA. RP Ritchie, RO (reprint author), Univ Calif Berkeley, Dept Mat Sci & Engn, Berkeley, CA 94720 USA.; Ritchie, RO (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. EM roritchie@lbl.gov RI Ritchie, Robert/A-8066-2008; OI Ritchie, Robert/0000-0002-0501-6998; Gludovatz, Bernd/0000-0002-2420-3879 FU Mechanical Behavior of Materials Program at the Lawrence Berkeley National Laboratory [KC-13]; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division [DE-AC02-05CH11231] FX This work was supported by the Mechanical Behavior of Materials Program (KC-13) at the Lawrence Berkeley National Laboratory, funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division, under Contract No. DE-AC02-05CH11231. Processing facilities were provided by the Missouri University of Science and Technology, Rolla. NR 41 TC 0 Z9 0 U1 14 U2 14 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0935-9648 EI 1521-4095 J9 ADV MATER JI Adv. Mater. PD DEC 7 PY 2016 VL 28 IS 45 BP 10061 EP 10067 DI 10.1002/adma.201602471 PG 7 WC Chemistry, Multidisciplinary; Chemistry, Physical; Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied; Physics, Condensed Matter SC Chemistry; Science & Technology - Other Topics; Materials Science; Physics GA EI8AA UT WOS:000392725200019 PM 27690374 ER PT J AU Baker, AH Hammerling, DM Mickelson, SA Xu, HY Stolpe, MB Naveau, P Sanderson, B Ebert-Uphoff, I Samarasinghe, S De Simone, F Carbone, F Gencarelli, CN Dennis, JM Kay, JE Lindstrom, P AF Baker, Allison H. Hammerling, Dorit M. Mickelson, Sheri A. Xu, Haiying Stolpe, Martin B. Naveau, Phillipe Sanderson, Ben Ebert-Uphoff, Imme Samarasinghe, Savini De Simone, Francesco Carbone, Francesco Gencarelli, Christian N. Dennis, John M. Kay, Jennifer E. Lindstrom, Peter TI Evaluating lossy data compression on climate simulation data within a large ensemble SO GEOSCIENTIFIC MODEL DEVELOPMENT LA English DT Article ID EARTH SYSTEM MODEL AB High-resolution Earth system model simulations generate enormous data volumes, and retaining the data from these simulations often strains institutional storage resources. Further, these exceedingly large storage requirements negatively impact science objectives, for example, by forcing reductions in data output frequency, simulation length, or ensemble size. To lessen data volumes from the Community Earth System Model (CESM), we advocate the use of lossy data compression techniques. While lossy data compression does not exactly preserve the original data (as lossless compression does), lossy techniques have an advantage in terms of smaller storage requirements. To preserve the integrity of the scientific simulation data, the effects of lossy data compression on the original data should, at a minimum, not be statistically distinguishable from the natural variability of the climate system, and previous preliminary work with data from CESM has shown this goal to be attainable. However, to ultimately convince climate scientists that it is acceptable to use lossy data compression, we provide climate scientists with access to publicly available climate data that have undergone lossy data compression. In particular, we report on the results of a lossy data compression experiment with output from the CESM Large Ensemble (CESM-LE) Community Project, in which we challenge climate scientists to examine features of the data relevant to their interests, and attempt to identify which of the ensemble members have been compressed and reconstructed. We find that while detecting distinguishing features is certainly possible, the compression effects noticeable in these features are often unimportant or disappear in post-processing analyses. In addition, we perform several analyses that directly compare the original data to the reconstructed data to investigate the preservation, or lack thereof, of specific features critical to climate science. Overall, we conclude that applying lossy data compression to climate simulation data is both advantageous in terms of data reduction and generally acceptable in terms of effects on scientific results. C1 [Baker, Allison H.; Hammerling, Dorit M.; Mickelson, Sheri A.; Xu, Haiying; Sanderson, Ben; Dennis, John M.] Natl Ctr Atmospher Res, POB 3000, Boulder, CO 80307 USA. [Stolpe, Martin B.] Swiss Fed Inst Technol, Inst Atmospher & Climate Sci, Zurich, Switzerland. [Naveau, Phillipe] Lab Sci Climat & Environm, Gif Sur Yvette, France. [Ebert-Uphoff, Imme; Samarasinghe, Savini] Colorado State Univ, Dept Elect & Comp Engn, Ft Collins, CO 80523 USA. [De Simone, Francesco; Carbone, Francesco; Gencarelli, Christian N.] UNICAL Polifunz, CNR, Inst Atmospher Pollut Res, Div Rende, Arcavacata Di Rende, Italy. [Kay, Jennifer E.] Univ Colorado, Dept Ocean & Atmospher Sci, Boulder, CO 80309 USA. [Lindstrom, Peter] Lawrence Livermore Natl Lab, Ctr Appl Sci Comp, Livermore, CA USA. RP Baker, AH (reprint author), Natl Ctr Atmospher Res, POB 3000, Boulder, CO 80307 USA. EM abaker@ucar.edu OI Hammerling, Dorit/0000-0003-3583-3611; Ebert-Uphoff, Imme/0000-0001-6470-1947; Lindstrom, Peter/0000-0003-3817-4199 FU National Science Foundation; ANR-DADA; LEFE-INSU-Multirisk; AMERISKA; A2C2; Extremoscope projects; U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344]; U.S. Department of Energy, Office of Science, Office of Advanced Scientific Computing Research FX We thank Adam Phillips (NCAR) for his input on CVDP. We thank Reto Knutti (ETH Zurich) for his suggestions and ideas. We also thank William Kaufman (Fairview HS) for his work on Fig. 17. This research used computing resources provided by the Climate Simulation Laboratory at NCAR's Computational and Information Systems Laboratory (CISL), sponsored by the National Science Foundation and other agencies. Part of this work has been supported by the ANR-DADA, LEFE-INSU-Multirisk, AMERISKA, A2C2, and Extremoscope projects. Part of the work was done during P. Naveau's visit to IMAGe-NCAR in Boulder, CO, USA. Part of this work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under contract DE-AC52-07NA27344, and this material is based upon work supported by the U.S. Department of Energy, Office of Science, Office of Advanced Scientific Computing Research. NR 50 TC 0 Z9 0 U1 0 U2 0 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1991-959X EI 1991-9603 J9 GEOSCI MODEL DEV JI Geosci. Model Dev. PD DEC 7 PY 2016 VL 9 IS 12 BP 4381 EP 4403 DI 10.5194/gmd-9-4381-2016 PG 23 WC Geosciences, Multidisciplinary SC Geology GA EF9KY UT WOS:000390650300001 ER PT J AU Hidy, D Barcza, Z Marjanovic, H Sever, MZO Dobor, L Gelybo, G Fodor, N Pinter, K Churkina, G Running, S Thornton, P Bellocchi, G Haszpra, L Horvath, F Suyker, A Nagy, Z AF Hidy, Dora Barcza, Zoltan Marjanovic, Hrvoje Sever, Masa Zorana Ostrogovic Dobor, Laura Gelybo, Gyorgyi Fodor, Nandor Pinter, Krisztina Churkina, Galina Running, Steven Thornton, Peter Bellocchi, Gianni Haszpra, Laszlo Horvath, Ferenc Suyker, Andrew Nagy, Zoltan TI Terrestrial ecosystem process model Biome-BGCMuSo v4.0: summary of improvements and new modeling possibilities SO GEOSCIENTIFIC MODEL DEVELOPMENT LA English DT Article ID EDDY COVARIANCE MEASUREMENTS; CARBON-DIOXIDE EXCHANGE; LAND-COVER CONVERSION; RAIN-FED MAIZE; BGC MODEL; STOMATAL CONDUCTANCE; SONIC ANEMOMETER; NITROGEN DEPOSITION; ATMOSPHERIC CO2; REGIONAL APPLICATIONS AB The process-based biogeochemical model Biome-BGC was enhanced to improve its ability to simulate carbon, nitrogen, and water cycles of various terrestrial ecosystems under contrasting management activities. Biome-BGC version 4.1.1 was used as a base model. Improvements included addition of new modules such as the multilayer soil module, implementation of processes related to soil moisture and nitrogen balance, soil-moisture-related plant senescence, and phenological development. Vegetation management modules with annually varying options were also implemented to simulate management practices of grasslands (mowing, grazing), croplands (ploughing, fertilizer application, planting, harvesting), and forests (thinning). New carbon and nitrogen pools have been defined to simulate yield and soft stem development of herbaceous ecosystems. The model version containing all developments is referred to as Biome-BGCMuSo (Biome-BGC with multilayer soil module; in this paper, Biome-BGCMuSo v4.0 is documented). Case studies on a managed forest, cropland, and grassland are presented to demonstrate the effect of model developments on the simulation of plant growth as well as on carbon and water balance. C1 [Hidy, Dora; Pinter, Krisztina; Nagy, Zoltan] Szent Istvan Univ, MTA SZIE Plant Ecol Res Grp, Pater K U 1, H-2103 Godollo, Hungary. [Barcza, Zoltan; Dobor, Laura] Eotvos Lorand Univ, Dept Meteorol, Pazmany P Setany 1-A, H-1117 Budapest, Hungary. [Marjanovic, Hrvoje; Sever, Masa Zorana Ostrogovic] Croatian Forest Res Inst, Dept Forest Management & Forestry Econ, Cvjetno Naselje 41, Jastrebarsko 10450, Croatia. [Gelybo, Gyorgyi] Hungarian Acad Sci, Agr Res Ctr, Inst Soil Sci & Agr Chem, Herman O Ut 15, H-1163 Budapest, Hungary. [Fodor, Nandor] Hungarian Acad Sci, Agr Res Ctr, Inst Agr, Brunszvik U 2, H-2462 Martonvasar, Hungary. [Churkina, Galina] Inst Adv Sustainabil Studies eV, Berliner Str 130, D-14467 Potsdam, Germany. [Running, Steven] Univ Montana, Dept Ecosyst & Conservat Sci, Numer Terradynam Simulat Grp, Missoula, MT 59812 USA. [Thornton, Peter] Oak Ridge Natl Lab, Div Environm Sci, Climate Change Sci Inst, POB 2008, Oak Ridge, TN 37831 USA. [Bellocchi, Gianni] INRA, UREP, F-63000 Clermont Ferrand, France. [Haszpra, Laszlo] Hungarian Meteorol Serv, POB 39, H-1675 Budapest, Hungary. [Horvath, Ferenc] Hungarian Acad Sci, Ctr Ecol Res, Inst Ecol & Bot, Alkotmany U 2-4, H-2163 Vacratot, Hungary. [Suyker, Andrew] Univ Nebraska, Sch Nat Resources, 806 Hardin Hall, Lincoln, NE 68588 USA. [Haszpra, Laszlo] MTA Res Ctr Astron & Earth Sci, Geodet & Geophys Inst, Csatkai Endre Utca 6-8, H-9400 Sopron, Hungary. [Dobor, Laura] Czech Univ Life Sci, Fac Forestry & Wood Sci, Dept Forest Protect & Entomol, Kamycka 129, Prague 16521 6, Czech Republic. [Churkina, Galina] Humboldt Univ, Dept Geog, Berlin, Germany. RP Hidy, D (reprint author), Szent Istvan Univ, MTA SZIE Plant Ecol Res Grp, Pater K U 1, H-2103 Godollo, Hungary. EM dori.hidy@gmail.com RI Thornton, Peter/B-9145-2012; OI Thornton, Peter/0000-0002-4759-5158; Marjanovic, Hrvoje/0000-0001-5701-7581 FU Hungarian Academy of Sciences [MTA PD 450012]; Hungarian Scientific Research Fund [OTKA K104816]; BioVeL project (Biodiversity Virtual e-Laboratory Project) [FP7-INFRASTRUCTURES-2011-2, 283359]; EU FP7 WHEALBI Project [613556]; Croatian Science Foundation Installation Research Project EFFEctivity [HRZZ-UIP-11-2013-2492]; metaprogramme Adaptation of Agriculture and Forests to Climate Change (AAFCC) of the French National Institute for Agricultural Research (INRA) FX The research was funded by the Hungarian Academy of Sciences (MTA PD 450012), the Hungarian Scientific Research Fund (OTKA K104816), the BioVeL project (Biodiversity Virtual e-Laboratory Project, FP7-INFRASTRUCTURES-2011-2, project number 283359), the EU FP7 WHEALBI Project (Wheat and Barley Legacy for Breeding Improvement; project No. 613556), the Croatian Science Foundation Installation Research Project EFFEctivity (HRZZ-UIP-11-2013-2492), and metaprogramme Adaptation of Agriculture and Forests to Climate Change (AAFCC) of the French National Institute for Agricultural Research (INRA). We acknowledge the international research project titled "FACCE MACSUR - Modelling European Agriculture with Climate Change for Food Security, a FACCE JPI knowledge hub". Biome-BGC version 4.1.1 (the predecessor of BBGCMuSo) was provided by the Numerical Terradynamic Simulation Group (NTSG) at the University of Montana, Missoula, MT (USA), which assumes no responsibility for the proper use by others. We are grateful to the Laboratory of Parallel and Distributed Systems, Institute for Computer Science and Control (MTA SZTAKI), that provided consultation, technical expertise, and access to the EDGeS@home volunteer desk top grid system in computationally demanding analysis. We thank Ben Bond-Lamberty and one anonymous referee for the valuable comments on the manuscript. NR 135 TC 0 Z9 0 U1 10 U2 10 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1991-959X EI 1991-9603 J9 GEOSCI MODEL DEV JI Geosci. Model Dev. PD DEC 7 PY 2016 VL 9 IS 12 BP 4405 EP 4437 DI 10.5194/gmd-9-4405-2016 PG 33 WC Geosciences, Multidisciplinary SC Geology GA EF9KY UT WOS:000390650300002 ER PT J AU Swanson, C Kaganovich, ID AF Swanson, Charles Kaganovich, Igor D. TI Modeling of reduced effective secondary electron emission yield from a velvet surface SO JOURNAL OF APPLIED PHYSICS LA English DT Article AB Complex structures on a material surface can significantly reduce total secondary electron emission from that surface. A velvet is a surface that consists of an array of vertically standing whiskers. The reduction occurs due to the capture of low-energy, true secondary electrons emitted at the bottom of the structure and on the sides of the velvet whiskers. We performed numerical simulations and developed an approximate analytical model that calculates the net secondary electron emission yield from a velvet surface as a function of the velvet whisker length and packing density, and the angle of incidence of primary electrons. We found that to suppress secondary electrons, the following condition on dimensionless parameters must be met: (pi/2)DA tan theta >> 1, where theta is the angle of incidence of the primary electron from the normal, D is the fraction of surface area taken up by the velvet whisker bases, and A is the aspect ratio, A equivalent to h/r, the ratio of height to radius of the velvet whiskers. We find that velvets available today can reduce the secondary electron yield by 90% from the value of a flat surface. The values of optimal velvet whisker packing density that maximally suppresses the secondary electron emission yield are determined as a function of velvet aspect ratio and the electron angle of incidence. Published by AIP Publishing. C1 [Swanson, Charles; Kaganovich, Igor D.] Princeton Univ, Princeton Plasma Phys Lab, Princeton, NJ 08543 USA. RP Swanson, C (reprint author), Princeton Univ, Princeton Plasma Phys Lab, Princeton, NJ 08543 USA. FU AFOSR [FA9550-11-1-0282]; UCLA FX The authors would like to thank Alexander Khrabrov for checking the math and ensuring consistency of the distribution function and flux formulations. This work was conducted under a subcontract with UCLA with the support of AFOSR under Grant No. FA9550-11-1-0282. NR 24 TC 1 Z9 1 U1 7 U2 7 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-8979 EI 1089-7550 J9 J APPL PHYS JI J. Appl. Phys. PD DEC 7 PY 2016 VL 120 IS 21 AR 213302 DI 10.1063/1.4971337 PG 9 WC Physics, Applied SC Physics GA EF8TN UT WOS:000390602600006 ER PT J AU Wright, AF Modine, NA AF Wright, A. F. Modine, N. A. TI Migration processes of the As interstitial in GaAs SO JOURNAL OF APPLIED PHYSICS LA English DT Article ID LEVEL TRANSIENT SPECTROSCOPY; SELF-DIFFUSION; 1ST-PRINCIPLES CALCULATIONS; ELECTRONIC-STRUCTURE; ARSENIC SUBLATTICE; POINT-DEFECTS; TOTAL-ENERGY; PSEUDOPOTENTIALS; SEMICONDUCTORS; RECOMBINATION AB Thermal migration processes of the As interstitial in GaAs were investigated using density-functional theory and the local-density approximation for exchange and correlation. The lowest-energy processes were found to involve the -1, 0, and +1 charge states, and to produce migration along < 110 >-type directions. In the -1 and 0 charge states, migration proceeds via hops between split-interstitial stable configurations at bulk As sites through bridging saddle-point configurations in which the interstitial atom is equidistant from two adjacent bulk As sites. In the +1 charge state, the roles of these two configurations are approximately reversed and migration proceeds via hops between bridging stable configurations through higher-energy split-interstitial stable configurations bounded by a pair of distorted split-interstitial saddle-point configurations. The predicted activation energies for migration in the 0 and +1 charge states agree well with measurements in semi-insulating and p-type material, respectively. Also consistent with experiments, the approximate reversal of the stable and saddle-point configurations between the 0 and +1 charge states is predicted to enable carrier-induced migration with a residual activation energy of 0.05 eV. Published by AIP Publishing. C1 [Wright, A. F.; Modine, N. A.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. RP Wright, AF (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. FU U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX This work was performed, in part, at the Center for Integrated Nanotechnologies, a U.S. Department of Energy, Office of Basic Energy Sciences user facility. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract No. DE-AC04-94AL85000. The authors wish to thank S. R. Lee at Sandia National Laboratories for the many helpful discussions. NR 51 TC 0 Z9 0 U1 1 U2 1 PU AMER INST PHYSICS PI MELVILLE PA 1305 WALT WHITMAN RD, STE 300, MELVILLE, NY 11747-4501 USA SN 0021-8979 EI 1089-7550 J9 J APPL PHYS JI J. Appl. Phys. PD DEC 7 PY 2016 VL 120 IS 21 AR 215705 DI 10.1063/1.4969049 PG 11 WC Physics, Applied SC Physics GA EF8TN UT WOS:000390602600040 ER PT J AU Babu, SK Chung, HT Zelenay, P Litster, S AF Babu, Siddharth Komini Chung, Hoon T. Zelenay, Piotr Litster, Shawn TI Resolving Electrode Morphology's Impact on Platinum Group Metal-Free Cathode Performance Using Nano-CT of 3D Hierarchical Pore and Ionomer Distribution SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE platinum group metal-free catalyst; computed tomography; ionomer imaging morphological characterization; transport modeling ID FUEL-CELL ELECTRODES; RAY COMPUTED-TOMOGRAPHY; OXYGEN REDUCTION; CATALYST LAYERS; NAFION; CARBON; ELECTROCATALYSTS; MICROSTRUCTURE; MICROSCOPY; SIMULATION AB This article reports on the characterization of polymer electrolyte fuel cell (PEFC) cathodes featuring a platinum group metal-free (PGM-free) catalyst using nano-scale resolution X-ray computed tomography (nano-CT) and morphological analysis. PGM-free PEFC cathodes have gained significant interest in the past decade since they have the potential to dramatically reduce PEFC costs by eliminating the large platinum (Pt) raw material cost. However, several challenges remain before they are commercially viable. Since these catalysts have lower volumetric activity, the PGM-free cathodes are thicker and subject to increased gas and proton transport resistances that reduce the performance. To better understand the efficacy of the catalyst and improve electrode performance, a detailed understanding the correlation between electrode fabrication, morphology, and performance is crucial. In this work, the pore/solid structure and the ionomer distribution was resolved in three dimensions (3D) using nano-CT for three PGM-free electrodes of varying Nafion loading. The associated transport properties were evaluated from pore/particle-scale simulations within the nano-CT-imaged structure. These characterizations are then used to elucidate the microstructural origins of the dramatic changes in fuel cell performance with varying Nafion ionomer loading. We show that this is primarily a result of distinct changes in ionomer's spatial distribution. The significant impact of electrode morphology on performance highlights the importance of PGM-free electrode development in concert with efforts to improve catalyst activity and durability. C1 [Babu, Siddharth Komini; Litster, Shawn] Carnegie Mellon Univ, Dept Mech Engn, Pittsburgh, PA 15213 USA. [Chung, Hoon T.; Zelenay, Piotr] Los Alamos Natl Lab, Mat Phys & Applicat, Los Alamos, NM 87545 USA. RP Litster, S (reprint author), Carnegie Mellon Univ, Dept Mech Engn, Pittsburgh, PA 15213 USA. EM litster@andrew.cmu.edu RI Chung, Hoon/A-7916-2012; OI Chung, Hoon/0000-0002-5367-9294; Komini Babu, Siddharth/0000-0001-5724-8486 FU U.S. Department of Energy, the Office of Energy Efficiency and Renewable Energy, Office of Fuel Cell Technologies; National Science Foundation [1229090] FX The authors gratefully acknowledge the support the support of the technology development manager Nancy Garland and funding from the U.S. Department of Energy, the Office of Energy Efficiency and Renewable Energy, Office of Fuel Cell Technologies. The nano-CT instrument was acquired with the support of a Major Research Infrastructure award from the National Science Foundation under Grant No. 1229090. NR 53 TC 1 Z9 1 U1 8 U2 8 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 7 PY 2016 VL 8 IS 48 BP 32764 EP 32777 DI 10.1021/acsami.6b08844 PG 14 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EE5DH UT WOS:000389624600017 ER PT J AU Fan, Y Robertson, AW Zhang, XW Tweedie, M Zhou, YQ Rummeli, MH Zheng, HM Warner, JH AF Fan, Ye Robertson, Alex W. Zhang, Xiaowei Tweedie, Martin Zhou, Yingqiu Rummeli, Mark H. Zheng, Haimei Warner, Jamie H. TI Negative Electro-conductance in Suspended 2D WS2 Nanoscale Devices SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE electro-conductance; WS2; 2D; in situ; TEM ID TRANSITION-METAL DICHALCOGENIDES; FIELD-EFFECT TRANSISTOR; IN-SITU; LAYER WS2; GRAPHENE NANORIBBONS; MONOLAYER MOS2; CARBON NANOTUBES; LIGHT-EMISSION; TRANSPORT; GAIN AB We study the in situ electro-conductance in nano scale electronic devices composed of suspended monolayer WS2 with metal electrodes inside an aberration-corrected transmission electron microscope. Monitoring the conductance changes when the device is exposed to the electron beam of 80 keV energy reveals a reversible decrease in conductivity with increasing beam current density. The response time of the electro-conductance when exposed to the electron beam is substantially faster than the recovery time when the beam is turned off. We propose a charge trap model that accounts for excitation of electrons into the conduction band and localized trap states from energy supplied by inelastic scattering of incident 80 keV electrons. These results show how monolayer transition metal dichalcogenide 2D semiconductors can be used as transparent direct electron detectors in ultrathin nanoscale devices. C1 [Fan, Ye; Robertson, Alex W.; Tweedie, Martin; Zhou, Yingqiu; Warner, Jamie H.] Univ Oxford, Dept Mat, Parks Rd, Oxford OX1 3PH, England. [Zhang, Xiaowei; Zheng, Haimei] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. [Rummeli, Mark H.] IFW Dresden, D-01171 Dresden, Germany. [Rummeli, Mark H.] Soochow Univ, Coll Phys Optoelect & Energy, Suzhou 215006, Peoples R China. [Rummeli, Mark H.] Soochow Univ, Collaborat Innovat Ctr Suzhou Nano Sci & Technol, Suzhou 215006, Peoples R China. [Rummeli, Mark H.] Polish Acad Sci, Ctr Polymer & Carbon Mat, M Curie Sklodowskiej 34, PL-41819 Zabrze, Poland. RP Warner, JH (reprint author), Univ Oxford, Dept Mat, Parks Rd, Oxford OX1 3PH, England. EM Jamie.warner@materials.ox.ac.uk RI Robertson, Alex/J-5321-2014 OI Robertson, Alex/0000-0002-9521-6482 FU Royal Society; University of Oxford; DOE Early Career Research Program; National Science Centre (OPUS programme) [015/19/B/STS/03399] FX J.H.W. thanks the Royal Society for support. Y.F. is thankful for the support from the Clarendon Scholarship from the University of Oxford. H.Z. is thankful for the support from the DOE Early Career Research Program. M.H.R thanks the National Natural Science Foundation of China and the National Science Centre (OPUS programme, Grant: 015/19/B/STS/03399). NR 47 TC 0 Z9 0 U1 21 U2 21 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 7 PY 2016 VL 8 IS 48 BP 32963 EP 32970 DI 10.1021/acsami.6b11480 PG 8 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EE5DH UT WOS:000389624600039 PM 27934195 ER PT J AU Mezher, M Garris, R Mansfield, LM Blum, M Hauschild, D Horsley, K Duncan, DA Yang, W Bar, M Weinhardt, L Ramanathan, K Heske, C AF Mezher, Michelle Garris, Rebekah Mansfield, Lorelle M. Blum, Monika Hauschild, Dirk Horsley, Kimberly Duncan, Douglas A. Yang, Wanli Baer, Marcus Weinhardt, Lothar Ramanathan, Kannan Heske, Clemens TI Soft X-ray Spectroscopy of a Complex Heterojunction in High-Efficiency Thin-Film Photovoltaics: Intermixing and Zn Speciation at the Zn(O,S)/Cu(In,Ga)Se-2 Interface SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE chalcopyrite thin-film solar cell; chemical structure; alternative buffer layers; Zn(O,S); X-ray photoelectron spectroscopy; X-ray emission spectroscopy ID SOLAR-CELL HETEROJUNCTION; PHOTOIONIZATION CROSS-SECTIONS; BAND ALIGNMENT; ELECTRONIC-STRUCTURE; JUNCTION FORMATION; BURIED INTERFACES; NA; BUFFER; SURFACES AB The chemical structure of the Zn(O,S)/Cu(In,Ga)Se-2 interface in high-efficiency photovoltaic devices is investigated using X-ray photoelectron and Auger electron spectroscopy, as well as soft X-ray emission spectroscopy. We find that the Ga/(Ga+In) ratio at the absorber surface does not change with the formation of the Zn(O,S)/Cu(In,Ga)Se-2 interface. Furthermore, we find evidence for Zn in multiple bonding environments, including ZnS, ZnO, Zn(OH)(2), and ZnSe. We also observe dehydrogenation of the Zn(O,S) buffer layer after Ar+ ion treatment. Similar to high-efficiency CdS/Cu(In,Ga)Se-2 devices, intermixing occurs at the interface, with diffusion of Se into the buffer, and the formation of S In and/or S Ga bonds at or close to the interface. C1 [Mezher, Michelle; Blum, Monika; Horsley, Kimberly; Duncan, Douglas A.; Baer, Marcus; Weinhardt, Lothar; Heske, Clemens] UNLV, Dept Chem & Biochem, Las Vegas, NV 89154 USA. [Garris, Rebekah; Mansfield, Lorelle M.; Ramanathan, Kannan] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Hauschild, Dirk; Weinhardt, Lothar; Heske, Clemens] Karlsruhe Inst Technol, Inst Photon Sci & Synchrotron Radiat IPS, D-76344 Eggenstein Leopoldshafen, Germany. [Hauschild, Dirk; Weinhardt, Lothar; Heske, Clemens] Karlsruhe Inst Technol, Inst Chem Technol & Polymer Chem ITCP, D-76128 Karlsruhe, Germany. [Yang, Wanli] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Baer, Marcus] Helmholtz Zentrum Berlin Mat & Energie GmbH, Renewable Energy, D-14109 Berlin, Germany. [Baer, Marcus] Brandenburg Tech Univ Cottbus Senftenberg, Inst Phys & Chem, D-03046 Cottbus, Germany. RP Mezher, M; Heske, C (reprint author), UNLV, Dept Chem & Biochem, Las Vegas, NV 89154 USA.; Heske, C (reprint author), Karlsruhe Inst Technol, Inst Photon Sci & Synchrotron Radiat IPS, D-76344 Eggenstein Leopoldshafen, Germany.; Heske, C (reprint author), Karlsruhe Inst Technol, Inst Chem Technol & Polymer Chem ITCP, D-76128 Karlsruhe, Germany. EM mezherm@unlv.nevada.edu; heske@.unlv.nevada.edu RI Yang, Wanli/D-7183-2011 OI Yang, Wanli/0000-0003-0666-8063 FU Department of Energy (DOE) through the F-PACE Partnership (NREL) [ZEJ-2-22082-0.1]; Impuls- and Vernetzungsfonds of the Helmholtz Association [VH-NG-423]; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX We gratefully acknowledge funding from the Department of Energy (DOE) through the F-PACE Partnership (NREL subcontract No. ZEJ-2-22082-0.1). M. Bar acknowledges funding by the Impuls- and Vernetzungsfonds of the Helmholtz Association (VH-NG-423). The Advanced Light Source is supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. NR 44 TC 0 Z9 0 U1 14 U2 14 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 7 PY 2016 VL 8 IS 48 BP 33256 EP 33263 DI 10.1021/acsami.6b09245 PG 8 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EE5DH UT WOS:000389624600072 PM 27934158 ER PT J AU Yan, ZQ Chen, L Yoon, M Kumar, S AF Yan, Zhequan Chen, Liang Yoon, Mina Kumar, Satish TI The Role of Interfacial Electronic Properties on Phonon Transport in Two-Dimensional MoS2 on Metal Substrates SO ACS APPLIED MATERIALS & INTERFACES LA English DT Article DE density functional theory; atomistic Green's function; MoS2/metal interface; electron density; phonon transport; thermal boundary conductance ID HEXAGONAL BORON-NITRIDE; GREENS-FUNCTION METHOD; SINGLE-LAYER MOS2; MONOLAYER MOS2; MOLYBDENUM-DISULFIDE; VALLEY POLARIZATION; HEAT-CONDUCTION; HETEROSTRUCTURES; TRANSITION; SIMULATION AB We investigate the role of interfacial electronic properties on the phonon transport in two-dimensional MoS2 adsorbed on metal substrates (Au and Sc) using first-principles density functional theory and the atomistic Green's function method. Our study reveals that the different degree of orbital hybridization and electronic charge distribution between MoS2 and metal substrates play a significant role in determining the overall phonon-phonon coupling and phonon transmission. The charge transfer caused by the adsorption of MoS2 on Sc substrate can significantly weaken the Mo-S bond strength and change the phonon properties of MoS2, which result in a significant change in thermal boundary conductance (TBC) from one lattice-stacking configuration to another for same metallic substrate. In a lattice-stacking configuration of MoS2/Sc, weakening of the Mo-S bond strength due to charge redistribution results in decrease in the force constant between Mo and S atoms and substantial redistribution of phonon density of states to low-frequency region which affects overall phonon transmission leading to 60% decrease in TBC compared to another configuration of MoS2/Sc. Strong chemical coupling between MoS2 and the Sc substrate leads to a significantly (similar to 19 times) higher TBC than that of the weakly bound MoS2/Au system. Our findings demonstrate the inherent connection among the interfacial electronic structure, the phonon distribution, and TBC, which helps us understand the mechanism of phonon transport at the MoS2/metal interfaces. The results provide insights for the future design of MoS2-based electronics and a way of enhancing heat dissipation at the interfaces of MoS2-based nanoelectronic devices. C1 [Yan, Zhequan; Kumar, Satish] Georgia Inst Technol, GW Woodruff Sch Mech Engn, Atlanta, GA 30332 USA. [Chen, Liang] Xi An Jiao Tong Univ, Sch Energy & Power Engn, Xian, Shaanxi, Peoples R China. [Yoon, Mina] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN 37831 USA. RP Kumar, S (reprint author), Georgia Inst Technol, GW Woodruff Sch Mech Engn, Atlanta, GA 30332 USA. EM satish.kumar@me.gatech.edu FU National Science Foundation [CBET-1236416]; ORNL Laboratory Directed Research and Development; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work was partially supported by the National Science Foundation Grant CBET-1236416. Part of this research was conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility and supported by the ORNL Laboratory Directed Research and Development funding. This research used the resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract DE-AC02-05CH11231. NR 41 TC 0 Z9 0 U1 21 U2 21 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 1944-8244 J9 ACS APPL MATER INTER JI ACS Appl. Mater. Interfaces PD DEC 7 PY 2016 VL 8 IS 48 BP 33299 EP 33306 DI 10.1021/acsami.6b10608 PG 8 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary SC Science & Technology - Other Topics; Materials Science GA EE5DH UT WOS:000389624600077 PM 27934181 ER PT J AU Gel, A Shahnam, M Musser, J Subramaniyan, AK Dietiker, JF AF Gel, Aytekin Shahnam, Mehrdad Musser, Jordan Subramaniyan, Arun K. Dietiker, Jean-Francois TI Nonintrusive Uncertainty Quantification of Computational Fluid Dynamics Simulations of a Bench-Scale Fluidized-Bed Gasifier SO INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH LA English DT Article ID VALIDATION; MODEL; COAL AB Uncertainty quantification (UQ) analysis is increasingly becoming one of the major requirements of simulation based engineering to assess the confidence in the results and make better-informed decisions based on the insight derived from the simulations. In an earlier study, Bayesian UQ analysis was applied to existing bench-scale fluidized-bed gasifier experiment results. In the current study, a series of simulations were carried over with the open-source computational fluid dynamics software MFiX to reproduce the experimental conditions, where three operating factors, i.e., coal flow rate, coal particle diameter, and steam-to-oxygen ratio, were systematically varied to understand their effect on the syngas composition. Bayesian UQ analysis was this time performed on the numerical results for comparison purposes. This is part of ongoing research efforts to explore the applicability of advanced UQ methods and processes such as Bayesian methods for large-scale complex multiphase flow simulations. As part of Bayesian UQanalysis, a global sensitivity analysis was performed based on the simulation results, which shows that the predicted syngas composition is strongly affected not only by the steam-to-oxygen ratio (which was observed in experiments as well) but also by variation in the coal flow rate and particle diameter (which was not observed in experiments). The carbon monoxide mole fraction is underpredicted at lower steam-to-oxygen ratios and overpredicted at higher steam-to-oxygen ratios. The opposite trend is observed for the carbon dioxide mole fraction. These discrepancies are attributed to either excessive segregation of the phases that leads to the fuel-rich or-lean regions or alternatively the selection of reaction models, where different reaction models and kinetics can lead to different syngas compositions throughout the gasifier. C1 [Gel, Aytekin; Shahnam, Mehrdad; Musser, Jordan; Dietiker, Jean-Francois] Natl Energy Technol Lab, Morgantown, WV 26505 USA. [Gel, Aytekin] ALPEMI Consulting LLC, Phoenix, AZ 85044 USA. [Subramaniyan, Arun K.] GE Global Res Ctr, Niskayuna, NY 12309 USA. [Dietiker, Jean-Francois] West Virginia Univ, Corp Res, Morgantown, WV 26505 USA. RP Gel, A (reprint author), Natl Energy Technol Lab, Morgantown, WV 26505 USA.; Gel, A (reprint author), ALPEMI Consulting LLC, Phoenix, AZ 85044 USA. EM aike@alpemi.com FU NETL under the RES Contract [DE-FE0004000]; NETL [AGMT-0407]; GE Global Research Center [AGMT-0407]; Office of Science of the U.S. DOE [DE-AC02-05CH11231] FX This technical effort was performed in support of NETL ongoing research under the RES Contract DE-FE0004000. The work presented is a joint effort between NETL and GE Global Research Center performed under a cooperative research and development agreement (No. AGMT-0407). The authors thank and acknowledge that this research used resources allocated through the 2014 ASCR Leadership Computing Challenge (ALCC) program at the NERSC, a U.S. DOE Office of Science User Facility supported by the Office of Science of the U.S. DOE under Contract DE-AC02-05CH11231. NR 23 TC 0 Z9 0 U1 1 U2 1 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0888-5885 J9 IND ENG CHEM RES JI Ind. Eng. Chem. Res. PD DEC 7 PY 2016 VL 55 IS 48 BP 12477 EP 12490 DI 10.1021/acs.iecr.6b02506 PG 14 WC Engineering, Chemical SC Engineering GA EE5CY UT WOS:000389623500019 ER PT J AU Waller, PJ Lyle, SJ Popp, TMO Diercks, CS Reimer, JA Yaghi, OM AF Waller, Peter J. Lyle, Steven J. Popp, Thomas M. Osborn Diercks, Christian S. Reimer, Jeffrey A. Yaghi, Omar M. TI Chemical Conversion of Linkages in Covalent Organic Frameworks SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID CRYSTALLINE; CONSTRUCTION AB The imine linkages of two layered, porous covalent organic frameworks (COFs), TPB-TP-COF ([C6H3(C6H4N)(3)](2)[C6H4( CH)(2)](3), 1) and 4PE-1P-COF ([C-2(C6H4N)(4)][C6H4(CH)(2)](2), 2), have been transformed into amide linkages to make the respective isostructural amide COFs 1' and 2' by direct oxidation with retention of crystallinity and permanent porosity. Remarkably, the oxidation of both imine COFs is complete, as assessed by FT-IR and C-13 CP-MAS NMR spectroscopy and demonstrates (a) the first chemical conversion of a COF linkage and (b) how the usual "crystallization problem" encountered in COF chemistry can be bypassed to access COFs, such as these amides, that are typically thought to be difficult to obtain by the usual de novo methods. The amide COFs show improved chemical stability relative to their imine progenitors. C1 [Waller, Peter J.; Lyle, Steven J.; Popp, Thomas M. Osborn; Diercks, Christian S.; Yaghi, Omar M.] Univ Calif Berkeley, Dept Chem, Kavli Energy NanoSci Inst Berkeley, Mat Sci Div,Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA. [Waller, Peter J.; Lyle, Steven J.; Popp, Thomas M. Osborn; Diercks, Christian S.; Yaghi, Omar M.] Berkeley Global Sci Inst, Berkeley, CA 94720 USA. [Popp, Thomas M. Osborn; Reimer, Jeffrey A.] Univ Calif Berkeley, Dept Chem & Biomol Engn, Berkeley, CA 94720 USA. [Popp, Thomas M. Osborn; Reimer, Jeffrey A.] Lawrence Berkeley Natl Lab, Environm Energy Technol Div, Berkeley, CA 94720 USA. [Yaghi, Omar M.] King Fand Univ Petr & Minerals, Dhahran 34464, Saudi Arabia. RP Yaghi, OM (reprint author), Univ Calif Berkeley, Dept Chem, Kavli Energy NanoSci Inst Berkeley, Mat Sci Div,Lawrence Berkeley Natl Lab, Berkeley, CA 94720 USA.; Yaghi, OM (reprint author), Berkeley Global Sci Inst, Berkeley, CA 94720 USA.; Yaghi, OM (reprint author), King Fand Univ Petr & Minerals, Dhahran 34464, Saudi Arabia. EM yaghi@berkeley.edu OI Yaghi, Omar/0000-0002-5611-3325; Waller, Peter/0000-0002-4013-8827 FU Army Research Office through a Multidisciplinary University Research Initiatives (MURI) [WG11NF-15-1-0047]; Center for Gas Separations Relevant to Clean Energy Technologies, an Energy Frontier Research Center - U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-SC0001015]; NSF; Berkeley Center for Green Chemistry [1144885]; ARAMCO, Saudi Arabia FX The synthesis of 1 and 2 was partially supported by BASF (Ludwigshafen, Germany). The oxidation and structure characterization was supported by the Army Research Office through a Multidisciplinary University Research Initiatives (MURI) Award under Grant WG11NF-15-1-0047. NMR experiments were supported through the Center for Gas Separations Relevant to Clean Energy Technologies, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences under Award DE-SC0001015. T.M.O.P. acknowledges funding from the NSF Graduate Fellowship Research Program. P.J.W. thanks the NSF and the Berkeley Center for Green Chemistry for support via the Systems Approach to Green Energy Integrative Graduate Education and Research Traineeship (1144885). O.M.Y. acknowledges collaborations with and support of ARAMCO, Saudi Arabia. We thank Rebecca L. Siegelman for assistance with sorption measurements and Kyle E. Cordova for help with manuscript preparation. NR 15 TC 1 Z9 1 U1 104 U2 104 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 7 PY 2016 VL 138 IS 48 BP 15519 EP 15522 DI 10.1021/jacs.6b08377 PG 4 WC Chemistry, Multidisciplinary SC Chemistry GA EE5DA UT WOS:000389623800004 PM 27934009 ER PT J AU Liu, F Zhou, ZC Zhang, C Vergote, T Fan, HJ Liu, F Zhu, XZ AF Liu, Feng Zhou, Zichun Zhang, Cheng Vergote, Thomas Fan, Haijun Liu, Feng Zhu, Xiaozhang TI A Thieno[3,4-b]thiophene-Based Non-fullerene Electron Acceptor for High-Performance Bulk-Heterojunction Organic Solar Cells SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID POWER CONVERSION EFFICIENCY; LOW-BANDGAP; POLYMER; 10-PERCENT; NETWORK; GAP AB A thieno[3,4-b]thiophene-based electron acceptor, ATT-1, is designed and synthesized. ATT-1 exhibits a planar conjugated framework, broad absorption with a large absorption coefficient, and a slightly high LUMO energy level. Bulk-heterojunction (BHJ) solar cells based on PTB7-Th electron donor and ATT-1 electron acceptor delivered power conversion efficiencies of up to 10.07%, which is among the best performances reported for non-fullerene BHJ solar cells using PTB7-Th as the electron donor. C1 [Liu, Feng; Zhou, Zichun; Zhang, Cheng; Vergote, Thomas; Fan, Haijun; Zhu, Xiaozhang] Chinese Acad Sci, Beijing Natl Lab Mol Sci, Inst Chem, CAS Key Lab Organ Solids, Beijing 100190, Peoples R China. [Liu, Feng] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China. [Liu, Feng; Zhou, Zichun; Zhang, Cheng; Zhu, Xiaozhang] Univ Chinese Acad Sci, Beijing 100049, Peoples R China. [Liu, Feng] Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. RP Liu, F; Zhu, XZ (reprint author), Chinese Acad Sci, Beijing Natl Lab Mol Sci, Inst Chem, CAS Key Lab Organ Solids, Beijing 100190, Peoples R China.; Liu, F (reprint author), Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai 200240, Peoples R China.; Liu, F; Zhu, XZ (reprint author), Univ Chinese Acad Sci, Beijing 100049, Peoples R China.; Liu, F (reprint author), Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. EM fengliu82@sjtu.edu.cn; xzzhu@iccas.ac.cn RI Liu, Feng/J-4361-2014 OI Liu, Feng/0000-0002-5572-8512 FU National Basic Research Program of China (973 Program) [2014CB643502]; Chinese Academy of Sciences [XDB12010200]; 1000 plan national recruiting program FX We thank the National Basic Research Program of China (973 Program) (No. 2014CB643502) for financial support, the Strategic Priority Research Program of the Chinese Academy of Sciences (XDB12010200), and the National Natural Science Foundation of China (91333113, 21572234). F.L. was supported by 1000 plan national recruiting program. Portions of this research were carried out at beamlines 7.3.3 and 11.0.1.2 at the Advanced Light Source, Molecular Foundry, and National Center for Electron Microscopy, Lawrence Berkeley National Laboratory, which was supported by the U.S. DOE, Office of Science, and Office of Basic Energy Sciences. NR 46 TC 0 Z9 0 U1 58 U2 58 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 7 PY 2016 VL 138 IS 48 BP 15523 EP 15526 DI 10.1021/jacs.6b08523 PG 4 WC Chemistry, Multidisciplinary SC Chemistry GA EE5DA UT WOS:000389623800005 PM 27934020 ER PT J AU Moonshiram, D Pineda-Galvan, Y Erdman, D Palenik, M Zong, RF Thummel, R Pushkar, Y AF Moonshiram, Dooshaye Pineda-Galvan, Yuliana Erdman, Darren Palenik, Mark Zong, Ruifa Thummel, Randolph Pushkar, Yulia TI Uncovering the Role of Oxygen Atom Transfer in Ru-Based Catalytic Water Oxidation SO JOURNAL OF THE AMERICAN CHEMICAL SOCIETY LA English DT Article ID RUTHENIUM(II) MONOAQUO COMPLEXES; ARTIFICIAL PHOTOSYNTHESIS; SINGLE-SITE; ELECTRONIC-STRUCTURE; RU(II) COMPLEXES; PROTON TRANSFER; REAL CATALYSTS; MONONUCLEAR; LIGAND; DIMER AB The realization of artificial photosynthesis carries the promise of cheap and abundant energy, however, significant advances in the rational design of water oxidation catalysts are required. Detailed information on the structure of the catalyst under reaction conditions and mechanisms of O-O bond formation should be obtained. Here, we used a combination of electron paramagnetic resonance (EPR), stopped flow freeze quench on a millisecond second time scale, X-ray absorption (XAS), resonance Raman (RR) spectroscopy, and density functional theory (DFT) to follow the dynamics of the Ru-based single site catalyst, [Ru-II(NPM)(4-pic)(2)(H2O)](2+) (NPM = 4-t-butyl-2,6-di(1',8'-naphthyrid-2'-yl)-pyridine, pic = 4-picoline), under the water oxidation conditions. We report a unique EPR signal with g-tensor, g(x) = 2.30, g(y) = 2.18, and g(z) = 1.83 which allowed us to observe fast dynamics of oxygen atom transfer from the Ru-IV=O oxo species to the uncoordinated nitrogen of the NPM ligand. In few seconds, the NPM ligand modification results in [Ru-III(NPM-NO)(4-pic)(2)(H2O)](3+) and [Ru-III(NPM-NO,NO)(4-pic)(2)](3+) complexes. A proposed [Ru-V(NPM)(4-pic)(2)=O](3+) intermediate was not detected under the tested conditions. We demonstrate that while the proximal base might be beneficial in O-O bond formation via nucleophilic water attack on an oxo species as shown by DFT, the noncoordinating nitrogen is impractical as a base in water oxidation catalysts due to its facile conversion to the N-O group. This study opens new horizons for understanding the real structure of Ru catalysts under water oxidation conditions and points toward the need to further investigate the role of the N-O ligand in promoting water oxidation catalysis. C1 [Moonshiram, Dooshaye; Pineda-Galvan, Yuliana; Erdman, Darren; Pushkar, Yulia] Purdue Univ, Dept Phys & Astron, 525 Northwestern Ave, W Lafayette, IN 47907 USA. [Moonshiram, Dooshaye] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Lemont, IL 60439 USA. [Palenik, Mark] Naval Res Lab, Div Chem, Code 6189,4555 Overlook Ave SW, Washington, DC 20375 USA. [Zong, Ruifa; Thummel, Randolph] Univ Houston, Dept Chem, Univ Pk, Houston, TX 77204 USA. RP Pushkar, Y (reprint author), Purdue Univ, Dept Phys & Astron, 525 Northwestern Ave, W Lafayette, IN 47907 USA. EM ypushkar@purdue.edu OI Palenik, Mark/0000-0002-6932-8624; Moonshiram, Dooshaye/0000-0002-9075-3035 FU U.S. Department of Energy, Office of Sciences, Office of Basic Energy Sciences [DE-FG02-10ER16184, DE-FG02-07ER15888, DE-AC02-06CH11357]; Robert Welch Foundation [E-621]; U.S. DOE [DE-AC02-06CH11357]; US Department of Energy - Basic Energy Science; Canadian Light Source; Advanced Photon Source FX This material is based upon work supported by the U.S. Department of Energy, Office of Sciences, Office of Basic Energy Sciences under Grant Numbers DE-FG02-10ER16184 (Y.P.), DE-FG02-07ER15888 (R.T. and R.Z.), and DE-AC02-06CH11357 (D.M.). R.T. and R.Z. also thank The Robert Welch Foundation (Grant E-621) for financial support. Use of the Advanced Photon Source, an Office of Science User Facility operated by the U.S. Department of Energy (DOE) Office of Science by Argonne National Laboratory, was supported by the U.S. DOE under Contract DE-AC02-06CH11357. PNC/XSD (Sector 20) facilities at the Advanced Photon Source, and research at these facilities, are supported by the US Department of Energy - Basic Energy Science, the Canadian Light Source and its funding partners, and the Advanced Photon Source. We thank Dr. Steve Heald and Dr. Dale Brewe for help with experiments at Beamline BM-20, APS. Dr. Polyansky is acknowledged for helpful discussions and supply of bulk electrolysis sample for EPR analysis. Access to EPR was provided by the Amy Instrumentation Facility, Department of Chemistry under the supervision of Dr. Michael Everly. We thank Dr. William Cramer and Dr. Stanislav Zakharov from structural biology at Purdue University for providing access to the SX20 Stopped-Flow UV-vis spectrometer (Applied Photophysics Ltd) and Dr. Yong Chen from the Department of Physics at Purdue University for allowing us to use the Xplora HORIBA Raman Microscope. M.P. is a NRC research associate. NR 68 TC 0 Z9 0 U1 39 U2 39 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0002-7863 J9 J AM CHEM SOC JI J. Am. Chem. Soc. PD DEC 7 PY 2016 VL 138 IS 48 BP 15605 EP 15616 DI 10.1021/jacs.6b08409 PG 12 WC Chemistry, Multidisciplinary SC Chemistry GA EE5DA UT WOS:000389623800020 PM 27802032 ER PT J AU Zhai, QG Bu, XH Mao, CY Zhao, X Daemen, L Cheng, YQ Ramirez-Cuesta, AJ Feng, PY AF Zhai, Quan-Guo Bu, Xianhui Mao, Chengyu Zhao, Xiang Daemen, Luke Cheng, Yongqiang Ramirez-Cuesta, Anibal J. Feng, Pingyun TI An ultra-tunable platform for molecular engineering of high-performance crystalline porous materials SO NATURE COMMUNICATIONS LA English DT Article ID METAL-ORGANIC FRAMEWORK; CARBON-DIOXIDE CAPTURE; PORE-SPACE PARTITION; AMBIENT CONDITIONS; BUILDING-BLOCKS; CO2; SEPARATION; DESIGN; LIGAND; CH4 AB Metal-organic frameworks are a class of crystalline porous materials with potential applications in catalysis, gas separation and storage, and so on. Of great importance is the development of innovative synthetic strategies to optimize porosity, composition and functionality to target specific applications. Here we show a platform for the development of metal-organic materials and control of their gas sorption properties. This platform can accommodate a large variety of organic ligands and homo-or hetero-metallic clusters, which allows for extraordinary tunability in gas sorption properties. Even without any strong binding sites, most members of this platform exhibit high gas uptake capacity. The high capacity is accomplished with an isosteric heat of adsorption as low as 20 kJ mol(-1) for carbon dioxide, which could bring a distinct economic advantage because of the significantly reduced energy consumption for activation and regeneration of adsorbents. C1 [Zhai, Quan-Guo; Mao, Chengyu; Zhao, Xiang; Feng, Pingyun] Univ Calif Riverside, Dept Chem, Riverside, CA 92521 USA. [Bu, Xianhui] Calif State Univ Long Beach, Dept Chem & Biochem, 1250 Bellflower Blvd, Long Beach, CA 90840 USA. [Daemen, Luke; Cheng, Yongqiang; Ramirez-Cuesta, Anibal J.] Oak Ridge Natl Lab, Spallat Neutron Source, MS-6473, Oak Ridge, TN 37831 USA. RP Feng, PY (reprint author), Univ Calif Riverside, Dept Chem, Riverside, CA 92521 USA.; Bu, XH (reprint author), Calif State Univ Long Beach, Dept Chem & Biochem, 1250 Bellflower Blvd, Long Beach, CA 90840 USA. EM xianhui.bu@csulb.edu; pingyun.feng@ucr.edu RI mao, chengyu/I-3172-2014; Ramirez-Cuesta, Timmy/A-4296-2010 OI mao, chengyu/0000-0002-2282-4313; Ramirez-Cuesta, Timmy/0000-0003-1231-0068 FU US Department of Energy, Office of Basic Energy Sciences, Materials Sciences and Engineering Division [DE-SC0010596]; VirtuES project at Oak Ridge National Laboratory [LDRD 7739] FX The work is supported by the US Department of Energy, Office of Basic Energy Sciences, Materials Sciences and Engineering Division under Award No. DE-SC0010596. Neutron scattering study benefitted from VISION (IPTS-15191) and VirtuES project (LDRD 7739) at Oak Ridge National Laboratory. NR 46 TC 3 Z9 3 U1 51 U2 51 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. 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CA CMS Collaboration TI Search for long-lived charged particles in proton-proton collisions at root s=13 TeV SO PHYSICAL REVIEW D LA English DT Article ID SPLIT SUPERSYMMETRY; E(+)E(-) ANNIHILATION; HEAVY; COLLIDERS; MATTER; LHC AB Results are presented of a search for heavy stable charged particles produced in proton-proton collisions at root s = 13 TeV using a data sample corresponding to an integrated luminosity of 2.5 fb(-1) collected in 2015 with the CMS detector at the CERN LHC. The search is conducted using signatures of anomalously high energy deposits in the silicon tracker and long time-of-flight measurements by the muon system. The data are consistent with the expected background, and upper limits are set on the cross sections for production of long-lived gluinos, top squarks, tau sleptons, and leptonlike long-lived fermions. 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R.; Dreyer, T.; Garutti, E.; Gonzalez, D.; Haller, J.; Hoffmann, M.; Junkes, A.; Klanner, R.; Kogler, R.; Kovalchuk, N.; Lapsien, T.; Lenz, T.; Marchesini, I.; Marconi, D.; Meyer, M.; Niedziela, M.; Nowatschin, D.; Pantaleo, F.; Peiffer, T.; Perieanu, A.; Poehlsen, J.; Sander, C.; Scharf, C.; Schleper, P.; Schmidt, A.; Schumann, S.; Schwandt, J.; Stadie, H.; Steinbrueck, G.; Stober, F. M.; Stoever, M.; Tholen, H.; Troendle, D.; Usai, E.; Vanelderen, L.; Vanhoefer, A.; Vormwald, B.] Univ Hamburg, Hamburg, Germany. [Barth, C.; Baus, C.; Berger, J.; Butz, E.; Chwalek, T.; Colombo, F.; De Boer, W.; Dierlamm, A.; Fink, S.; Friese, R.; Giffels, M.; Gilbert, A.; Goldenzweig, P.; Haitz, D.; Hartmann, F.; Heindl, S. M.; Husemann, U.; Katkov, I.; Pardo, P. Lobelle; Maier, B.; Mildner, H.; Mozer, M. U.; Mueller, Th.; Plagge, M.; Quast, G.; Rabbertz, K.; Roecker, S.; Roscher, F.; Schroeder, M.; Shvetsov, I.; Sieber, G.; Simonis, H. J.; Ulrich, R.; Wagner-Kuhr, J.; Wayand, S.; Weber, M.; Weiler, T.; Williamson, S.; Woehrmann, C.; Wolf, R.] Inst Expt Kernphys, Karlsruhe, Germany. [Anagnostou, G.; Daskalakis, G.; Geralis, T.; Giakoumopoulou, V. A.; Kyriakis, A.; Loukas, D.; Topsis-Giotis, I.] NCSR Demokritos, Inst Nucl & Particle Phys, Aghia Paraskevi, Greece. [Campbell, A.; Kesisoglou, S.; Panagiotou, A.; Saoulidou, N.; Tziaferi, E.] Univ Athens, Athens, Greece. [Evangelou, I.; Flouris, G.; Foudas, C.; Kokkas, P.; Loukas, N.; Manthos, N.; Papadopoulos, I.; Paradas, E.] Univ Ioannina, Ioannina, Greece. [Filipovic, N.] Eotvos Lorand Univ, MTA ELTE Lendlet CMS Particle & Nucl Phys Grp, Budapest, Hungary. [Bencze, G.; Hajdu, C.; Hidas, P.; Horvath, D.; Sikler, F.; Veszpremi, V.; Vesztergombi, G.; Zsigmond, A. J.] Wigner Res Ctr Phys, Budapest, Hungary. [Beni, N.; Czellar, S.; Karancsi, J.; Makovec, A.; Molnar, J.; Szillasi, Z.] Inst Nucl Res ATOMKI, Debrecen, Hungary. [Bartok, M.; Raics, P.; Trocsanyi, Z. L.; Ujvari, B.] Univ Debrecen, Debrecen, Hungary. [Bahinipati, S.; Choudhury, S.; Mal, P.; Mandal, K.; Nayak, A.; Sahoo, D. K.; Sahoo, N.; Swain, S. K.] Natl Inst Sci Educ & Res, Bhubaneswar, Orissa, India. [Bansal, S.; Beri, S. B.; Bhatnagar, V.; Chawla, R.; Bhawandeep, U.; Kalsi, A. K.; Kaur, A.; Kaur, M.; Kumar, R.; Mehta, A.; Mittal, M.; Singh, J. B.; Walia, G.] Panjab Univ, Chandigarh, India. [Kumar, Ashok; Bhardwaj, A.; Choudhary, B. C.; Garg, R. B.; Keshri, S.; Malhotra, S.; Naimuddin, M.; Nishu, N.; Ranjan, K.; Sharma, R.; Sharma, V.] Univ Delhi, Delhi, India. [Bhattacharya, R.; Bhattacharya, S.; Chatterjee, K.; Dey, S.; Dutt, S.; Dutta, S.; Ghosh, S.; Majumdar, N.; Modak, A.; Mondal, K.; Mukhopadhyay, S.; Nandan, S.; Purohit, A.; Roy, A.; Roy, D.; Chowdhury, S. Roy; Sarkar, S.; Sharan, M.; Thakur, S.] Saha Inst Nucl Phys, Kolkata, India. [Behera, P. K.] Indian Inst Technol, Madras, Tamil Nadu, India. [Chudasama, R.; Dutta, D.; Jha, V.; Kumar, V.; Mohanty, A. K.; Netrakanti, P. K.; Pant, L. M.; Shukla, P.; Topkar, A.] Bhabha Atom Res Ctr, Mumbai, Maharashtra, India. [Aziz, T.; Dugad, S.; Kole, G.; Mahakud, B.; Mitra, S.; Mohanty, G. B.; Parida, B.; Sur, N.; Sutar, B.] Tata Inst Fundamental Res A, Mumbai, Maharashtra, India. [Banerjee, S.; Bhowmik, S.; Dewanjee, R. K.; Ganguly, S.; Guchait, M.; Jain, Sa.; Kumar, S.; Maity, M.; Majumder, G.; Mazumdar, K.; Sarkar, T.; Wickramage, N.] Tata Inst Fundamental Res B, Mumbai, Maharashtra, India. [Chauhan, S.; Dube, S.; Hegde, V.; Kapoor, A.; Kothekar, K.; Rane, A.; Sharma, S.] Indian Inst Sci Educ & Res, Pune, Maharashtra, India. [Behnamian, H.; Chenarani, S.; Tadavani, E. Eskandari; Etesami, S. M.; Fahim, A.; Khakzad, M.; Najafabadi, M. Mohammadi; Naseri, M.; Mehdiabadi, S. Paktinat; Hosseinabadi, F. Rezaei; Safarzadeh, B.; Zeinali, M.] Inst Res Fundamental Sci, Tehran, Iran. [Felcini, M.; Grunewald, M.] Univ Coll Dublin, Dublin, Ireland. [Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iaselli, G.; Maggi, G.; Maggi, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Silvestris, L.; Venditti, R.; Verwilligen, P.] Ist Nazl Fis Nucl, Sez Bari, Bari, Italy. [Abbrescia, M.; Calabria, C.; Caputo, C.; Cristella, L.; De Palma, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Radogna, R.; Selvaggi, G.; Venditti, R.] Univ Bari, Bari, Italy. [Creanza, D.; De Filippis, N.; Iaselli, G.; Maggi, G.; Pugliese, G.] Politecn Bari, Bari, Italy. [Abbiendi, G.; Battilana, C.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.; Albergo, S.] Ist Nazl Fis Nucl, Sez Bologna, Bologna, Italy. [Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Fanfani, A.; Fasanella, D.; Guiducci, L.; Navarria, F. L.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Univ Bologna, Bologna, Italy. [Chiorboli, M.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Ist Nazl Fis Nucl, Sez Catania, Catania, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Giordano, F.; Potenza, R.; Tricomi, A.] Univ Catania, Catania, Italy. [Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Meschini, M.; Paoletti, S.; Sguazzoni, G.; Viliani, L.] Ist Nazl Fis Nucl, Sez Firenze, Florence, Italy. [Ciulli, V.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Viliani, L.] Univ Florence, Florence, Italy. [Benussi, L.; Bianco, S.; Fabbri, F.; Piccolo, D.; Primavera, F.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Calvelli, V.; Ferro, F.; Vetere, M. Lo; Monge, M. R.; Robutti, E.; Tosi, S.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Calvelli, V.; Vetere, M. Lo; Monge, M. R.; Tosi, S.] Univ Genoa, Genoa, Italy. [Brianza, L.; Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Ghezzi, A.; Govoni, P.; Malberti, M.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Pigazzini, S.; Ragazzi, S.; de Fatis, T. Tabarelli] Ist Nazl Fis Nucl, Sez Milano Bicocca, Milan, Italy. [Dinardo, M. E.; Fiorendi, S.; Ghezzi, A.; Govoni, P.; Manzoni, R. A.; Marzocchi, B.; Paganoni, M.; Ragazzi, S.; de Fatis, T. Tabarelli] Univ Milano Bicocca, Milan, Italy. [Buontempo, S.; Cavallo, N.; De Nardo, G.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Paolucci, P.; Sciacca, C.; Thyssen, F.] Ist Nazl Fis Nucl, Sez Napoli, Rome, Italy. [Esposito, M.; Iorio, A. O. M.; Sciacca, C.] Univ Naples Federico II, Rome, Italy. [Cavallo, N.; Fabozzi, F.] Univ Basilicata, Rome, Italy. [Di Guida, S.; Meola, S.] Univ G Marconi, Rome, Italy. [Azzi, P.; Bacchetta, N.; Benato, L.; Biasotto, M.; Boletti, A.; De Oliveira, A. Carvalho Antunes; Checchia, P.; Dall'Osso, M.; Manzano, P. De Castro; Dorigo, T.; Fanzago, F.; Gasparini, F.; Gasparini, U.; Gozzelino, A.; Lacaprara, S.; Margoni, M.; Maron, G.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Torassa, E.; Zanetti, M.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Ist Nazl Fis Nucl, Sez Padova, Trento, Italy. [Benato, L.; Boletti, A.; De Oliveira, A. Carvalho Antunes; Dall'Osso, M.; Gasparini, F.; Gasparini, U.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Univ Padua, Trento, Italy. Univ Trento, Trento, Italy. [Braghieri, A.; Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Univ Pavia, Pavia, Italy. [Solestizi, L. Alunni; Bilei, G. M.; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Menichelli, M.; Saha, A.; Santocchia, A.] Ist Nazl Fis Nucl, Sez Perugia, Perugia, Italy. [Abdulsalam, A.; Solestizi, L. Alunni; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Santocchia, A.] Univ Perugia, Perugia, Italy. [Abdulsalam, A.; Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Donato, S.; Fedi, G.; Giassi, A.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Tonelli, G.] Univ Pisa, Pisa, Italy. [Donato, S.; Ligabue, F.] Scuola Normale Super Pisa, Pisa, Italy. [Barone, L.; Cipriani, M.; D'imperio, G.; Del Re, D.; Diemoz, M.; Gelli, S.; Longo, E.; Margaroli, F.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Barone, L.; Cipriani, M.; D'imperio, G.; Del Re, D.; Gelli, S.; Margaroli, F.; Organtini, G.; Preiato, F.; Rahatlou, S.; Santanastasio, F.] Univ Roma, Rome, Italy. [Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bartosik, N.; Bellan, R.; Biino, C.; Cartiglia, N.; Costa, M.; Cotto, G.; Covarelli, R.; Dattola, D.; Degano, A.; Demaria, N.; Finco, L.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Sola, V.; Solano, A.; Staiano, A.; Traczyk, P.] Ist Nazl Fis Nucl, Sez Torino, Novara, Italy. [Amapane, N.; Argiro, S.; Bellan, R.; Costa, M.; Cotto, G.; Covarelli, R.; Degano, A.; Finco, L.; Kiani, B.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Sacchi, R.; Solano, A.; Traczyk, P.] Univ Turin, Novara, Italy. [Arcidiacono, R.; Arneodo, M.; Ruspa, M.] Univ Piemonte Orientale, Novara, Italy. [Belforte, S.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; La Licata, C.; Schizzi, A.; Zanetti, A.] Ist Nazl Fis Nucl, Sez Trieste, Trieste, Italy. [Della Ricca, G.; La Licata, C.; Schizzi, A.] Univ Trieste, Trieste, Italy. [Kim, D. H.; Kim, G. N.; Kim, M. S.; Lee, S.; Lee, S. W.; Oh, Y. D.; Sekmen, S.; Son, D. C.; Yang, Y. C.] Kyungpook Natl Univ, Daegu, South Korea. [Lee, A.] Chonbuk Natl Univ, Jeonju, South Korea. [Kim, H.] Chonnam Natl Univ, Inst Univ & Elementary Particles, Kwangju, South Korea. [Cifuentes, J. A. Brochero; Kim, T. J.] Hanyang Univ, Seoul, South Korea. [Cho, S.; Choi, S.; Go, Y.; Gyun, D.; Ha, S.; Hong, B.; Jo, Y.; Kim, Y.; Lee, B.; Lee, K.; Lee, K. S.; Lee, S.; Lim, J.; Park, S. K.; Roh, Y.] Korea Univ, Seoul, South Korea. [Almond, J.; Kim, J.; Lee, H.; Oh, S. B.; Radburn-Smith, B. C.; Seo, S. H.; Yoo, H. D.; Yu, G. B.] Seoul Natl Univ, Seoul, South Korea. [Choi, M.; Kim, H.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.] Univ Seoul, Seoul, South Korea. [Choi, Y.; Goh, J.; Hwang, C.; Lee, J.; Yu, I.] Sungkyunkwan Univ, Suwon, South Korea. [Dudenas, V.; Juodagalvis, A.; Vaitkus, J.] Vilnius Univ, Vilnius, Lithuania. [Ahmed, I.; Ibrahim, Z. A.; Komaragiri, J. R.; Ali, M. A. B. Md; Idris, F. Mohamad; Abdullah, W. A. T. Wan; Yusli, M. N.; Zolkapli, Z.] Univ Malaya, Natl Ctr Particle Phys, Kuala Lumpur, Malaysia. [Castilla-Valdez, H.; De la Cruz-Burelo, E.; Heredia-De la Cruz, I.; Hernandez-Almada, A.; Lopez-Fernandez, R.; Magana Villalba, R.; Mejia Guisao, J.; Sanchez-Hernandez, A.] Ctr Invest & Estudios Avanzados IPN, Mexico City, DF, Mexico. [Carrillo Moreno, S.; Oropeza Barrera, C.; Vazquez Valencia, F.] Univ Iberoamer, Mexico City, DF, Mexico. [Carpinteyro, S.; Pedraza, I.; Salazar Ibarguen, H. A.; Uribe Estrada, C.] Benemerita Univ Autonoma Puebla, Puebla, Mexico. [Morelos Pineda, A.] Univ Autonoma San Luis Potosi, San Luis Potosi, Mexico. [Krofcheck, D.] Univ Auckland, Auckland, New Zealand. [Butler, P. H.] Univ Canterbury, Christchurch, New Zealand. [Ahmad, A.; Ahmad, M.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Shah, M. A.; Shoaib, M.; Waqas, M.] Quaid I Azam Univ, Natl Ctr Phys, Islamabad, Pakistan. [Bialkowska, H.; Bluj, M.; Boimska, B.; Frueboes, T.; Gorski, M.; Kazana, M.; Nawrocki, K.; Romanowska-Rybinska, K.; Szleper, M.; Zalewski, P.] Natl Ctr Nucl Res, Otwock, Poland. [Bunkowski, K.; Byszuk, A.; Doroba, K.; Kalinowski, A.; Konecki, M.; Krolikowski, J.; Misiura, M.; Olszewski, M.; Walczak, M.] Univ Warsaw, Fac Phys, Inst Expt Phys, Warsaw, Poland. [Bargassa, P.; Da Cruz E Silva, C. Beirao; Di Francesco, A.; Faccioli, P.; Parracho, P. G. Ferreira; Gallinaro, M.; Hollar, J.; Leonardo, N.; Iglesias, L. Lloret; Nemallapudi, M. V.; Antunes, J. Rodrigues; Seixas, J.; Toldaiev, O.; Vadruccio, D.; Varela, J.; Vischia, P.] Lab Instrumentacao & Fisica Expt Particulas, Lisbon, Portugal. [Alexakhin, V.; Golutvin, I.; Gorbunov, I.; Karjavin, V.; Korenkov, V.; Lanev, A.; Malakhov, A.; Matveev, V.; Mitsyn, V. V.; Moisenz, P.; Palichik, V.; Perelygin, V.; Savina, M.; Shmatov, S.; Shulha, S.; Skatchkov, N.; Smirnov, V.; Tikhonenko, E.; Zarubin, A.] Joint Inst Nucl Res, Dubna, Russia. [Chtchipounov, L.; Golovtsov, V.; Ivanov, Y.; Kim, V.; Kuznetsova, E.; Murzin, V.; Oreshkin, V.; Sulimov, V.; Vorobyev, A.] Petersburg Nucl Phys Inst, St Petersburg, Russia. [Andreev, Yu.; Dermenev, A.; Gninenko, S.; Golubev, N.; Karneyeu, A.; Kirsanov, M.; Krasnikov, N.; Pashenkov, A.; Tlisov, D.; Toropin, A.] Inst Nucl Res, Moscow, Russia. [Epshteyn, V.; Gavrilov, V.; Lychkovskaya, N.; Popov, V.; Pozdnyakov, I.; Safronov, G.; Spiridonov, A.; Toms, M.; Vlasov, E.; Zhokin, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Bylinkin, A.] Moscow Inst Phys & Technol, Moscow, Russia. [Chistov, R.; Danilov, M.; Rusinov, V.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Andreev, V.; Azarkin, M.; Dremin, I.; Kirakosyan, M.; Leonidov, A.; Rusakov, S. V.; Terkulov, A.] PN Lebedev Phys Inst, Moscow, Russia. [Baskakov, A.; Belyaev, A.; Boos, E.; Dubinin, M.; Dudko, L.; Ershov, A.; Gribushin, A.; Klyukhin, V.; Kodolova, O.; Lokhtin, I.; Miagkov, I.; Obraztsov, S.; Petrushanko, S.; Savrin, V.; Snigirev, A.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Blinov, V.; Skovpen, Y.] Novosibirsk State Univ, Novosibirsk, Russia. [Azhgirey, I.; Bayshev, I.; Bitioukov, S.; Elumakhov, D.; Kachanov, V.; Kalinin, A.; Konstantinov, D.; Krychkine, V.; Petrov, V.; Ryutin, R.; Sobol, A.; Troshin, S.; Tyurin, N.; Uzunian, A.; Volkov, A.] Inst High Energy Phys, State Res Ctr Russian Federat, Protvino, Russia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Dordevic, M.; Milosevic, J.; Rekovic, V.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Dordevic, M.; Milosevic, J.; Rekovic, V.] Vinca Inst Nucl Sci, Belgrade, Serbia. [Alcaraz Maestre, J.; Barrio Luna, M.; Calvo, E.; Cerrada, M.; Chamizo Llatas, M.; Colino, N.; De la Cruz, B.; Delgado Peris, A.; Escalante Del Valle, A.; Fernandez Bedoya, C.; Fernandez Ramos, J. P.; Flix, J.; Fouz, M. C.; Garcia-Abia, P.; Gonzalez Lopez, O.; Goy Lopez, S.; Hernandez, J. M.; Josa, M. I.; Navarro De Martino, E.; Perez-Calero Yzquierdo, A.; Puerta Pelayo, J.; Quintario Olmeda, A.; Redondo, I.; Romero, L.; Soares, M. S.] Ctr Invest Energet Medioambientales & Tecnol CIEM, Madrid, Spain. [de Troconiz, J. F.; Missiroli, M.; Moran, D.] Univ Autonoma Madrid, Madrid, Spain. [Cuevas, J.; Fernandez Menendez, J.; Gonzalez Caballero, I.; Gonzalez Fernandez, J. R.; Palencia Cortezon, E.; Sanchez Cruz, S.; Suarez Andres, I.; Vizan Garcia, J. M.] Univ Oviedo, Oviedo, Spain. [Cabrillo, I. J.; Calderon, A.; Castineiras De Saa, J. R.; Curras, E.; Fernandez, M.; Garcia-Ferrero, J.; Gomez, G.; Lopez Virto, A.; Marco, J.; Martinez Rivero, C.; Matorras, F.; Piedra Gomez, J.; Rodrigo, T.; Ruiz-Jimeno, A.; Scodellaro, L.; Trevisani, N.; Vila, I.; Vilar Cortabitarte, R.] Univ Cantabria, Inst Fis Cantabria IFCA, CSIC, Santander, Spain. [Abbaneo, D.; Auffray, E.; Auzinger, G.; Bachtis, M.; Baillon, P.; Ball, A. H.; Barney, D.; Bloch, P.; Bocci, A.; Bonato, A.; Botta, C.; Camporesi, T.; Castello, R.; Cepeda, M.; Cerminara, G.; D'Alfonso, M.; d'Enterria, D.; Dabrowski, A.; Daponte, V.; David, A.; De Gruttola, M.; De Roeck, A.; Di Marco, E.; Dobson, M.; Dorney, B.; du Pree, T.; Duggan, D.; Duenser, M.; Dupont, N.; Elliott-Peisert, A.; Fartoukh, S.; Franzoni, G.; Fulcher, J.; Funk, W.; Gigi, D.; Gill, K.; Girone, M.; Glege, F.; Gulhan, D.; Gundacker, S.; Guthoff, M.; Hammer, J.; Harris, P.; Hegeman, J.; Innocente, V.; Janot, P.; Kieseler, J.; Kirschenmann, H.; Knuenz, V.; Kornmayer, A.; Kortelainen, M. J.; Kousouris, K.; Krammer, M.; Lange, C.; Lecoq, P.; Lourenco, C.; Lucchini, M. T.; Malgeri, L.; Mannelli, M.; Martelli, A.; Meijers, F.; Merlin, J. A.; Mersi, S.; Meschi, E.; Moortgat, F.; Morovic, S.; Mulders, M.; Neugebauer, H.; Orfanelli, S.; Orsini, L.; Pape, L.; Perez, E.; Peruzzi, M.; Petrilli, A.; Petrucciani, G.; Pfeiffer, A.; Pierini, M.; Racz, A.; Reis, T.; Rolandi, G.; Rovere, M.; Ruan, M.; Sakulin, H.; Sauvan, J. B.; Schaefer, C.; Schwick, C.; Seidel, M.; Sharma, A.; Silva, P.; Sphicas, P.; Steggemann, J.; Stoye, M.; Takahashi, Y.; Tosi, M.; Triossi, A.; Tsirou, A.; Veckalns, V.; Veres, G. I.; Wardle, N.; Wohri, H. K.; Zagozdzinska, A.; Zeuner, W. D.; Bertl, W.; Sen, S.] CERN, European Org Nucl Res, Geneva, Switzerland. [Deiters, K.; Erdmann, W.; Horisberger, R.; Ingram, Q.; Kaestli, H. C.; Kotlinski, D.; Langenegger, U.; Rohe, T.] Paul Scherrer Inst, Villigen, Switzerland. [Bachmair, F.; Baeni, L.; Bianchini, L.; Casal, B.; Dissertori, G.; Dittmar, M.; Donega, M.; Grab, C.; Heidegger, C.; Hits, D.; Hoss, J.; Kasieczka, G.; Lecomte, P.; Lustermann, W.; Mangano, B.; Marionneau, M.; del Arbol, P. Martinez Ruiz; Masciovecchio, M.; Meinhard, M. T.; Meister, D.; Micheli, F.; Musella, P.; Nessi-Tedaldi, F.; Pandolfi, F.; Pata, J.; Pauss, F.; Perrin, G.; Perrozzi, L.; Quittnat, M.; Rossini, M.; Schoenenberger, M.; Starodumov, A.; Tavolaro, V. R.; Theofilatos, K.; Wallny, R.] Swiss Fed Inst Technol, Inst Particle Phys, Zurich, Switzerland. [Aarrestad, T. K.; Amsler, C.; Caminada, L.; Canelli, M. F.; De Cosa, A.; Galloni, C.; Hinzmann, A.; Hreus, T.; Kilminster, B.; Ngadiuba, J.; Pinna, D.; Rauco, G.; Robmann, P.; Salerno, D.; Yang, Y.] Univ Zurich, Zurich, Switzerland. [Candelise, V.; Doan, T. H.; Jain, Sh.; Khurana, R.; Konyushikhin, M.; Kuo, C. M.; Lin, W.; Lu, Y. J.; Pozdnyakov, A.; Yu, S. S.] Natl Cent Univ, Chungli, Taiwan. [Kumar, Arun; Chang, P.; Chang, Y. H.; Chang, Y. W.; Chao, Y.; Chen, K. F.; Chen, P. H.; Dietz, C.; Fiori, F.; Hou, W. -S.; Hsiung, Y.; Liu, Y. F.; Lu, R. -S.; Moya, M. Minano; Paganis, E.; Psallidas, A.; Tsai, J. F.; Tzeng, Y. M.] Natl Taiwan Univ, Taipei, Taiwan. [Asavapibhop, B.; Singh, G.; Srimanobhas, N.; Suwonjandee, N.] Chulalongkorn Univ, Fac Sci, Dept Phys, Bangkok, Thailand. [Cerci, S.; Damarseckin, S.; Demiroglu, Z. S.; Dozen, C.; Dumanoglu, I.; Girgis, S.; Gokbulut, G.; Guler, Y.; Gurpinar, E.; Hos, I.; Kangal, E. E.; Kara, O.; Topaksu, A. Kayis; Kiminsu, U.; Oglakci, M.; Onengut, G.; Ozdemir, K.; Cerci, D. Sunar; Topakli, H.; Turkcapar, S.; Zorbakir, I. S.; Zorbilmez, C.] Cukurova Univ, Adana, Turkey. [Bilin, B.; Bilmis, S.; Isildak, B.; Karapinar, G.; Yalvac, M.; Zeyrek, M.] Middle East Tech Univ, Dept Phys, Ankara, Turkey. [Gulmez, E.; Kaya, M.; Kaya, O.; Yetkin, E. A.; Yetkin, T.] Bogazici Univ, Istanbul, Turkey. [Cakir, A.; Cankocak, K.; Sen, S.] Istanbul Tech Univ, Istanbul, Turkey. [Grynyov, B.] Natl Acad Sci Ukraine, Inst Scintillat Mat, Kharkov, Ukraine. [Levchuk, L.; Sorokin, P.] Kharkov Inst Phys & Technol, Natl Sci Ctr, Kharkov, Ukraine. [Aggleton, R.; Ball, F.; Beck, L.; Brooke, J. J.; Burns, D.; Clement, E.; Cussans, D.; Flacher, H.; Goldstein, J.; Grimes, M.; Heath, G. P.; Heath, H. F.; Jacob, J.; Kreczko, L.; Lucas, C.; Newbold, D. M.; Paramesvaran, S.; Poll, A.; Sakuma, T.; El Nasr-Storey, S. Seif; Smith, D.; Smith, V. J.] Univ Bristol, Bristol, Avon, England. [Bell, K. W.; Belyaev, A.; Brew, C.; Brown, R. M.; Calligaris, L.; Cieri, D.; Cockerill, D. J. A.; Coughlan, J. A.; Harder, K.; Harper, S.; Olaiya, E.; Petyt, D.; Shepherd-Themistocleous, C. H.; Thea, A.; Tomalin, I. R.; Williams, T.] Rutherford Appleton Lab, Didcot, Oxon, England. [Baber, M.; Bainbridge, R.; Buchmuller, O.; Bundock, A.; Burton, D.; Casasso, S.; Citron, M.; Colling, D.; Corpe, L.; Dauncey, P.; Davies, G.; De Wit, A.; Della Negra, M.; Di Maria, R.; Dunne, P.; Elwood, A.; Futyan, D.; Haddad, Y.; Hall, G.; Iles, G.; James, T.; Lane, R.; Laner, C.; Lucas, R.; Lyons, L.; Magnan, A. -M.; Malik, S.; Mastrolorenzo, L.; Nash, J.; Nikitenko, A.; Pela, J.; Penning, B.; Pesaresi, M.; Raymond, D. M.; Richards, A.; Rose, A.; Seez, C.; Summers, S.; Tapper, A.; Uchida, K.; Acosta, M. Vazquez; Virdee, T.; Wright, J.; Zenz, S. C.] Imperial Coll, London, England. [Cole, J. E.; Hobson, P. R.; Khan, A.; Kyberd, P.; Leslie, D.; Reid, I. D.; Symonds, P.; Teodorescu, L.; Turner, M.] Brunel Univ, Uxbridge, Middx, England. [Borzou, A.; Call, K.; Dittmann, J.; Hatakeyama, K.; Liu, H.; Pastika, N.] Baylor Univ, Waco, TX 76798 USA. [Charaf, O.; Cooper, S. I.; Henderson, C.; Rumerio, P.; West, C.] Univ Alabama, Tuscaloosa, AL 35487 USA. [Arcaro, D.; Avetisyan, A.; Bose, T.; Gastler, D.; Rankin, D.; Richardson, C.; Rohlf, J.; Sulak, L.; Zou, D.] Boston Univ, Boston, MA 02215 USA. [Benelli, G.; Berry, E.; Cutts, D.; Garabedian, A.; Hakala, J.; Heintz, U.; Hogan, J. M.; Jesus, O.; Laird, E.; Landsberg, G.; Mao, Z.; Narain, M.; Piperov, S.; Sagir, S.; Spencer, E.; Syarif, R.] Brown Univ, Providence, RI 02912 USA. [Aleksandrov, A.; Breedon, R.; Breto, G.; Burns, D.; Sanchez, M. Calderon De la Barca; Chauhan, S.; Chertok, M.; Conway, J.; Conway, R.; Cox, P. T.; Erbacher, R.; Flores, C.; Funk, G.; Gardner, M.; Ko, W.; Lander, R.; Mclean, C.; Mulhearn, M.; Pellett, D.; Pilot, J.; Shalhout, S.; Smith, J.; Squires, M.; Stolp, D.; Tripathi, M.; Wilbur, S.; Yohay, R.] Univ Calif Davis, Davis, CA 95616 USA. [Cousins, R.; Everaerts, P.; Florent, A.; Hauser, J.; Ignatenko, M.; Saltzberg, D.; Takasugi, E.; Valuev, V.; Weber, M.] Univ Calif Los Angeles, Los Angeles, CA 90095 USA. [Burt, K.; Clare, R.; Ellison, J.; Gary, J. W.; Hanson, G.; Heilman, J.; Jandir, P.; Kennedy, E.; Lacroix, F.; Long, O. R.; Negrete, M. Olmedo; Paneva, M. I.; Shrinivas, A.; Si, W.; Wei, H.; Wimpenny, S.; Yates, B. R.] Univ Calif Riverside, Riverside, CA 92521 USA. [Branson, J. G.; Cerati, G. B.; Cittolin, S.; Derdzinski, M.; Gerosa, R.; Holzner, A.; Klein, D.; Krutelyov, V.; Letts, J.; Macneill, I.; Padhi, S.; Pieri, M.; Sani, M.; Sharma, V.; Simon, S.; Tadel, M.; Vartak, A.; Wasserbaech, S.; Welke, C.; Wood, J.; Wurthwein, F.; Yagil, A.; Della Porta, G. Zevi] Univ Calif San Diego, La Jolla, CA 92093 USA. [Bhandari, R.; Bradmiller-Feld, J.; Campagnari, C.; Dishaw, A.; Dutta, V.; Flowers, K.; Sevilla, M. Franco; Geffert, P.; George, C.; Golf, F.; Gouskos, L.; Gran, J.; Heller, R.; Incandela, J.; Mccoll, N.; Mullin, S. D.; Ovcharova, A.; Richman, J.; Stuart, D.; Suarez, I.; Yoo, J.] Univ Calif Santa Barbara, Dept Phys, Santa Barbara, CA 93106 USA. [Anderson, D.; Apresyan, A.; Bendavid, J.; Bornheim, A.; Bunn, J.; Chen, Y.; Duarte, J.; Lawhorn, J. M.; Mott, A.; Newman, H. B.; Pena, C.; Spiropulu, M.; Vlimant, J. R.; Xie, S.; Zhu, R. Y.] CALTECH, Pasadena, CA 91125 USA. [Andrews, M. B.; Azzolini, V.; Ferguson, T.; Paulini, M.; Russ, J.; Sun, M.; Vogel, H.; Vorobiev, I.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Cumalat, J. P.; Ford, W. T.; Jensen, F.; Johnson, A.; Krohn, M.; Mulholland, T.; Stenson, K.; Wagner, S. R.] Univ Colorado, Boulder, CO 80309 USA. [Alexander, J.; Chaves, J.; Chu, J.; Dittmer, S.; Mcdermott, K.; Mirman, N.; Kaufman, G. Nicolas; Patterson, J. R.; Rinkevicius, A.; Ryd, A.; Skinnari, L.; Soffi, L.; Tan, S. M.; Tao, Z.; Thom, J.; Tucker, J.; Wittich, P.; Zientek, M.] Cornell Univ, Ithaca, NY 14853 USA. [Winn, D.] Fairfield Univ, Fairfield, CT 06430 USA. [Abdullin, S.; Albrow, M.; Apollinari, G.; Banerjee, S.; Bauerdick, L. A. T.; Beretvas, A.; Berryhill, J.; Bhat, P. C.; Bolla, G.; Burkett, K.; Butler, J. N.; Cheung, H. W. K.; Chlebana, F.; Cihangir, S.; Cremonesi, M.; Elvira, V. D.; Fisk, I.; Freeman, J.; Gottschalk, E.; Gray, L.; Green, D.; Grunendahl, S.; Gutsche, O.; Hare, D.; Harris, R. M.; Hasegawa, S.; Hirschauer, J.; Hu, Z.; Jayatilaka, B.; Jindariani, S.; Johnson, M.; Joshi, U.; Klima, B.; Kreis, B.; Lammel, S.; Linacre, J.; Lincoln, D.; Lipton, R.; Liu, T.; De Sa, R. Lopes; Lykken, J.; Maeshima, K.; Magini, N.; Marraffino, J. M.; Maruyama, S.; Mason, D.; McBride, P.; Merkel, P.; Mrenna, S.; Nahn, S.; Newman-Holmes, C.; O'Dell, V.; Pedro, K.; Prokofyev, O.; Rakness, G.; Ristori, L.; Sexton-Kennedy, E.; Soha, A.; Spalding, W. J.; Spiegel, L.; Stoynev, S.; Strobbe, N.; Taylor, L.; Tkaczyk, S.; Tran, N. V.; Uplegger, L.; Vaandering, E. W.; Vernieri, C.; Verzocchi, M.; Vidal, R.; Wang, M.; Weber, H. A.; Whitbeck, A.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Acosta, D.; Avery, P.; Bortignon, P.; Bourilkov, D.; Brinkerhoff, A.; Carnes, A.; Carver, M.; Curry, D.; Das, S.; Field, R. D.; Furic, I. K.; Konigsberg, J.; Korytov, A.; Ma, P.; Matchev, K.; Mei, H.; Milenovic, P.; Mitselmakher, G.; Rank, D.; Shchutska, L.; Sperka, D.; Thomas, L.; Wang, J.; Wang, S.; Yelton, J.] Univ Florida, Gainesville, FL 32611 USA. [Linn, S.; Markowitz, P.; Martinez, G.; Rodriguez, L.] Florida Int Univ, Miami, FL 33199 USA. [Ackert, A.; Adams, J. R.; Adams, T.; Askew, A.; Bein, S.; Diamond, B.; Hagopian, S.; Hagopian, V.; Johnson, K. F.; Khatiwada, A.; Prosper, H.; Santra, A.; Weinberg, M.] Florida State Univ, Tallahassee, FL 32306 USA. [Baarmand, M. M.; Bhopatkar, V.; Colafranceschi, S.; Hohlmann, M.; Noonan, D.; Roy, T.; Yumiceva, F.] Florida Inst Technol, Melbourne, FL 32901 USA. [Adams, M. R.; Apanasevich, L.; Berry, D.; Betts, R. R.; Bucinskaite, I.; Cavanaugh, R.; Evdokimov, O.; Gauthier, L.; Gerber, C. E.; Hofman, D. J.; Kurt, P.; O'Brien, C.; Gonzalez, I. D. Sandoval; Turner, P.; Varelas, N.; Wang, H.; Wu, Z.; Zakaria, M.; Zhang, J.] Univ Illinois, Chicago, IL 60607 USA. [Bilki, B.; Clarida, W.; Dilsiz, K.; Durgut, S.; Gandrajula, R. P.; Haytmyradov, M.; Khristenko, V.; Merlo, J. -P.; Mermerkaya, H.; Mestvirishvili, A.; Moeller, A.; Nachtman, J.; Ogul, H.; Onel, Y.; Ozok, F.; Penzo, A.; Snyder, C.; Tiras, E.; Wetzel, J.; Yi, K.] Univ Iowa, Iowa City, IA 52242 USA. [Anderson, I.; Blumenfeld, B.; Cocoros, A.; Eminizer, N.; Fehling, D.; Feng, L.; Gritsan, A. V.; Maksimovic, P.; Osherson, M.; Roskes, J.; Sarica, U.; Swartz, M.; Xiao, M.; Xin, Y.; You, C.] Johns Hopkins Univ, Baltimore, MD 21218 USA. [Al-Bataineh, A.; Baringer, P.; Bean, A.; Boren, S.; Bowen, J.; Bruner, C.; Castle, J.; Forthomme, L.; Kenny, R. P., III; Kropivnitskaya, A.; Majumder, D.; Mcbrayer, W.; Murray, M.; Sanders, S.; Stringer, R.; Takaki, J. D. Tapia; Wang, Q.] Univ Kansas, Lawrence, KS 66045 USA. [Ivanov, A.; Kaadze, K.; Khalil, S.; Makouski, M.; Maravin, Y.; Mohammadi, A.; Saini, L. K.; Skhirtladze, N.; Toda, S.] Kansas State Univ, Manhattan, KS 66506 USA. [Rebassoo, F.; Wright, D.] Lawrence Livermore Natl Lab, Livermore, CA 94551 USA. [Anelli, C.; Baden, A.; Baron, O.; Belloni, A.; Calvert, B.; Eno, S. C.; Ferraioli, C.; Gomez, J. A.; Hadley, N. J.; Jabeen, S.; Kellogg, R. G.; Kolberg, T.; Kunkle, J.; Lu, Y.; Mignerey, C.; Ricci-Tam, F.; Shin, Y. H.; Skuja, A.; Tonjes, M. B.; Tonwar, S. C.] Univ Maryland, College Pk, MD 20742 USA. [Abercrombie, D.; Allen, B.; Apyan, A.; Barbieri, R.; Baty, A.; Bi, R.; Bierwagen, K.; Brandt, S.; Busza, W.; Cali, I. A.; Demiragli, Z.; Di Matteo, L.; Ceballos, G. Gomez; Goncharov, M.; Hsu, D.; Iiyama, Y.; Klute, M.; Kovalskyi, D.; Krajczar, K.; Lai, Y. S.; Lee, Y. -J.; Levin, A.; Luckey, P. D.; Marini, A. C.; Mcginn, C.; Mironov, C.; Narayanan, S.; Niu, X.; Paus, C.; Roland, C.; Roland, G.; Salfeld-Nebgen, J.; Stephans, G. S. F.; Sumorok, K.; Tatar, K.; Varma, M.; Velicanu, D.; Veverka, J.; Wang, J.; Wang, T. W.; Wyslouch, B.; Yang, M.; Zhukova, V.] MIT, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Benvenuti, A. C.; Chatterjee, R. M.; Evans, A.; Finkel, A.; Gude, A.; Hansen, P.; Kalafut, S.; Kao, S. C.; Kubota, Y.; Lesko, Z.; Mans, J.; Nourbakhsh, S.; Ruckstuhl, N.; Rusack, R.; Tambe, N.; Turkewitz, J.] Univ Minnesota, Minneapolis, MN 55455 USA. [Acosta, J. G.; Oliveros, S.] Univ Mississippi, Oxford, MS 38677 USA. [Avdeeva, E.; Bartek, R.; Bloom, K.; Claes, D. R.; Dominguez, A.; Fangmeier, C.; Suarez, R. Gonzalez; Kamalieddin, R.; Kravchenko, I.; Rodrigues, A. Malta; Meier, F.; Monroy, J.; Siado, J. E.; Snow, G. R.; Stieger, B.] Univ Nebraska, Lincoln, NE 68588 USA. [Alyari, M.; Dolen, J.; George, J.; Godshalk, A.; Harrington, C.; Iashvili, I.; Kaisen, J.; Kharchilava, A.; Kumar, A.; Parker, A.; Rappoccio, S.; Roozbahani, B.] SUNY Buffalo, Buffalo, NY 14260 USA. [Alverson, G.; Barberis, E.; Baumgartel, D.; Hortiangtham, A.; Massironi, A.; Morse, D. M.; Nash, D.; Orimoto, T.; De Lima, R. Teixeira; Trocino, D.; Wang, R. -J.; Wood, D.] Northeastern Univ, Boston, MA 02115 USA. [Bhattacharya, S.; Hahn, K. A.; Kubik, A.; Kumar, A.; Low, J. F.; Mucia, N.; Odell, N.; Pollack, B.; Schmitt, M. H.; Sung, K.; Trovato, M.; Velasco, M.] Northwestern Univ, Evanston, IL 60208 USA. [Dev, N.; Hildreth, M.; Anampa, K. Hurtado; Jessop, C.; Karmgard, D. J.; Kellams, N.; Lannon, K.; Marinelli, N.; Meng, F.; Mueller, C.; Musienko, Y.; Planer, M.; Reinsvold, A.; Ruchti, R.; Smith, G.; Taroni, S.; Wayne, M.; Wolf, M.; Woodard, A.] Univ Notre Dame, Notre Dame, IN 46556 USA. [Alimena, J.; Antonelli, L.; Brinson, J.; Bylsma, B.; Durkin, L. S.; Flowers, S.; Francis, B.; Hart, A.; Hill, C.; Hughes, R.; Ji, W.; Liu, B.; Luo, W.; Puigh, D.; Winer, B. L.; Wulsin, H. W.] Ohio State Univ, Columbus, OH 43210 USA. [Cooperstein, S.; Driga, O.; Elmer, P.; Hardenbrook, J.; Hebda, P.; Lange, D.; Luo, J.; Marlow, D.; Medvedeva, T.; Mei, K.; Mooney, M.; Olsen, J.; Palmer, C.; Piroue, P.; Stickland, D.; Tully, C.; Zuranski, A.] Princeton Univ, Princeton, NJ 08542 USA. [Malik, S.] Univ Puerto Rico, Mayaguez, PR 00681 USA. [Barker, A.; Barnes, V. E.; Folgueras, S.; Gutay, L.; Jha, M. K.; Jones, M.; Jung, A. W.; Jung, K.; Miller, D. H.; Neumeister, N.; Shi, X.; Sun, J.; Svyatkovskiy, A.; Wang, F.; Xie, W.; Xu, L.] Purdue Univ, W Lafayette, IN 47907 USA. [Parashar, N.; Stupak, J.] Purdue Univ Calumet, Hammond, IN 46323 USA. [Adair, A.; Akgun, B.; Chen, Z.; Ecklund, K. M.; Geurts, F. J. M.; Guilbaud, M.; Li, W.; Michlin, B.; Northup, M.; Padley, B. P.; Redjimi, R.; Roberts, J.; Rorie, J.; Tu, Z.; Zabel, J.] Rice Univ, Houston, TX 77251 USA. [Betchart, B.; Bodek, A.; de Barbaro, P.; Demina, R.; Duh, Y. T.; Ferbel, T.; Galanti, M.; Garcia-Bellido, A.; Han, J.; Hindrichs, O.; Khukhunaishvili, A.; Lo, K. H.; Tan, P.; Verzetti, M.] Univ Rochester, 601 Elmwood Ave, Rochester, NY 14627 USA. [Agapitos, A.; Chou, J. P.; Contreras-Campana, E.; Gershtein, Y.; Espinosa, T. A. Gomez; Halkiadakis, E.; Heindl, M.; Hidas, D.; Hughes, E.; Kaplan, S.; Elayavalli, R. Kunnawalkam; Kyriacou, S.; Lath, A.; Nash, K.; Saka, H.; Salur, S.; Schnetzer, S.; Sheffield, D.; Somalwar, S.; Stone, R.; Thomas, S.; Thomassen, P.; Walker, M.] Rutgers State Univ, Piscataway, NJ 08854 USA. [Foerster, M.; Heideman, J.; Riley, G.; Rose, K.; Spanier, S.; Thapa, K.] Univ Tennessee, Knoxville, TN 37996 USA. [Bouhali, O.; Celik, A.; Dalchenko, M.; De Mattia, M.; Delgado, A.; Dildick, S.; Eusebi, R.; Gilmore, J.; Huang, T.; Juska, E.; Kamon, T.; Mueller, R.; Pakhotin, Y.; Patel, R.; Perloff, A.; Pernie, L.; Rathjens, D.; Rose, A.; Safonov, A.; Tatarinov, A.; Ulmer, K. A.] Texas A&M Univ, College Stn, TX 77843 USA. [Akchurin, N.; Cowden, C.; Damgov, J.; De Guio, F.; Dragoiu, C.; Dudero, P. R.; Faulkner, J.; Kunori, S.; Lamichhane, K.; Lee, S. W.; Libeiro, T.; Peltola, T.; Undleeb, S.; Volobouev, I.; Wang, Z.] Texas Tech Univ, Lubbock, TX 79409 USA. [Delannoy, A. G.; Greene, S.; Gurrola, A.; Janjam, R.; Johns, W.; Maguire, C.; Melo, A.; Ni, H.; Sheldon, P.; Tuo, S.; Velkovska, J.; Xu, Q.] Vanderbilt Univ, 221 Kirkland Hall, Nashville, TN 37235 USA. [Arenton, M. W.; Barria, P.; Cox, B.; Goodell, J.; Hirosky, R.; Ledovskoy, A.; Li, H.; Neu, C.; Sinthuprasith, T.; Sun, X.; Wang, Y.; Wolfe, E.; Xia, F.] Univ Virginia, Charlottesville, VA 22904 USA. [Clarke, C.; Harr, R.; Karchin, P. E.; Lamichhane, P.; Sturdy, J.] Wayne State Univ, Detroit, MI 48202 USA. [Belknap, D. A.; Dasu, S.; Dodd, L.; Duric, S.; Gomber, B.; Grothe, M.; Herndon, M.; Herve, A.; Klabbers, P.; Lanaro, A.; Levine, A.; Long, K.; Loveless, R.; Ojalvo, I.; Perry, T.; Polese, G.; Ruggles, T.; Savin, A.; Smith, N.; Smith, W. H.; Taylor, D.; Woods, N.] Univ Wisconsin, Madison, WI 53706 USA. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Vienna Univ Technol, Vienna, Austria. Peking Univ, State Key Lab Nucl Phys & Technol, Beijing, Peoples R China. Univ Haute Alsace Mulhouse, Univ Strasbourg, Inst Pluridisciplinaire Hubert Curien, CNRS,IN2P3, Strasbourg, France. [Manganote, E. J. Tonelli] Univ Estadual Campinas, Campinas, SP, Brazil. Univ Fed Pelotas, Pelotas, Brazil. [Fang, W.] Univ Libre Bruxelles, Brussels, Belgium. [Chen, Y.] DESY, Hamburg, Germany. [Finger, M.; Finger, M., Jr.; Tsamalaidze, Z.] Joint Inst Nucl Res, Dubna, Russia. [Assran, Y.] Suez Univ, Suez, Egypt. [Assran, Y.] British Univ Egypt, Cairo, Egypt. Ain Shams Univ, Cairo, Egypt. [Mahrous, A.] Helwan Univ, Cairo, Egypt. [Agram, J. -L.; Conte, E.; Fontaine, J. -C.] Univ Haute Alsace, Mulhouse, France. [Popov, A.; Zhukov, V.; Katkov, I.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Toriashvili, T.] Tbilisi State Univ, Tbilisi, Rep of Georgia. [Stahl, A.; Pantaleo, F.; Hartmann, F.; Mohanty, A. K.; Silvestris, L.; Tosi, N.; Viliani, L.; Primavera, F.; Brianza, L.; Manzoni, R. A.; Di Guida, S.; Meola, S.; Paolucci, P.; Azzi, P.; Pazzini, J.; Azzurri, P.; D'imperio, G.; Del Re, D.; Arcidiacono, R.; Kornmayer, A.; Virdee, T.] CERN, European Org Nucl Res, Geneva, Switzerland. [Borras, K.] Rhein Westfal TH Aachen, Phys Inst A 3, Aachen, Germany. [Gallo, E.] Univ Hamburg, Hamburg, Germany. [Hempel, M.; Karacheban, O.] Brandenburg Tech Univ Cottbus, Cottbus, Germany. [Horvath, D.] Inst Nucl Res ATOMKI, Debrecen, Hungary. [Vesztergombi, G.; Bartok, M.; Veres, G. I.] Eotvos Lorand Univ, MTA ELTE Lendulet CMS Particle & Nucl Phys Grp, Budapest, Hungary. [Karancsi, J.] Univ Debrecen, Debrecen, Hungary. [Choudhury, S.] Indian Inst Sci Educ & Res, Bhopal, India. [Nayak, A.] Inst Phys, Bhubaneswar, Orissa, India. [Bhowmik, S.; Maity, M.; Sarkar, T.] Visva Bharati Univ, Santini Ketan, W Bengal, India. [Wickramage, N.] Univ Ruhuna, Matara, Sri Lanka. [Chenarani, S.; Etesami, S. M.; Kangal, E. E.] Isfahan Univ Technol, Esfahan, Iran. [Fahim, A.] Univ Tehran, Dept Engn Sci, Tehran, Iran. [Mehdiabadi, S. Paktinat] Yazd Univ, Yazd, Iran. [Safarzadeh, B.] Islamic Azad Univ, Sci & Res Branch, Plasma Phys Res Ctr, Tehran, Iran. [Biasotto, M.; Maron, G.] Ist Nazl Fis Nucl, Lab Nazl Legnaro, Legnaro, Italy. [Androsov, K.; Ciocci, M. A.; Grippo, M. T.] Univ Siena, Siena, Italy. [Savoy-Navarro, A.] Purdue Univ, W Lafayette, IN 47907 USA. [Ali, M. A. B. Md] Int Islamic Univ Malaysia, Kuala Lumpur, Malaysia. [Idris, F. Mohamad] MOSTI, Malaysian Nucl Agcy, Kajang, Malaysia. [Heredia-De la Cruz, I.] Consejo Nacl Ciencia & Technol, Mexico City, DF, Mexico. Warsaw Univ Technol, Inst Elect Syst, Warsaw, Poland. [Matveev, V.; Musienko, Y.] Inst Nucl Res, Moscow, Russia. [Matveev, V.; Bylinkin, A.; Azarkin, M.; Dremin, I.; Leonidov, A.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Kim, V.] St Petersburg State Polytech Univ, St Petersburg, Russia. [Kuznetsova, E.] Univ Florida, Gainesville, FL USA. [Chistov, R.; Danilov, M.] PN Lebedev Phys Inst, Moscow, Russia. [Dubinin, M.] CALTECH, Pasadena, CA USA. [Blinov, V.; Skovpen, Y.; Bilki, B.] Budker Inst Nucl Phys, Novosibirsk, Russia. Univ Belgrade, Fac Phys, Belgrade, Serbia. [Di Marco, E.] Univ Rome, Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Rolandi, G.] Ist Nazl Fis Nucl, Scuola Normale & Sez, Pisa, Italy. [Sphicas, P.] Univ Athens, Athens, Greece. [Veckalns, V.] Riga Tech Univ, Riga, Latvia. [Starodumov, A.; Nikitenko, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Amsler, C.] Albert Einstein Ctr Fundamental Phys, Bern, Switzerland. [Cerci, S.; Cerci, D. Sunar] Adiyaman Univ, Adiyaman, Turkey. Mersin Univ, Mersin, Turkey. [Onengut, G.] Cag Univ, Mersin, Turkey. [Ozdemir, K.] Piri Reis Univ, Istanbul, Turkey. [Topakli, H.] Gaziosmanpasa Univ, Tokat, Turkey. [Isildak, B.] Ozyegin Univ, Istanbul, Turkey. 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RP Khachatryan, V (reprint author), Yerevan Phys Inst, Yerevan, Armenia. RI Azarkin, Maxim/N-2578-2015; Danilov, Mikhail/C-5380-2014; Kirakosyan, Martin/N-2701-2015; Della Ricca, Giuseppe/B-6826-2013; Puljak, Ivica/D-8917-2017; Fernandez Menendez, Javier/B-6550-2014; TUVE', Cristina/P-3933-2015; Goh, Junghwan/Q-3720-2016; Manganote, Edmilson/K-8251-2013; Lokhtin, Igor/D-7004-2012; Terkulov, Adel/M-8581-2015; Smirnov, Vitaly/B-5001-2017; Moraes, Arthur/F-6478-2010; Ogul, Hasan/S-7951-2016; Dremin, Igor/K-8053-2015; Yazgan, Efe/C-4521-2014; Konecki, Marcin/G-4164-2015; Chistov, Ruslan/B-4893-2014; Leonidov, Andrey/M-4440-2013; Paulini, Manfred/N-7794-2014; Andreev, Vladimir/M-8665-2015 OI Danilov, Mikhail/0000-0001-9227-5164; Della Ricca, Giuseppe/0000-0003-2831-6982; Fernandez Menendez, Javier/0000-0002-5213-3708; TUVE', Cristina/0000-0003-0739-3153; Goh, Junghwan/0000-0002-1129-2083; Moraes, Arthur/0000-0002-5157-5686; Ogul, Hasan/0000-0002-5121-2893; Yazgan, Efe/0000-0001-5732-7950; Konecki, Marcin/0000-0001-9482-4841; Chistov, Ruslan/0000-0003-1439-8390; Paulini, Manfred/0000-0002-6714-5787; FU BMWFW (Austria); FWF (Austria); FNRS (Belgium); FWO (Belgium); CNPq (Brazil); CAPES (Brazil); FAPERJ (Brazil); FAPESP (Brazil); MES (Bulgaria); CERN; CAS (China); MoST (China); NSFC (China); COLCIENCIAS (Colombia); MSES (Croatia); CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER (Estonia); ERC IUT (Estonia); ERDF (Estonia); Academy of Finland (Finland); MEC (Finland); HIP (Finland); CEA (France); CNRS/IN2P3 (France); BMBF (Germany); DFG (Germany); HGF (Germany); GSRT (Greece); OTKA (Hungary); NIH (Hungary); DAE (India); DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP (Republic of Korea); NRF (Republic of Korea); LAS (Lithuania); MOE (Malaysia); UM (Malaysia); BUAP (Mexico); CINVESTAV (Mexico); CONACYT (Mexico); LNS (Mexico); SEP (Mexico); UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE (Poland); NSC (Poland); FCT (Portugal); JINR (Dubna); MON (Russia); RosAtom (Russia); RAS (Russia); RFBR (Russia); MESTD (Serbia); SEIDI (Spain); CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter (Thailand); IPST (Thailand); STAR (Thailand); NSTDA (Thailand); TUBITAK (Turkey); TAEK (Turkey); NASU (Ukraine); SFFR (Ukraine); STFC (United Kingdom); DOE (USA); NSF (USA); Marie-Curie program; European Research Council (European Union); EPLANET (European Union); Leventis Foundation; A. P. Sloan Foundation; Alexander von Humboldt Foundation; Belgian Federal Science Policy Office; Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; Council of Science and Industrial Research, India; HOMING PLUS program of the Foundation for Polish Science; Mobility Plus program of the Ministry of Science and Higher Education; National Science Center (Poland) [Harmonia 2014/14/M/ST2/00428, Opus 2013/11/B/ST2/04202, 2014/13/B/ST2/02543, 2014/15/B/ST2/03998, Sonata-bis 2012/07/E/ST2/01406]; Thalis program - EU-ESF; Aristeia program - EU-ESF; Greek NSRF; National Priorities Research Program by Qatar National Research Fund; Programa Clarin-COFUND del Principado de Asturias; Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University; Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); Welch Foundation [C-1845]; European Union FX We congratulate our colleagues in the CERN accelerator departments for the excellent performance of the LHC and thank the technical and administrative staffs at CERN and at other CMS institutes for their contributions to the success of the CMS effort. In addition, we gratefully acknowledge the computing centers and personnel of the Worldwide LHC Computing Grid for delivering so effectively the computing infrastructure essential to our analyses. Finally, we acknowledge the enduring support for the construction and operation of the LHC and the CMS detector provided by the following funding agencies: BMWFW and FWF (Austria); FNRS and FWO (Belgium); CNPq, CAPES, FAPERJ, and FAPESP (Brazil); MES (Bulgaria); CERN; CAS, MoST, and NSFC (China); COLCIENCIAS (Colombia); MSES and CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER, ERC IUT, and ERDF (Estonia); Academy of Finland, MEC, and HIP (Finland); CEA and CNRS/IN2P3 (France); BMBF, DFG, and HGF (Germany); GSRT (Greece); OTKA and NIH (Hungary); DAE and DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP and NRF (Republic of Korea); LAS (Lithuania); MOE and UM (Malaysia); BUAP, CINVESTAV, CONACYT, LNS, SEP, and UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE and NSC (Poland); FCT (Portugal); JINR (Dubna); MON, RosAtom, RAS, and RFBR (Russia); MESTD (Serbia); SEIDI and CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter, IPST, STAR, and NSTDA (Thailand); TUBITAK and TAEK (Turkey); NASU and SFFR (Ukraine); STFC (United Kingdom); DOE and NSF (USA). Individuals have received support from the Marie-Curie program and the European Research Council and EPLANET (European Union); the Leventis Foundation; the A. P. Sloan Foundation; the Alexander von Humboldt Foundation; the Belgian Federal Science Policy Office; the Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); the Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); the Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; the Council of Science and Industrial Research, India; the HOMING PLUS program of the Foundation for Polish Science, cofinanced from European Union, Regional Development Fund, the Mobility Plus program of the Ministry of Science and Higher Education, the National Science Center (Poland), contracts Harmonia 2014/14/M/ST2/00428, Opus 2013/11/B/ST2/04202, 2014/13/B/ST2/02543, and 2014/15/B/ST2/03998, Sonata-bis 2012/07/E/ST2/01406; the Thalis and Aristeia programs cofinanced by EU-ESF and the Greek NSRF; the National Priorities Research Program by Qatar National Research Fund; the Programa Clarin-COFUND del Principado de Asturias; the Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University, and the Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); and the Welch Foundation, contract C-1845. NR 64 TC 0 Z9 0 U1 42 U2 42 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 7 PY 2016 VL 94 IS 11 AR 112004 DI 10.1103/PhysRevD.94.112004 PG 23 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA EE3PN UT WOS:000389505200001 ER PT J AU Aartsen, MG Abraham, K Ackermann, M Adams, J Aguilar, JA Ahlers, M Ahrens, M Altmann, D Andeen, K Anderson, T Ansseau, I Anton, G Archinger, M Arguelles, C Auffenberg, J Axani, S Bai, X Barwick, SW Baum, V Bay, R Beatty, JJ Tjus, JB Becker, KH BenZvi, S Berghaus, P Berley, D Bernardini, E Bernhard, A Besson, DZ Binder, G Bindig, D Bissok, M Blaufuss, E Blot, S Bohm, C Borner, M Bos, F Bose, D Boser, S Botner, O Braun, J Brayeur, L Bretz, HP Burgman, A Carver, T Casier, M Cheung, E Chirkin, D Christov, A Clark, K Classen, L Coenders, S Collin, GH Conrad, JM Cowen, DF Cross, R Day, M de Andre, JPAM De Clercy, C Rosendo, ED Dembinski, H De Ridder, S Desiati, P de Vries, KD de Wasseige, G de With, M DeYoung, T Diaz-Velez, JC di Lorenzo, V Dujmovic, H Dumm, JP Dunkman, M Eberhardt, B Ehrhardt, T Eichmann, B Eller, P Euler, S Evenson, PA Fahey, S Fazely, AR Feintzeig, J Felde, J Filimonov, K Finley, C Flis, S Fosig, CC Franckowiak, A Friedman, E Fuchs, T Gaisser, TK Gallagher, J Gerhardt, L Ghorbani, K Giang, W Gladstone, L Glagla, M Glusenkamp, T Goldschmidt, A Golup, G Gonzalez, JG Grant, D Griffith, Z Haack, C Ismail, AH Hallgren, A Halzen, F Hansen, E Hansmann, B Hansmann, T Hanson, K Hebecker, D Heereman, D Helbing, K Hellauer, R Hickford, S Hignight, J Hill, GC Hoffman, KD Hoffmann, R Holzapfel, K Hoshina, K Huang, F Huber, M Hultqvist, K In, S Ishihara, A Jacobi, E Japaridze, GS Jeong, M Jero, K Jones, BJP Jurkovic, M Kappes, A Karg, T Karle, A Katz, U Kauer, M Keivani, A Kelley, JL Kemp, J Kheirandish, A Kim, M Kintscher, T Kiryluk, J Kittler, T Klein, SR Kohnen, G Koirala, R Kolanoski, H Konietz, R Kopke, L Kopper, C Kopper, S Koskinen, DJ Kowalski, M Krings, K Kroll, M Kruckl, G Kruger, C Kunnen, J Kunwar, S Kurahashi, N Kuwabara, T Labare, M Lanfranchi, JL Larson, MJ Lauber, F Lennarz, D Lesiak-Bzdak, M Leuermann, M Leuner, J Lu, L Lunemann, J Madsen, J Maggi, G Mahn, KBM Mancina, S Mandelartz, M Maruyama, R Mase, K Maunu, R McNally, F Meagher, K Medici, M Meier, M Meli, A Menne, T Merino, G Meures, T Miarecki, S Mohrmann, L Montaruli, T Moulai, M Nahnhauer, R Naumann, U Neer, G Niederhausen, H Nowicki, SC Nygren, DR Pollmann, AO Olivas, A O' Murchadha, A Palczewski, T Pandya, H Pankova, DV Penek, O Pepper, JA de los Heros, CP Pieloth, D Pinat, E Price, PB Przybylski, GT Quinnan, M Raab, C Radel, L Rameez, M Rawlins, K Reimann, R Relethford, B Relich, M Resconi, E Rhode, W Richman, M Riedel, B Robertson, S Rongen, M Rott, C Ruhe, T Ryckbosch, D Rysewyk, D Sabbatini, L Herrera, SES Sandrock, A Sandroos, J Sarkar, S Satalecka, K Schimp, M Schlunder, P Schmidt, T Schoenen, S Schoneberg, S Schumacher, L Seckel, D Seunarine, S Soldin, D Song, M Spiczak, GM Spiering, C Stahlberg, M Stanev, T Stasik, A Steuer, A Stezelberger, T Stokstad, RG Stossl, A Strom, R Strotjohann, NL Sullivan, GW Sutherland, M Taavola, H Taboada, I Tatar, J Tenholt, F Ter-Antonyan, S Terliuk, A Tesic, G Tilav, S Toale, PA Tobin, MN Toscano, S Tosi, D Tselengidou, M Turcati, A Unger, E Usner, M Vandenbroucke, J van Eijndhoven, N Vanheule, S van Rossem, M van Santen, J Veenkamp, J Vehring, M Voge, M Vraeghe, M Walck, C Wallace, A Wallraff, M Wandkowsky, N Weaver, C Weiss, MJ Wendt, C Westerhoff, S Whelan, BJ Wickmann, S Wiebe, K Wiebusch, CH Wille, L Williams, DR Wills, L Wolf, M Wood, TR Woolsey, E Woschnagg, K Xu, DL Xu, XW Xu, Y Yanez, JP Yodh, G Yoshida, S Zoll, M AF Aartsen, M. G. Abraham, K. Ackermann, M. Adams, J. Aguilar, J. A. Ahlers, M. Ahrens, M. Altmann, D. Andeen, K. Anderson, T. Ansseau, I. Anton, G. Archinger, M. Arguelles, C. Auffenberg, J. Axani, S. Bai, X. Barwick, S. W. Baum, V. Bay, R. Beatty, J. J. Tjus, J. Becker Becker, K. -H. BenZvi, S. Berghaus, P. Berley, D. Bernardini, E. Bernhard, A. Besson, D. Z. Binder, G. Bindig, D. Bissok, M. Blaufuss, E. Blot, S. Bohm, C. Boerner, M. Bos, F. Bose, D. Boeser, S. Botner, O. Braun, J. Brayeur, L. Bretz, H. -P. Burgman, A. Carver, T. Casier, M. Cheung, E. Chirkin, D. Christov, A. Clark, K. Classen, L. Coenders, S. Collin, G. H. Conrad, J. M. Cowen, D. F. Cross, R. Day, M. de Andre, J. P. A. M. De Clercy, C. Rosendo, E. del Pino Dembinski, H. De Ridder, S. Desiati, P. de Vries, K. D. de Wasseige, G. de With, M. DeYoung, T. Diaz-Velez, J. C. di Lorenzo, V. Dujmovic, H. Dumm, J. P. Dunkman, M. Eberhardt, B. Ehrhardt, T. Eichmann, B. Eller, P. Euler, S. Evenson, P. A. Fahey, S. Fazely, A. R. Feintzeig, J. 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Kuwabara, T. Labare, M. Lanfranchi, J. L. Larson, M. J. Lauber, F. Lennarz, D. Lesiak-Bzdak, M. Leuermann, M. Leuner, J. Lu, L. Lunemann, J. Madsen, J. Maggi, G. Mahn, K. B. M. Mancina, S. Mandelartz, M. Maruyama, R. Mase, K. Maunu, R. McNally, F. Meagher, K. Medici, M. Meier, M. Meli, A. Menne, T. Merino, G. Meures, T. Miarecki, S. Mohrmann, L. Montaruli, T. Moulai, M. Nahnhauer, R. Naumann, U. Neer, G. Niederhausen, H. Nowicki, S. C. Nygren, D. R. Pollmann, A. Obertacke Olivas, A. O' Murchadha, A. Palczewski, T. Pandya, H. Pankova, D. V. Penek, O. Pepper, J. A. de los Heros, C. Perez Pieloth, D. Pinat, E. Price, P. B. Przybylski, G. T. Quinnan, M. Raab, C. Raedel, L. Rameez, M. Rawlins, K. Reimann, R. Relethford, B. Relich, M. Resconi, E. Rhode, W. Richman, M. Riedel, B. Robertson, S. Rongen, M. Rott, C. Ruhe, T. Ryckbosch, D. Rysewyk, D. Sabbatini, L. Herrera, S. E. Sanchez Sandrock, A. Sandroos, J. Sarkar, S. Satalecka, K. Schimp, M. Schlunder, P. Schmidt, T. Schoenen, S. Schoeneberg, S. Schumacher, L. Seckel, D. Seunarine, S. Soldin, D. Song, M. Spiczak, G. M. Spiering, C. Stahlberg, M. Stanev, T. Stasik, A. Steuer, A. Stezelberger, T. Stokstad, R. G. Stoessl, A. Stroem, R. Strotjohann, N. L. Sullivan, G. W. Sutherland, M. Taavola, H. Taboada, I. Tatar, J. Tenholt, F. Ter-Antonyan, S. Terliuk, A. Tesic, G. Tilav, S. Toale, P. A. Tobin, M. N. Toscano, S. Tosi, D. Tselengidou, M. Turcati, A. Unger, E. Usner, M. Vandenbroucke, J. van Eijndhoven, N. Vanheule, S. van Rossem, M. van Santen, J. Veenkamp, J. Vehring, M. Voge, M. Vraeghe, M. Walck, C. Wallace, A. Wallraff, M. Wandkowsky, N. Weaver, Ch. Weiss, M. J. Wendt, C. Westerhoff, S. Whelan, B. J. Wickmann, S. Wiebe, K. Wiebusch, C. H. Wille, L. Williams, D. R. Wills, L. Wolf, M. Wood, T. R. Woolsey, E. Woschnagg, K. Xu, D. L. Xu, X. W. Xu, Y. Yanez, J. P. Yodh, G. Yoshida, S. Zoll, M. CA IceCube Collaboration TI Constraints on Ultrahigh-Energy Cosmic-Ray Sources from a Search for Neutrinos above 10 PeV with IceCube SO PHYSICAL REVIEW LETTERS LA English DT Article ID COSMOGENIC NEUTRINOS; TRACK RECONSTRUCTION; FERMI-LAT; BURSTS; SPECTRUM; MODEL; FLUX; TELESCOPES; SELECTION; EMISSION AB We report constraints on the sources of ultrahigh-energy cosmic rays (UHECRs) above 10(9) GeV, based on an analysis of seven years of IceCube data. This analysis efficiently selects very high-energy neutrino-induced events which have deposited energies from 5 x 10(5) GeV to above 10(11) GeV. Two neutrino-induced events with an estimated deposited energy of (2.6 +/- 0.3) x 10(6) GeV, the highest neutrino energy observed so far, and (7.7 +/- 2.0) x 10(5) GeV were detected. The atmospheric background-only hypothesis of detecting these events is rejected at 3.6 sigma. The hypothesis that the observed events are of cosmogenic origin is also rejected at > 99% CL because of the limited deposited energy and the nonobservation of events at higher energy, while their observation is consistent with an astrophysical origin. Our limits on cosmogenic neutrino fluxes disfavor the UHECR sources having a cosmological evolution stronger than the star formation rate, e.g., active galactic nuclei and gamma-ray bursts, assuming proton-dominated UHECRs. Constraints on UHECR sources including mixed and heavy UHECR compositions are obtained for models of neutrino production within UHECR sources. Our limit disfavors a significant part of parameter space for active galactic nuclei and new-born pulsar models. These limits on the ultrahigh-energy neutrino flux models are the most stringent to date. C1 [Auffenberg, J.; Bissok, M.; Glagla, M.; Haack, C.; Hansmann, B.; Hansmann, T.; Kemp, J.; Konietz, R.; Leuermann, M.; Leuner, J.; Penek, O.; Raedel, L.; Reimann, R.; Rongen, M.; Schimp, M.; Schoenen, S.; Schumacher, L.; Stahlberg, M.; Vehring, M.; Wallraff, M.; Wickmann, S.; Wiebusch, C. H.] Rhein Westfal TH Aachen, Phys Inst 3, D-52056 Aachen, Germany. [Aartsen, M. G.; Hill, G. C.; Robertson, S.; Wallace, A.; Whelan, B. J.] Univ Adelaide, Dept Phys, Adelaide, SA 5005, Australia. [Rawlins, K.] Univ Alaska Anchorage, Dept Phys & Astron, 3211 Providence Dr, Anchorage, AK 99508 USA. [Japaridze, G. S.] Clark Atlanta Univ, CTSPS, Atlanta, GA 30314 USA. [Taboada, I.] Georgia Inst Technol, Sch Phys, Atlanta, GA 30332 USA. [Taboada, I.] Georgia Inst Technol, Ctr Relativist Astrophys, Atlanta, GA 30332 USA. [Fazely, A. R.; Ter-Antonyan, S.; Xu, X. W.] Southern Univ, Dept Phys, Baton Rouge, LA 70813 USA. [Bay, R.; Binder, G.; Filimonov, K.; Gerhardt, L.; Klein, S. R.; Miarecki, S.; Price, P. 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D.; de Wasseige, G.; Golup, G.; Kunnen, J.; Lunemann, J.; Maggi, G.; Toscano, S.; van Eijndhoven, N.] Vrije Univ Brussel, Dienst ELEM, B-1050 Brussels, Belgium. [Arguelles, C.; Axani, S.; Collin, G. H.; Conrad, J. M.; Jones, B. J. P.; Moulai, M.] MIT, Dept Phys, Cambridge, MA 02139 USA. [Ishihara, A.; Kuwabara, T.; Lu, L.; Mase, K.; Relich, M.; Yoshida, S.] Chiba Univ, Dept Phys, Chiba 2638522, Japan. [Ishihara, A.; Kuwabara, T.; Lu, L.; Mase, K.; Relich, M.; Yoshida, S.] Chiba Univ, Inst Global Prominent Res, Chiba 2638522, Japan. [Adams, J.] Univ Canterbury, Dept Phys & Astron, Private Bag 4800, Christchurch, New Zealand. [Berley, D.; Blaufuss, E.; Cheung, E.; Felde, J.; Friedman, E.; Hellauer, R.; Hoffman, K. D.; Maunu, R.; Olivas, A.; Schmidt, T.; Song, M.; Sullivan, G. W.] Univ Maryland, Dept Phys, College Pk, MD 20742 USA. [Beatty, J. J.; Sutherland, M.] Ohio State Univ, Dept Phys, Columbus, OH 43210 USA. [Beatty, J. J.; Sutherland, M.] Ohio State Univ, Ctr Cosmol & AstroParticle Phys, Columbus, OH 43210 USA. [Beatty, J. J.] Ohio State Univ, Dept Astron, 174 W 18Th Ave, Columbus, OH 43210 USA. [Hansen, E.; Koskinen, D. J.; Larson, M. J.; Medici, M.; Rameez, M.; Sarkar, S.] Univ Copenhagen, Niels Bohr Inst, DK-2100 Copenhagen, Denmark. [Boerner, M.; Fuchs, T.; Meier, M.; Menne, T.; Pieloth, D.; Rhode, W.; Ruhe, T.; Sandrock, A.; Schlunder, P.] TU Dortmund Univ, Dept Phys, D-44221 Dortmund, Germany. [de Andre, J. P. A. M.; DeYoung, T.; Hignight, J.; Lennarz, D.; Mahn, K. B. M.; Neer, G.; Rysewyk, D.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Giang, W.; Grant, D.; Kopper, C.; Nowicki, S. C.; Riedel, B.; Herrera, S. E. Sanchez; Weaver, Ch.; Wood, T. R.; Woolsey, E.] Univ Alberta, Dept Phys, Edmonton, AB T6G 2E1, Canada. [Altmann, D.; Anton, G.; Katz, U.; Kittler, T.; Tselengidou, M.] Friedrich Alexander Univ Erlangen Nurnberg, Erlangen Ctr Astroparticle Phys, D-91058 Erlangen, Germany. [Carver, T.; Christov, A.; Montaruli, T.] Univ Geneva, Dept Phys Nucl & Corpusculaire, CH-1211 Geneva, Switzerland. [De Ridder, S.; Ismail, A. Haj; Labare, M.; Meli, A.; Ryckbosch, D.; Vanheule, S.; Vraeghe, M.] Univ Ghent, Dept Phys & Astron, B-9000 Ghent, Belgium. [Barwick, S. W.; Yodh, G.] Univ Calif Irvine, Dept Phys & Astron, Irvine, CA 92697 USA. [Besson, D. Z.] Univ Kansas, Dept Phys & Astron, Lawrence, KS 66045 USA. [Gallagher, J.] Univ Wisconsin, Dept Astron, Madison, WI 53706 USA. [Ahlers, M.; Braun, J.; Chirkin, D.; Day, M.; Desiati, P.; Diaz-Velez, J. C.; Fahey, S.; Feintzeig, J.; Ghorbani, K.; Gladstone, L.; Griffith, Z.; Halzen, F.; Hanson, K.; Hoshina, K.; Jero, K.; Karle, A.; Kauer, M.; Kelley, J. L.; Kheirandish, A.; Krueger, C.; Mancina, S.; McNally, F.; Merino, G.; Sabbatini, L.; Tobin, M. N.; Tosi, D.; Vandenbroucke, J.; van Rossem, M.; Wandkowsky, N.; Wendt, C.; Westerhoff, S.; Wille, L.; Xu, D. L.] Univ Wisconsin, Dept Phys, Madison, WI 53706 USA. [Ahlers, M.; Braun, J.; Chirkin, D.; Day, M.; Desiati, P.; Diaz-Velez, J. C.; Fahey, S.; Feintzeig, J.; Ghorbani, K.; Gladstone, L.; Griffith, Z.; Halzen, F.; Hanson, K.; Hoshina, K.; Jero, K.; Karle, A.; Kauer, M.; Kelley, J. L.; Kheirandish, A.; Krueger, C.; Mancina, S.; McNally, F.; Merino, G.; Sabbatini, L.; Tobin, M. N.; Tosi, D.; Vandenbroucke, J.; van Rossem, M.; Wandkowsky, N.; Wendt, C.; Westerhoff, S.; Wille, L.; Xu, D. L.] Univ Wisconsin, Wisconsin IceCube Particle Astrophys, Madison, WI 53706 USA. [Archinger, M.; Baum, V.; Boeser, S.; Rosendo, E. del Pino; di Lorenzo, V.; Eberhardt, B.; Ehrhardt, T.; Foesig, C. -C.; Koepke, L.; Krueckl, G.; Sandroos, J.; Steuer, A.; Wiebe, K.] Johannes Gutenberg Univ Mainz, Inst Phys, Staudinger Weg 7, D-55099 Mainz, Germany. [Andeen, K.; Berghaus, P.] Marquette Univ, Dept Phys, Milwaukee, WI 53201 USA. [Kohnen, G.] Univ Mons, B-7000 Mons, Belgium. [Berghaus, P.] Natl Res Nucl Univ MEPhI Moscow Engn Phys Inst, Moscow 115409, Russia. [Abraham, K.; Bernhard, A.; Coenders, S.; Holzapfel, K.; Huber, M.; Jurkovic, M.; Krings, K.; Resconi, E.; Turcati, A.; Veenkamp, J.] Tech Univ Munich, Phys Dept, D-85748 Garching, Germany. [Classen, L.; Kappes, A.] Westfalische Wilhelms Univ Munster, Inst Kern Phys, D-48149 Munster, Germany. [Dembinski, H.; Evenson, P. A.; Gaisser, T. K.; Gonzalez, J. G.; Koirala, R.; Pandya, H.; Seckel, D.; Stanev, T.; Tilav, S.] Univ Delaware, Bartol Res Inst, Newark, DE 19716 USA. [Dembinski, H.; Evenson, P. A.; Gaisser, T. K.; Gonzalez, J. G.; Koirala, R.; Pandya, H.; Seckel, D.; Stanev, T.; Tilav, S.] Univ Delaware, Dept Phys & Astron, Newark, DE 19716 USA. [Maruyama, R.] Yale Univ, Dept Phys, New Haven, CT 06520 USA. [Sarkar, S.] Univ Oxford, Dept Phys, 1 Keble Rd, Oxford OX1 3NP, England. [Kurahashi, N.; Relethford, B.; Richman, M.; Wills, L.] Drexel Univ, Dept Phys, 3141 Chestnut St, Philadelphia, PA 19104 USA. [Bai, X.] South Dakota Sch Mines & Technol, Phys Dept, Rapid City, SD 57701 USA. [Madsen, J.; Seunarine, S.; Spiczak, G. M.] Univ Wisconsin, Dept Phys, River Falls, WI 54022 USA. [Ahrens, M.; Bohm, C.; Dumm, J. P.; Finley, C.; Flis, S.; Hultqvist, K.; Walck, C.; Wolf, M.; Zoll, M.] Stockholm Univ, Oskar Klein Ctr, SE-10691 Stockholm, Sweden. [Ahrens, M.; Bohm, C.; Dumm, J. P.; Finley, C.; Flis, S.; Hultqvist, K.; Walck, C.; Wolf, M.; Zoll, M.] Stockholm Univ, Dept Phys, SE-10691 Stockholm, Sweden. [Kiryluk, J.; Lesiak-Bzdak, M.; Niederhausen, H.; Xu, Y.] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Bose, D.; Dujmovic, H.; In, S.; Jeong, M.; Kim, M.; Rott, C.] Sungkyunkwan Univ, Dept Phys, Suwon 440746, South Korea. [Clark, K.] Univ Toronto, Dept Phys, Toronto, ON M5S 1A7, Canada. [Palczewski, T.; Pepper, J. A.; Toale, P. A.; Williams, D. R.] Univ Alabama, Dept Phys & Astron, Tuscaloosa, AL 35487 USA. [Cowen, D. F.] Penn State Univ, Dept Phys & Astron, University Pk, PA 16802 USA. [Anderson, T.; Cowen, D. F.; Dunkman, M.; Eller, P.; Huang, F.; Keivani, A.; Lanfranchi, J. L.; Pankova, D. V.; Quinnan, M.; Tesic, G.; Weiss, M. J.] Penn State Univ, Dept Phys, University Pk, PA 16802 USA. [BenZvi, S.; Cross, R.] Univ Rochester, Dept Phys & Astron, Rochester, NY 14627 USA. [Botner, O.; Burgman, A.; Euler, S.; Hallgren, A.; de los Heros, C. Perez; Stroem, R.; Taavola, H.; Unger, E.] Uppsala Univ, Dept Phys & Astron, Box 516, S-75120 Uppsala, Sweden. [Becker, K. -H.; Bindig, D.; Helbing, K.; Hickford, S.; Hoffmann, R.; Kopper, S.; Lauber, F.; Naumann, U.; Pollmann, A. Obertacke; Soldin, D.] Univ Wuppertal, Dept Phys, D-42119 Wuppertal, Germany. [Ackermann, M.; Bernardini, E.; Blot, S.; Bretz, H. -P.; Franckowiak, A.; Gluesenkamp, T.; Jacobi, E.; Karg, T.; Kintscher, T.; Kowalski, M.; Kunwar, S.; Mohrmann, L.; Nahnhauer, R.; Satalecka, K.; Spiering, C.; Stasik, A.; Stoessl, A.; Strotjohann, N. L.; Terliuk, A.; Usner, M.; van Santen, J.; Yanez, J. P.] DESY, D-15735 Zeuthen, Germany. [Hoshina, K.] Univ Tokyo, Earthquake Res Inst, Bunkyo Ku, Tokyo 1130032, Japan. RP Ishihara, A (reprint author), Chiba Univ, Dept Phys, Chiba 2638522, Japan.; Ishihara, A (reprint author), Chiba Univ, Inst Global Prominent Res, Chiba 2638522, Japan. EM aya@hepburn.s.chiba-u.ac.jp RI Maruyama, Reina/A-1064-2013; Anton, Gisela/C-4840-2013; Wiebusch, Christopher/G-6490-2012; Sarkar, Subir/G-5978-2011; Koskinen, David/G-3236-2014; Beatty, James/D-9310-2011 OI Maruyama, Reina/0000-0003-2794-512X; Anton, Gisela/0000-0003-2039-4724; Wiebusch, Christopher/0000-0002-6418-3008; Sarkar, Subir/0000-0002-3542-858X; Koskinen, David/0000-0002-0514-5917; Beatty, James/0000-0003-0481-4952 FU U. S. National Science Foundation-Office of Polar Programs; U. S. National Science Foundation-Physics Division; University of Wisconsin Alumni Research Foundation; Grid Laboratory Of Wisconsin (GLOW); Open Science Grid (OSG); U. S. Department of Energy; National Energy Research Scientific Computing Center; Louisiana Optical Network Initiative (LONI); Natural Sciences and Engineering Research Council of Canada; WestGrid and Compute/Calcul Canada; Swedish Research Council; Swedish Polar Research Secretariat; Swedish National Infrastructure for Computing (SNIC); Knut and Alice Wallenberg Foundation, Sweden; German Ministry for Education and Research (BMBF); Deutsche Forschungsgemeinschaft (DFG); Helmholtz Alliance for Astroparticle Physics (HAP); Research Department of Plasmas with Complex Interactions (Bochum), Germany; Fund for Scientific Research (FNRS-FWO); FWO Odysseus programme; Flanders Institute to encourage scientific and technological research in industry (IWT); Belgian Federal Science Policy Office (Belspo); University of Oxford, United Kingdom; Marsden Fund, New Zealand; Australian Research Council; Japan Society for Promotion of Science (JSPS); Swiss National Science Foundation (SNSF), Switzerland; National Research Foundation of Korea (NRF); Villum Fonden, Danish National Research Foundation (DNRF), Denmark FX We acknowledge the support from the following agencies: U. S. National Science Foundation-Office of Polar Programs, U. S. National Science Foundation-Physics Division, University of Wisconsin Alumni Research Foundation, the Grid Laboratory Of Wisconsin (GLOW) grid infrastructure at the University of Wisconsin-Madison, the Open Science Grid (OSG) grid infrastructure; U. S. Department of Energy, and National Energy Research Scientific Computing Center, the Louisiana Optical Network Initiative (LONI) grid computing resources; Natural Sciences and Engineering Research Council of Canada, WestGrid and Compute/Calcul Canada; Swedish Research Council, Swedish Polar Research Secretariat, Swedish National Infrastructure for Computing (SNIC), and Knut and Alice Wallenberg Foundation, Sweden; German Ministry for Education and Research (BMBF), Deutsche Forschungsgemeinschaft (DFG), Helmholtz Alliance for Astroparticle Physics (HAP), Research Department of Plasmas with Complex Interactions (Bochum), Germany; Fund for Scientific Research (FNRS-FWO), FWO Odysseus programme, Flanders Institute to encourage scientific and technological research in industry (IWT), Belgian Federal Science Policy Office (Belspo); University of Oxford, United Kingdom; Marsden Fund, New Zealand; Australian Research Council; Japan Society for Promotion of Science (JSPS); the Swiss National Science Foundation (SNSF), Switzerland; National Research Foundation of Korea (NRF); Villum Fonden, Danish National Research Foundation (DNRF), Denmark. NR 96 TC 4 Z9 4 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 7 PY 2016 VL 117 IS 24 AR 241101 DI 10.1103/PhysRevLett.117.241101 PG 9 WC Physics, Multidisciplinary SC Physics GA EE3PY UT WOS:000389507000004 PM 28009216 ER PT J AU Antonius, G Louie, SG AF Antonius, Gabriel Louie, Steven G. TI Temperature-Induced Topological Phase Transitions: Promoted versus Suppressed Nontrivial Topology SO PHYSICAL REVIEW LETTERS LA English DT Article ID FUNCTIONAL PERTURBATION-THEORY; CRYSTALLINE INSULATOR; SPIN TEXTURE; DIRECT-GAP; DEPENDENCE; INVERSION; SOLIDS AB Contrary to previous two-band model studies which find increasing temperature would induce a topological phase transition, we show here through first-principles calculations that the opposite is also realizable, depending on the material's full band structure and symmetry of the electron-phonon coupling potential. This finding explains recent experimental results by Wojek et al. [Nat. Commun. 6, 8463 (2015)]. We show that the topological phase diagram of BiTldS(1-delta)Sed(delta))(2) as a function of doping and temperature contains two distinct regions with nontrivial topology. In BiTlS2, the phonons promote the topological phase at high temperature, while in BiTlSe2, the system is driven back into the trivial phase. C1 [Antonius, Gabriel] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. Lawrence Berkeley Natl Lab, Div Mat Sci, Berkeley, CA 94720 USA. RP Antonius, G (reprint author), Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. EM antonius@lbl.gov FU National Science Foundation [DMR-1508412, 787 ACI-1053575]; Center for Computational Study of Excited State Phenomena in Energy Materials - U.S. Department of Energy, Office of Basic Energy' Sciences [DE-AC02-05CH11231]; Office of Science of the U.S. Department of Energy [DE-AC02-05CH11231]; Extreme Science and Engineering Discovery Environment (XSEDE) FX G. Antonius acknowledges fruitful discussions with Ion Garate and Kush Saha. This research was supported by the National Science Foundation under Grant No. DMR-1508412, which provided for basic theory and formalism, and by the Center for Computational Study of Excited State Phenomena in Energy Materials funded by the U.S. Department of Energy, Office of Basic Energy' Sciences, under Contract No. DE-AC02-05CH11231 at Lawrence Berkeley National Laboratory, which provided for algorithm and code developments and simulations. The computational resources were provided by the National Energy Research Scientific Computing Center (NERSC); a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231; and the Extreme Science and Engineering Discovery Environment (XSEDE); which is supported by National Science Foundation Grant No. 787 ACI-1053575. NR 40 TC 1 Z9 1 U1 14 U2 14 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 7 PY 2016 VL 117 IS 24 AR 246401 DI 10.1103/PhysRevLett.117.246401 PG 6 WC Physics, Multidisciplinary SC Physics GA EE3PY UT WOS:000389507000011 PM 28009189 ER PT J AU Olson, RE Leeper, RJ Kline, JL Zylstra, AB Yi, SA Biener, J Braun, T Kozioziemski, BJ Sater, JD Bradley, PA Peterson, RR Haines, BM Yin, L Hopkins, LFB Meezan, NB Walters, C Biener, MM Kong, C Crippen, JW Kyrala, GA Shah, RC Herrmann, HW Wilson, DC Hamza, AV Nikroo, A Batha, SH AF Olson, R. E. Leeper, R. J. Kline, J. L. Zylstra, A. B. Yi, S. A. Biener, J. Braun, T. Kozioziemski, B. J. Sater, J. D. Bradley, P. A. Peterson, R. R. Haines, B. M. Yin, L. Hopkins, L. F. Berzak Meezan, N. B. Walters, C. Biener, M. M. Kong, C. Crippen, J. W. Kyrala, G. A. Shah, R. C. Herrmann, H. W. Wilson, D. C. Hamza, A. V. Nikroo, A. Batha, S. H. TI First Liquid Layer Inertial Confinement Fusion Implosions at the National Ignition Facility SO PHYSICAL REVIEW LETTERS LA English DT Article AB The first cryogenic deuterium and deuterium-tritium liquid layer implosions at the National Ignition Facility (NIF) demonstrate D-2 and DT layer inertial confinement fusion (ICF) implosions that can access a low-to-moderate hot-spot convergence ratio (12 < CR < 25). Previous ICF experiments at the NIF utilized high convergence (CR > 30) DT ice layer implosions. Although high CR is desirable in an idealized 1D sense, it amplifies the deleterious effects of asymmetries. To date, these asymmetries prevented the achievement of ignition at the NIF and are the major cause of simulation-experiment disagreement. In the initial liquid layer experiments, high neutron yields were achieved with CRs of 12-17, and the hot-spot formation is well understood, demonstrated by a good agreement between the experimental data and the radiation hydrodynamic simulations. These initial experiments open a new NIF experimental capability that provides an opportunity to explore the relationship between hot-spot convergence ratio and the robustness of hot-spot formation during ICF implosions. C1 [Olson, R. E.; Leeper, R. J.; Kline, J. L.; Zylstra, A. B.; Yi, S. A.; Bradley, P. A.; Peterson, R. R.; Haines, B. M.; Yin, L.; Kyrala, G. A.; Shah, R. C.; Herrmann, H. W.; Wilson, D. C.; Batha, S. H.] LANL, Los Alamos, NM 87185 USA. [Biener, J.; Braun, T.; Kozioziemski, B. J.; Sater, J. D.; Hopkins, L. F. Berzak; Meezan, N. B.; Walters, C.; Biener, M. M.; Hamza, A. V.; Nikroo, A.] LLNL, Livermore, CA 94551 USA. [Kong, C.; Crippen, J. W.] GA, San Diego, CA 92186 USA. RP Olson, RE (reprint author), LANL, Los Alamos, NM 87185 USA. FU U. S. Department of Energy by LANL [DE-AC52-06NA25396]; LLNL [DE-AC52-07NA27344]; GA [DE-NA0001808] FX We thank S. Khan, T. Ma, R. Benedetti, and N. Izumi (LLNL) for the x-ray shape analysis; C. Yeamans, D. Sayre, and R. Hatarik (LLNL) and M. Gatu Johnson (MIT) for the neutron analysis; F. Merrill (LANL) for the neutron image analysis; N. Rice and H. Huang (GA) for capsule and foam layer characterization; and the NIF operations, laser, target fabrication, and diagnostic teams for their efforts during these experiments. This work was performed under the auspices of the U. S. Department of Energy by LANL under Contract No. DE-AC52-06NA25396, by LLNL under Contract No. DE-AC52-07NA27344, and by GA under Contract No. DE-NA0001808. NR 23 TC 0 Z9 0 U1 15 U2 15 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 7 PY 2016 VL 117 IS 24 AR 245001 DI 10.1103/PhysRevLett.117.245001 PG 5 WC Physics, Multidisciplinary SC Physics GA EE3PY UT WOS:000389507000007 PM 28009190 ER PT J AU Ishihara, H Chen, YC De Marco, N Lin, O Huang, CM Limsakoune, V Chou, YC Yang, Y Tung, V AF Ishihara, Hidetaka Chen, Yen-Chang De Marco, Nicholas Lin, Oliver Huang, Chih-Meng Limsakoune, Vipawee Chou, Yi-Chia Yang, Yang Tung, Vincent TI Electrohydrodynamic-assisted Assembly of Hierarchically Structured, 3D Crumpled Nanostructures for Efficient Solar Conversions SO SCIENTIFIC REPORTS LA English DT Article ID FLUORESCENCE QUENCHING MICROSCOPY; CHEMICAL-VAPOR-DEPOSITION; GRAPHENE OXIDE; HIGH-PERFORMANCE; SUPERCAPACITORS; ENERGY; ELECTRODES; CAPACITORS; ARRAYS; FILMS AB The tantalizing prospect of harnessing the unique properties of graphene crumpled nanostructures continues to fuel tremendous interest in energy storage and harvesting applications. However, the paper ball-like, hard texture, and closed-sphere morphology of current 3D graphitic nanostructure production not only constricts the conductive pathways but also limits the accessible surface area. Here, we report new insights into electrohydrodynamically-generated droplets as colloidal nanoreactors in that the stimuli-responsive nature of reduced graphene oxide can lead to the formation of crumpled nanostructures with a combination of open structures and doubly curved, saddle-shaped edges. In particular, the crumpled nanostructures dynamically adapt to non-spherical, polyhedral shapes under continuous deposition, ultimately assembling into foam-like microstructures with a highly accessible surface area and spatially interconnected transport pathways. The implementation of such crumpled nanostructures as three-dimensional rear contacts for solar conversion applications realize benefits of a high aspect ratio, electrically addressable and energetically favorable interfaces, and substantial enhancement of both short-circuit currents and fill-factors compared to those made of planar graphene counterparts. Further, the 3D crumpled nanostructures may shed lights onto the development of effective electrocatalytic electrodes due to their open structure that simultaneously allows for efficient water flow and hydrogen escape. C1 [Ishihara, Hidetaka; Chen, Yen-Chang; De Marco, Nicholas; Limsakoune, Vipawee; Tung, Vincent] Univ Calif, Sch Engn, Merced, CA 95343 USA. [Chen, Yen-Chang; Lin, Oliver] Lawrence Berkeley Natl Lab, Mol Foundry, Berkeley, CA 94720 USA. [Huang, Chih-Meng; Chou, Yi-Chia] Natl Chiao Tung Univ, Dept Electrophys, Hsinchu, Taiwan. [Yang, Yang] Univ Calif Los Angeles, Dept Mat Sci & Engn, Los Angeles, CA 90095 USA. [Yang, Yang] Calif NanoSyst Inst, Los Angeles, CA 90095 USA. RP Tung, V (reprint author), Univ Calif, Sch Engn, Merced, CA 95343 USA. EM vtung@lbl.gov FU Doctoral New Investigator Award from ACS Petroleum Fund [ACS PRF 54717-DNI10]; Ministry of Science and Technology of Taiwan [NSC 101-2112-M-009-021-MY3]; Center for Interdisciplinary Science under the MOE-ATU project for NCTU; Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231, 3192, 3715]; NASA MIRO Center [NNX15AQ01A] FX The authors gratefully acknowledge the research award from the Doctoral New Investigator Award from ACS Petroleum Fund (ACS PRF 54717-DNI10, V.T.), Ministry of Science and Technology of Taiwan (NSC 101-2112-M-009-021-MY3, Y.C.C.) and the Center for Interdisciplinary Science under the MOE-ATU project for NCTU (Y.C.C.). Characterization and fabrication of ultracapacitor in this work were performed as a user project (#3192 and #3715) at the Molecular Foundry, Lawrence Berkeley National Lab, supported by the Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. Y.C would like to acknowledge the fellowship from NASA MIRO Center under Contract No. NNX15AQ01A. V.T. is indebted to Professor Jiaxing Huang, and Dr. Alexander Baron Smith at Northwestern University for the help on instrumental support, Dr. Chun Tang for modeling work, Dr. Ziruo Hong and Huajun Chen at UCLA for the assistance on UPS characterization. Teresa L. Chen and Daniel Sun for the fruitful discussion in droplet dynamics and assistance in instrumentation. NR 50 TC 0 Z9 0 U1 15 U2 15 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 7 PY 2016 VL 6 AR 38701 DI 10.1038/srep38701 PG 11 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE6VJ UT WOS:000389750600001 PM 27924857 ER PT J AU Handunkanda, SU Occhialini, CA Said, AH Hancock, JN AF Handunkanda, Sahan U. Occhialini, Connor A. Said, Ayman H. Hancock, Jason N. TI Two-dimensional nanoscale correlations in the strong negative thermal expansion material ScF3 SO PHYSICAL REVIEW B LA English DT Article ID RIGID-UNIT MODES; PHASE-TRANSITIONS; CUBIC SCF3; LATTICES AB We present diffuse x-ray scattering data on the strong negative thermal expansion (NTE) material ScF3 and find that two-dimensional nanoscale correlations exist at momentum-space regions associated with possibly rigid rotations of the perovskite octahedra. We address the extent to which rigid octahedral motion describes the dynamical fluctuations behind NTE by generalizing a simple model supporting a single floppy mode that is often used to heuristically describe instances of NTE. We find this model has tendencies toward dynamic inhomogeneities and its application to recent and existing experimental data suggest an intricate link between the nanometer correlation length scale, the energy scale for octahedral tilt fluctuations, and the coefficient of thermal expansion in ScF3. We then investigate the breakdown of the rigid limit and propose a resolution to an outstanding debate concerning the role of molecular rigidity in strong NTE materials. C1 [Handunkanda, Sahan U.; Occhialini, Connor A.; Hancock, Jason N.] Univ Connecticut, Dept Phys, Storrs, CT 06269 USA. [Handunkanda, Sahan U.; Hancock, Jason N.] Univ Connecticut, Inst Mat Sci, Storrs, CT 06269 USA. [Said, Ayman H.] Argonne Natl Lab, Adv Photon Source, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Hancock, JN (reprint author), Univ Connecticut, Dept Phys, Storrs, CT 06269 USA.; Hancock, JN (reprint author), Univ Connecticut, Inst Mat Sci, Storrs, CT 06269 USA. EM jason.hancock@uconn.edu FU National Science Foundation [DMR-1506825]; U.S. Department of Energy, Office of Basic Energy Sciences [DE-AC02-06CH11357]; NSF [DMR-0115852]; Treibic family scholarship FX The authors would like to acknowledge valuable conversations with Richard Brierley, Joshua Deutsch, Gian Guzman-Verri, and Peter Littlewood. Support for this project was provided by National Science Foundation Award No. DMR-1506825. Work at Argonne National Laboratory is supported by the U.S. Department of Energy, Office of Basic Energy Sciences under Contract No. DE-AC02-06CH11357. The construction of HERIX was partially supported by the NSF under Grant No. DMR-0115852. C.A.O. acknowledges support from the Treibic family scholarship, managed by the Office of Undergraduate Research at the University of Connecticut. NR 30 TC 1 Z9 1 U1 17 U2 17 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 7 PY 2016 VL 94 IS 21 AR 214102 DI 10.1103/PhysRevB.94.214102 PG 6 WC Physics, Condensed Matter SC Physics GA EE3OQ UT WOS:000389501200001 ER PT J AU Li, B Louca, D Niedziela, J Li, ZY Zhang, LB Zhou, JS Goodenough, JB AF Li, Bing Louca, Despina Niedziela, Jennifer Li, Zongyao Zhang, Libin Zhou, Jianshi Goodenough, John B. TI Lattice and magnetic dynamics in perovskite Y1-xLaxTiO3 SO PHYSICAL REVIEW B LA English DT Article ID NEUTRON-DIFFRACTION; ORBITAL PHYSICS; LATIO3; YTIO3; TRANSITION; SCATTERING; DISTORTION; INSULATOR; SYSTEMS; OXIDES AB Inelastic neutron scattering combined with the dynamic pair density function (DPDF) analysis were used to investigate the magnetic and lattice dynamics in the orbitally active Y1-xLaxTiO3 as it crosses the antiferromagnetic (AFM) to ferromagnetic (FM) phase boundary. Upon doping, the FM state present in YTiO3 is suppressed on approaching a critical concentration of x(c) similar to 0.3 in which T-C similar or equal to 0, and is replaced by the AFM phase of LaTiO3. Below x(c), magnetic scattering from spin waves is dominant at low energies. At x(c) with a T-C similar or equal to 0, magnetic scattering is also observed and is most likely due to AFM fluctuations. At the same time, local atomic fluctuations extending to 50 meV are observed above and below the magnetic transitions from 0 <= x <= 1 that show distinct characteristics with x. From Y to La, a clear difference is observed in the phonon density of states as a function of doping as well. At x = 0.15 and 0.3, low-energy modes involving predominantly the rare-earth ion become suppressed with increasing temperature, while in x = 1, strong suppression of phonon modes across a wide range in energy is observed above T-N. It is likely that in the Y heavy samples, phonon modes below 20 meV have a stronger influence on the orbital excitations, while in LaTiO3, a strong phonon dependence is observed upon cooling up to T-N. C1 [Li, Bing; Louca, Despina] Univ Virginia, Dept Phys, Charlottesville, VA 22904 USA. [Niedziela, Jennifer] Oak Ridge Natl Lab, Spallat Neutron Source, Oak Ridge, TN 37831 USA. [Li, Zongyao; Zhang, Libin; Zhou, Jianshi; Goodenough, John B.] Univ Texas Austin, Mech Engn, Mat Sci & Engn Program, Austin, TX 78712 USA. RP Louca, D (reprint author), Univ Virginia, Dept Phys, Charlottesville, VA 22904 USA. EM louca@virginia.edu RI Li, Bing /A-4610-2010 FU Department of Energy [DE-FG02-01ER45927]; National Science Foundation [DMR1122603]; Major Research Instrument Grant [DMR-1229131] FX This work has been supported by the Department of Energy, Grant No. DE-FG02-01ER45927 and the National Science Foundation, Grant No. DMR1122603 and Major Research Instrument Grant No. DMR-1229131. NR 44 TC 0 Z9 0 U1 14 U2 14 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 7 PY 2016 VL 94 IS 22 AR 224301 DI 10.1103/PhysRevB.94.224301 PG 7 WC Physics, Condensed Matter SC Physics GA EE3OW UT WOS:000389502500002 ER PT J AU Pathak, AK Paudyal, D Mudryk, Y Gschneidner, KA Pecharsky, VK AF Pathak, Arjun K. Paudyal, D. Mudryk, Y. Gschneidner, K. A., Jr. Pecharsky, V. K. TI Tunable magnetism and structural transformations in mixed light- and heavy-lanthanide dialuminides SO PHYSICAL REVIEW B LA English DT Article AB Rare-earth intermetallics play a critical yet often obscure role in numerous technological applications, including sensors, actuators, permanent magnets, and rechargeable batteries; therefore, understanding their basic science is of utmost importance. Here we report structural behaviors, specific heat, and magnetism of Pr1-xErxAl2 studied by means of temperature-dependent x-ray powder diffraction, heat capacity, and magnetization measurements, in addition to first-principles calculations. Although the cubic lattice of PrAl2 distorts tetragonally at the Curie temperature T-C, the distortion is rhombohedral in ErAl2, creating a potential for instability in the pseudobinary PrAl2-ErAl2 system. When 0.05 <= x <= 0.5, materials show complex magnetization behaviors, including metamagnetic transitions and Griffith-like phase. Unique among other mixed-lanthanide dialuminides, the substitution of Er for Pr in Pr1-xErxAl2 results in unexpected ferrimagnetic behavior, and the ferrimagnetic interactions become strongest around x = 0.25, where the compound shows unusual metamagnetic like transitions observed only in the odd-numbered quadrants of the full magnetic field cycles. The electronic structure calculations, including exchange interactions and crystal field splitting, magnetic moments, anisotropic 4f energy density, and magnetic surface potentials rationalize the interesting physics observed experimentally. C1 [Pathak, Arjun K.; Paudyal, D.; Mudryk, Y.; Gschneidner, K. A., Jr.; Pecharsky, V. K.] Iowa State Univ, Ames Lab, US Dept Energy, Ames, IA 50011 USA. [Gschneidner, K. A., Jr.; Pecharsky, V. K.] Iowa State Univ, Dept Mat Sci & Engn, Ames, IA 50011 USA. RP Pathak, AK (reprint author), Iowa State Univ, Ames Lab, US Dept Energy, Ames, IA 50011 USA. EM pathak138@ameslab.gov FU U.S. Department of Energy by Iowa State University of Science and Technology [DE-AC02-07CH11358]; Department of Energy, Office of Basic Energy Sciences, Materials Sciences Division FX The Ames Laboratory is operated for the U.S. Department of Energy by Iowa State University of Science and Technology under Contract No. DE-AC02-07CH11358. This work was supported by the Department of Energy, Office of Basic Energy Sciences, Materials Sciences Division. NR 29 TC 0 Z9 0 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 7 PY 2016 VL 94 IS 22 AR 224406 DI 10.1103/PhysRevB.94.224406 PG 10 WC Physics, Condensed Matter SC Physics GA EE3OW UT WOS:000389502500003 ER PT J AU Tian, W Cao, H Wang, J Ye, F Matsuda, M Yan, JQ Liu, Y Garlea, VO Agrawal, HK Chakoumakos, BC Sales, BC Fishman, RS Fernandez-Baca, JA AF Tian, W. Cao, Huibo Wang, Jincheng Ye, Feng Matsuda, M. Yan, J. -Q. Liu, Yaohua Garlea, V. O. Agrawal, Harish K. Chakoumakos, B. C. Sales, B. C. Fishman, Randy S. Fernandez-Baca, J. A. TI Spin-lattice coupling mediated multiferroicity in (ND4)(2)FeCl5 center dot D2O SO PHYSICAL REVIEW B LA English DT Article ID FERROELECTRICITY; ANTIFERROMAGNETS; POLARIZATION; BEHAVIOR AB We report a neutron diffraction study of the multiferroic mechanism in (ND4)(2)FeCl5 center dot D2O, a molecular compound that exhibits magnetically induced ferroelectricity. This material exhibits two successive magnetic transitions on cooling: a long-range order transition to an incommensurate (IC) collinear sinusoidal spin state at T-N = 7.3 K, followed by a second transition to an IC cycloidal spin state at T-FE = 6.8 K, the latter of which is accompanied by spontaneous ferroelectric polarization. The cycloid structure is strongly distorted by spin-lattice coupling, as evidenced by the observations of both odd and even higher-order harmonics associated with the cycloid wave vector, and a weak commensurate phase that coexists with the IC phase. The second-order harmonic appears at TFE, thereby providing unambiguous evidence that the onset of the electric polarization is accompanied by a lattice modulation due to spin-lattice interaction. The neutron results, in conjunction with the negative thermal expansion and large magnetostriction observed in Ref. [19], indicate that spin-lattice coupling plays a critical role in the ferroelectric mechanism of (ND4)(2)FeCl5 center dot D2O. C1 [Tian, W.; Cao, Huibo; Wang, Jincheng; Ye, Feng; Matsuda, M.; Liu, Yaohua; Garlea, V. O.; Chakoumakos, B. C.; Fernandez-Baca, J. A.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Yan, J. -Q.; Sales, B. C.; Fishman, Randy S.] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Agrawal, Harish K.] Oak Ridge Natl Lab, Instrument & Source Div, Oak Ridge, TN 37831 USA. [Fernandez-Baca, J. A.] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA. RP Tian, W (reprint author), Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. EM wt6@ornl.gov RI Liu, Yaohua/B-2529-2009; SNS, Corelli/O-8443-2015; Matsuda, Masaaki/A-6902-2016 OI Liu, Yaohua/0000-0002-5867-5065; SNS, Corelli/0000-0001-5563-3292; Matsuda, Masaaki/0000-0003-2209-9526 FU Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy; Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division FX The research work at ORNL's High Flux Isotope Reactor and Spallation Neutron Source was sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy. J.Q.Y., B.C.S., and R.S.F. were supported by the Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. NR 34 TC 0 Z9 0 U1 4 U2 4 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 7 PY 2016 VL 94 IS 21 AR 214405 DI 10.1103/PhysRevB.94.214405 PG 6 WC Physics, Condensed Matter SC Physics GA EE3OQ UT WOS:000389501200003 ER PT J AU Zou, T Cai, YQ dela Cruz, CR Garlea, VO Mahanti, SD Cheng, JG Ke, X AF Zou, T. Cai, Y. -Q. dela Cruz, C. R. Garlea, V. O. Mahanti, S. D. Cheng, J. -G. Ke, X. TI Up-up-down-down magnetic chain structure of the spin-1/2 tetragonally distorted spinel GeCu2O4 SO PHYSICAL REVIEW B LA English DT Article ID GEOMETRICALLY FRUSTRATED ANTIFERROMAGNET; ANISOTROPIC SUPEREXCHANGE; GENI2O4; GECO2O4 AB GeCu2O4 spinel exhibits a tetragonal structure due to the strong Jahn-Teller distortion associated with Cu2+ ions. We show that its magnetic structure can be described as slabs composed of a pair of layers with orthogonally oriented spin-1/2 Cu chains in the basal ab plane. The spins between the two layers within a slab are collinearly aligned while the spin directions of neighboring slabs are perpendicular to each other. Interestingly, we find that spins along each chain form an unusual up-up-down-down (UUDD) pattern, suggesting a non-negligible nearest-neighbor biquadratic exchange interaction in the effective classical spin Hamiltonian. We hypothesize that spin-orbit coupling and orbital mixing of Cu2+ ions in this system are non-negligible, which calls for future calculations using perturbation theory with extended Hilbert (spin and orbital) space and calculations based on density functional theory including spin-orbit coupling and looking at the global stability of the UUDD state. C1 [Zou, T.; Mahanti, S. D.; Ke, X.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Zou, T.; dela Cruz, C. R.; Garlea, V. O.] Oak Ridge Natl Lab, Quantum Condensed Matter Div, Oak Ridge, TN 37831 USA. [Cai, Y. -Q.; Cheng, J. -G.] Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Beijing 100190, Peoples R China. [Cai, Y. -Q.; Cheng, J. -G.] Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China. RP Ke, X (reprint author), Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. EM ke@pa.msu.edu RI Zou, Tao/A-1761-2013 OI Zou, Tao/0000-0002-6510-5749 FU Michigan State University; National Science Foundation [DMR-1608752]; NNSF of China [11304371, 11574377, 2014CB921500]; MOST of China [11304371, 11574377, 2014CB921500]; Strategic Priority Research Program of Frontier Sciences of the Chinese Academy of Sciences [XDB07020100]; Opening Project of Wuhan National High Magnetic Field Center, Huazhong University of Science and Technology [2015KF22]; Scientific User Facilities Division, Office of Basic Energy Sciences, DOE; Key Research Program of Frontier Sciences of the Chinese Academy of Sciences [XDB07020100] FX X.K. appreciates insightful discussion with Professor T. A. Kaplan and Professor G.-W. Chern. Work at Michigan State University was supported by the start-up funds from Michigan State University and by the National Science Foundation under Award No. DMR-1608752. J.G.C. acknowledges the support of the NNSF and MOST of China (Grants No. 11304371, No. 11574377, and No. 2014CB921500), the Strategic Priority Research Program and the Key Research Program of Frontier Sciences of the Chinese Academy of Sciences (Grant No. XDB07020100), and the Opening Project of Wuhan National High Magnetic Field Center (Grant No. 2015KF22), Huazhong University of Science and Technology. Work at ORNL was supported by the Scientific User Facilities Division, Office of Basic Energy Sciences, DOE. NR 30 TC 0 Z9 0 U1 9 U2 9 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 7 PY 2016 VL 94 IS 21 AR 214406 DI 10.1103/PhysRevB.94.214406 PG 6 WC Physics, Condensed Matter SC Physics GA EE3OQ UT WOS:000389501200004 ER PT J AU Xiong, CY Li, WL Ding, D Pu, J Chi, B Li, J AF Xiong, Chunyan Li, Wenlu Ding, Dong Pu, Jian Chi, Bo Li, Jian TI Chromium poisoning effect on strontium-doped samarium manganite for solid oxide fuel cell SO INTERNATIONAL JOURNAL OF HYDROGEN ENERGY LA English DT Article DE Solid oxide fuel cell; Cathode; Chromium poisoning; Durability; Strontium-doped samarium manganite ID OXYGEN REDUCTION REACTION; LAMNO3 ELECTRODES; CATHODE MATERIALS; TEMPERATURE; DEPOSITION; NONSTOICHIOMETRY; INTERCONNECT; ALLOY AB Strontium-doped samarium manganite is a potential cathode for solid oxide fuel cells (SOFCs) with remarkable high oxygen reduction reaction activity. Here we investigated chromium poisoning effect on Sm0.5Sr0.5MnO3 cathode of SOFCs for the first time. The Cr caused cathode degradation is studied under current density of 200 mA cm(-2) and open circuit potential (OCP) at 750 degrees C. After polarized in the presence of the Crofer22 APU at 750 degrees C for 1200 min, the polarization resistance decreases from 3.25 Omega cm(2) to 2.25 Omega cm(2), then increases to a stable value of 2.75 Omega cm(2). The degradation rate of SSM is lower than that of LSM cathode in the same experimental environment. At OCP, the polarization resistance increases to 7.00 Omega cm(2) and reaches a stable level. SEM and EDX shows the depositions on the Sm0.5Sr0.5MnO3 boundary after applying current for 1200 min, and on the SSM surface after aging at OCP for 200 h. The Cr depositions are mainly comprised of SrCrO4 formed by the nucleation reaction. The results show that SSM is a poisoning tolerant cathode and good replacement for the LSM in IT-SOFCs due to the better electrochemical performance and the relatively stable characteristics after Cr poisoning. (C) 2016 Published by Elsevier Ltd on behalf of Hydrogen Energy Publications LLC. C1 [Xiong, Chunyan; Pu, Jian; Chi, Bo; Li, Jian] Huazhong Univ Sci & Technol, State Key Lab Mat Proc & Die & Mould Technol, Sch Mat Sci & Engn, Ctr Fuel Cell Innovat, Wuhan 430074, Hubei, Peoples R China. [Li, Wenlu] Wuhan Univ Technol, Int Sch Mat Sci & Engn, Wuhan, Hubei, Peoples R China. [Ding, Dong] Idaho Natl Lab, POB 1625,MS 3732, Idaho Falls, ID 83415 USA. [Li, Jian] Huazhong Univ Sci & Technol Shenzhen, Res Inst, Shenzhen 518000, Guangdong, Peoples R China. RP Pu, J (reprint author), Huazhong Univ Sci & Technol, State Key Lab Mat Proc & Die & Mould Technol, Sch Mat Sci & Engn, Ctr Fuel Cell Innovat, Wuhan 430074, Hubei, Peoples R China. EM pujian@hust.edu.cn RI Ding, Dong/B-9145-2017 OI Ding, Dong/0000-0002-6921-4504 FU National Natural Science Foundation of China [51271083]; Guangdong Province [2013B090500051]; Shenzhen City [JCYJ20140419131733975]; Shandong Province [2015ZDXX0602A02] FX This research was financially supported by National Natural Science Foundation of China (51271083) and Guangdong Province (2013B090500051), Shenzhen City (JCYJ20140419131733975) and Shandong Province (2015ZDXX0602A02). The SEM characterizations were assisted by the Analytical and Testing Center of Huazhong University of Science and Technology. NR 27 TC 0 Z9 0 U1 6 U2 6 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 0360-3199 EI 1879-3487 J9 INT J HYDROGEN ENERG JI Int. J. Hydrog. Energy PD DEC 7 PY 2016 VL 41 IS 45 BP 20660 EP 20669 DI 10.1016/j.ijhydene.2016.07.061 PG 10 WC Chemistry, Physical; Electrochemistry; Energy & Fuels SC Chemistry; Electrochemistry; Energy & Fuels GA EB6VE UT WOS:000387522900024 ER PT J AU Manna, PK Skoropata, E Ting, YW Lin, KW Freeland, JW van Lierop, J AF Manna, P. K. Skoropata, E. Ting, Y-W Lin, K-W Freeland, J. W. van Lierop, J. TI Interface mixing and its impact on exchange coupling in exchange biased systems SO JOURNAL OF PHYSICS-CONDENSED MATTER LA English DT Article DE exchange bias; interlayer exchange coupling; interface mixing; x-ray absorption spectroscopy (XAS); x-ray magnetic circular dichroism (XMCD) ID DOMAIN STATE MODEL; RAY CIRCULAR-DICHROISM; RANDOM-FIELD MODEL; MAGNETIC-PROPERTIES; ANISOTROPY; PROBE AB Exchange bias and interlayer exchange coupling are interface driven phenomena. Since an ideal interface is very challenging to achieve, a clear understanding of the chemical and magnetic natures of interfaces is pivotal to identify their influence on the magnetism. We have chosen Ni80Fe20/CoO(t(CoO))/Co trilayers as a model system, and identified non-stoichiometric Ni-ferrite and Co-ferrite at the surface and interface, respectively. These ferrites, being ferrimagnets typically, should influence the exchange coupling. However, in our trilayers the interface ferrites were found not to be ferro-or ferri-magnetic; thus having no observable influence on the exchange coupling. Our analysis also revealed that (i) interlayer exchange coupling was present between Ni80Fe20 and Co even though the interlayer thickness was significantly larger than expected for this phenomenon to happen, and (ii) the majority of the CoO layer (except some portion near the interface) did not contribute to the observed exchange bias. We also identified that the interlayer exchange coupling and the exchange bias properties were not interdependent. C1 [Manna, P. K.; Skoropata, E.; van Lierop, J.] Univ Manitoba, Dept Phys & Astron, Winnipeg, MB R3T 2N2, Canada. [Ting, Y-W; Lin, K-W] Natl Chung Hsing Univ, Dept Mat Sci & Engn, Taichung 402, Taiwan. [Freeland, J. W.] Argonne Natl Lab, Adv Photon Source, Argonne, IL 60439 USA. RP Manna, PK (reprint author), Univ Manitoba, Dept Phys & Astron, Winnipeg, MB R3T 2N2, Canada. EM Palash.Manna@umanitoba.ca; Johan.van.Lierop@umanitoba.ca FU US Department of Energy [DE-AC02-06CH11357] FX The authors thank the Natural Sciences and Engineering Research Council of Canada, Canada Foundation for Innovation, and National Science Council of Taiwan. Use of the Advanced Photon Source at Argonne was supported by the US Department of Energy under contract DE-AC02-06CH11357. NR 69 TC 0 Z9 0 U1 15 U2 15 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0953-8984 EI 1361-648X J9 J PHYS-CONDENS MAT JI J. Phys.-Condes. Matter PD DEC 7 PY 2016 VL 28 IS 48 AR 486004 DI 10.1088/0953-8984/28/48/486004 PG 12 WC Physics, Condensed Matter SC Physics GA DZ5VA UT WOS:000385928600001 PM 27705957 ER PT J AU Opacic, M Lazarevic, N Radonjic, MM Scepanovic, M Ryu, H Wang, AF Tanaskovic, D Petrovic, C Popovic, ZV AF Opacic, M. Lazarevic, N. Radonjic, M. M. Scepanovic, M. Ryu, Hyejin Wang, Aifeng Tanaskovic, D. Petrovic, C. Popovic, Z. V. TI Raman spectroscopy of KxCo2-ySe2 single crystals near the ferromagnet-paramagnet transition SO JOURNAL OF PHYSICS-CONDENSED MATTER LA English DT Article DE Raman spectroscopy; electron-phonon; lattice dynamics ID TEMPERATURE-DEPENDENCE; PHONON; SUPERCONDUCTIVITY; CS AB Polarized Raman scattering spectra of the KxCo2-ySe2 single crystals reveal the presence of two phonon modes, assigned as of the A(1g) and B-1g symmetry. The absence of additional modes excludes the possibility of vacancy ordering, unlike in KxFe2-ySe2. The ferromagnetic (FM) phase transition at T-c approximate to 74 K leaves a clear fingerprint on the temperature dependence of the Raman mode energy and linewidth. For T > T-c the temperature dependence looks conventional, driven by the thermal expansion and anharmonicity. The Raman modes are rather broad due to the electron-phonon coupling increased by the disorder and spin fluctuation effects. In the FM phase the phonon frequency of both modes increases, while an opposite trend is seen in their linewidth: the A(1g) mode narrows in the FM phase, whereas the B-1g mode broadens. We argue that the large asymmetry and anomalous frequency shift of the B-1g mode is due to the coupling of spin fluctuations and vibration. Our density functional theory (DFT) calculations for the phonon frequencies agree rather well with the Raman measurements, with some discrepancy being expected since the DFT calculations neglect the spin fluctuations. C1 [Opacic, M.; Lazarevic, N.; Scepanovic, M.; Popovic, Z. V.] Univ Belgrade, Ctr Solid State Phys & New Mat, Inst Phys Belgrade, Pregrevica 118, Belgrade 11080, Serbia. [Radonjic, M. M.] Univ Augsburg, Ctr Elect Correlat & Magnetism, Inst Phys, Theoret Phys 3, D-86135 Augsburg, Germany. [Radonjic, M. M.; Tanaskovic, D.] Univ Belgrade, Inst Phys Belgrade, Comp Sci Lab, Pregrevica 118, Belgrade 11080, Serbia. [Ryu, Hyejin; Wang, Aifeng; Petrovic, C.] Brookhaven Natl Lab, Condensed Matter Phys & Mat Sci Dept, Upton, NY 11973 USA. [Ryu, Hyejin; Petrovic, C.] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Ryu, Hyejin] EO Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. RP Lazarevic, N (reprint author), Univ Belgrade, Ctr Solid State Phys & New Mat, Inst Phys Belgrade, Pregrevica 118, Belgrade 11080, Serbia. EM nenad.lazarevic@ipb.ac.rs FU Serbian Ministry of Education, Science and Technological Development [ON171032, III45018, ON171017]; European Commission [675121]; DAAD through the bilateral Serbian-German project (PPP Serbien) [56267076]; US DOE [DE-SC0012704]; Center for Emergent Superconductivity, an Energy Frontier Research Center - US DOE, Office for Basic Energy Science; Deutsche Forschungsgemeinschaft [Transregio TRR 80, FOR 1346] FX We gratefully acknowledge discussions with R Hackl. This work was supported by the Serbian Ministry of Education, Science and Technological Development under Projects ON171032, III45018 and ON171017, by the European Commission under H2020 project VI-SEEM, Grant No. 675121, as well as by the DAAD through the bilateral Serbian-German project (PPP Serbien, grant-no. 56267076) 'Interplay of Fe-vacancy ordering and spin fluctuations in iron-based high temperature superconductors'. Work at Brookhaven is supported by the US DOE under Contract No. DE-SC0012704 and in part by the Center for Emergent Superconductivity, an Energy Frontier Research Center funded by the US DOE, Office for Basic Energy Science (CP). Numerical simulations were run on the PARADOX supercomputing facility at the Scientific Computing Laboratory of the Institute of Physics Belgrade. MMR also acknowledges the support by the Deutsche Forschungsgemeinschaft through Transregio TRR 80 and Research Unit FOR 1346. NR 54 TC 0 Z9 0 U1 9 U2 9 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0953-8984 EI 1361-648X J9 J PHYS-CONDENS MAT JI J. Phys.-Condes. Matter PD DEC 7 PY 2016 VL 28 IS 48 AR 485401 DI 10.1088/0953-8984/28/48/485401 PG 8 WC Physics, Condensed Matter SC Physics GA DZ5UX UT WOS:000385928200001 PM 27705954 ER PT J AU Brosey, CA Ho, C Long, WZ Singh, S Burnett, K Hura, GL Nix, JC Bowman, GR Ellenberger, T Tainer, JA AF Brosey, Chris A. Ho, Chris Long, Winnie Z. Singh, Sukrit Burnett, Kathryn Hura, Greg L. Nix, Jay C. Bowman, Gregory R. Ellenberger, Tom Tainer, John A. TI Defining NADH-Driven Allostery Regulating Apoptosis-Inducing Factor SO STRUCTURE LA English DT Article ID SMALL-ANGLE SCATTERING; CELL-DEATH; OXIDATIVE-PHOSPHORYLATION; HIGH-THROUGHPUT; PROTEINS; BINDING; SAXS; AIF; PARTHANATOS; MUTATION AB Apoptosis-inducing factor (AIF) is critical for mitochondrial respiratory complex biogenesis and for mediating necroptotic parthanatos; these functions are seemingly regulated by enigmatic allosteric switching driven by NADH charge-transfer complex (CTC) formation. Here, we define molecular pathways linking AIF's active site to allosteric switching regions by characterizing dimer-permissive mutants using small-angle X-ray scattering (SAXS) and crystallography and by probing AIF-CTC communication networks using molecular dynamics simulations. Collective results identify two pathways propagating allostery from the CTC active site: (1) active-site H454 links to S480 of AIF's central beta-strand to modulate a hydrophobic border at the dimerization interface, and (2) an interaction network links AIF's FAD cofactor, central beta-strand, and C beta-clasp whereby R529 reorientation initiates C-loop release during CTC formation. This knowledge of AIF allostery and its flavoswitch mechanism provides a foundation for biologically understanding and biomedically controlling its participation in mitochondrial homeostasis and cell death. C1 [Brosey, Chris A.; Ho, Chris; Long, Winnie Z.; Bowman, Gregory R.; Ellenberger, Tom] Washington Univ, Sch Med, Biochem & Mol Biophys, St Louis, MO 63110 USA. [Burnett, Kathryn; Hura, Greg L.; Tainer, John A.] Lawrence Berkeley Natl Lab, MBIB Div, Berkeley, CA 94720 USA. [Hura, Greg L.] Univ Calif Santa Cruz, Chem & Biochem, Santa Cruz, CA 95064 USA. [Nix, Jay C.] Lawrence Berkeley Natl Lab, Mol Biol Consortium, Berkeley, CA 94720 USA. [Brosey, Chris A.; Tainer, John A.] Univ Texas MD Anderson Canc Ctr, Mol & Cellular Oncol, Houston, TX 77030 USA. RP Brosey, CA (reprint author), Washington Univ, Sch Med, Biochem & Mol Biophys, St Louis, MO 63110 USA.; Tainer, JA (reprint author), Lawrence Berkeley Natl Lab, MBIB Div, Berkeley, CA 94720 USA.; Brosey, CA; Tainer, JA (reprint author), Univ Texas MD Anderson Canc Ctr, Mol & Cellular Oncol, Houston, TX 77030 USA. EM cabrosey@mdanderson.org; jtainer@mdanderson.org OI Singh, Sukrit/0000-0003-1914-4955 FU NIH Structural Cell Biology of DNA Repair Machines P01 grant [CA92584]; Washington University School of Medicine; NIH National Research Service Award [F32-GM109591]; Robert A. Welch Chemistry Chair; Cancer Prevention and Research Institute of Texas; University of Texas System Science and Technology Acquisition and Retention; United States Department of Energy program Integrated Diffraction Analysis Technologies (IDAT) FX We thank the Berkeley Lab Advanced Light Source (ALS) and staff at beamlines 4.2.2 and 12.3.1 for aiding X-ray crystallographic and X-ray scattering data collection. This work was supported by NIH Structural Cell Biology of DNA Repair Machines P01 grant CA92584 (G.L.H., J.A.T., T.E.) and chair funds from Washington University School of Medicine to T.E. C.A.B. was supported by an NIH National Research Service Award (F32-GM109591). J.A.T. is supported by a Robert A. Welch Chemistry Chair, the Cancer Prevention and Research Institute of Texas, and the University of Texas System Science and Technology Acquisition and Retention. SAXS experiments at the ALS 12.3.1 SIBYLS beamline are supported by the United States Department of Energy program Integrated Diffraction Analysis Technologies (IDAT). NR 50 TC 0 Z9 0 U1 1 U2 1 PU CELL PRESS PI CAMBRIDGE PA 600 TECHNOLOGY SQUARE, 5TH FLOOR, CAMBRIDGE, MA 02139 USA SN 0969-2126 EI 1878-4186 J9 STRUCTURE JI Structure PD DEC 6 PY 2016 VL 24 IS 12 BP 2067 EP 2079 DI 10.1016/j.str.2016.09.012 PG 13 WC Biochemistry & Molecular Biology; Biophysics; Cell Biology SC Biochemistry & Molecular Biology; Biophysics; Cell Biology GA EJ4UB UT WOS:000393211300007 PM 27818101 ER PT J AU Li, X Cox, JT Huang, WL Kane, M Tang, KQ Bieberich, CJ AF Li, Xiang Cox, Jonathan T. Huang, Weiliang Kane, Maureen Tang, Keqi Bieberich, Charles J. TI Quantifying Kinase-Specific Phosphorylation Stoichiometry Using Stable Isotope Labeling In a Reverse In-Gel Kinase Assay SO ANALYTICAL CHEMISTRY LA English DT Article ID SUBAMBIENT PRESSURE IONIZATION; PROTEIN-PHOSPHORYLATION; MASS-SPECTROMETRY; TARGETING CANCER; INHIBITORS; NETWORKS; IDENTIFICATION; PHOSPHOPROTEOMICS; NANOELECTROSPRAY; PROTEOMICS AB Despite recent advancements in large-scale phosphoproteomics, methods to quantify kinase-specific phosphorylation stoichiometry of protein substrates are lacking. We developed a method to quantify kinase-specific phosphorylation stoichiometry by combining the reverse in-gel kinase assay (RIKA) with high-resolution liquid chromatography mass spectrometry (LC-MS). Beginning with predetermined ratios of phosphorylated to non-phosphorylated protein kinase CK2 (CK2) substrate molecules, we employed O-18-labeled adenosine triphosphate (O-18-ATP) as the phosphate donor in a RIKA, then quantified the ratio of O-18- versus O-16-labeled tryptic phosphopeptide using high mass accuracy mass spectrometry (MS). We demonstrate that the phosphorylation stoichiometry determined by this method across a broad percent phosphorylation range correlated extremely well with the predicted value (correlation coefficient = 0.99). This approach provides a quantitative alternative to antibody-based methods of determining the extent of phosphorylation of a substrate pool. C1 [Li, Xiang; Bieberich, Charles J.] Univ Maryland Baltimore Cty, Dept Biol Sci, Baltimore, MD 21250 USA. [Cox, Jonathan T.; Tang, Keqi] Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99352 USA. [Huang, Weiliang; Kane, Maureen] Univ Maryland, Sch Pharm, Dept Pharmaceut Sci, Baltimore, MD 21201 USA. [Bieberich, Charles J.] Univ Maryland Baltimore Cty, Marlene & Stewart Greenebaum Canc Ctr, Baltimore, MD 21201 USA. RP Bieberich, CJ (reprint author), Univ Maryland Baltimore Cty, Dept Biol Sci, Baltimore, MD 21250 USA.; Tang, KQ (reprint author), Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99352 USA.; Bieberich, CJ (reprint author), Univ Maryland Baltimore Cty, Marlene & Stewart Greenebaum Canc Ctr, Baltimore, MD 21201 USA. EM Keqi.Tang@pnnl.gov; bieberic@umbc.edu FU National Cancer Institute, National Institutes of Health [R21CA155568, R21CA199042]; NIH National Cancer Institute [R21CA155568]; NIH General Medical Sciences [FM103491-12]; Department of Energy Office of Biological and Environmental Research Genome Sciences Program under the Pan-omics project; DOE [DE-AC05-76RLO01830] FX This work is supported by grants R21CA155568 (Innovative Molecular Analysis Technologies Program) and R21CA199042 to C.J.B. from the National Cancer Institute, National Institutes of Health. Work related to the SPIN-MS sample analysis was supported by the NIH National Cancer Institute (R21CA155568) as well as the General Medical Sciences (FM103491-12), and by the Department of Energy Office of Biological and Environmental Research Genome Sciences Program under the Pan-omics project. SPIN-MS data were collected at the Environmental Molecular Science Laboratory, a U. S. Department of Energy (DOE) national scientific user facility located at PNNL in Richland, Washington. PNNL is a multiprogramming national laboratory operated by Battelle for the DOE under contract DE-AC05-76RLO01830. NR 47 TC 0 Z9 0 U1 8 U2 8 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0003-2700 EI 1520-6882 J9 ANAL CHEM JI Anal. Chem. PD DEC 6 PY 2016 VL 88 IS 23 BP 11468 EP 11475 DI 10.1021/acs.analchem.6b02599 PG 8 WC Chemistry, Analytical SC Chemistry GA EE4FE UT WOS:000389556900033 PM 27808495 ER PT J AU Garimella, SVB Hamid, AM Deng, L Ibrahim, YM Webb, IK Baker, ES Prost, SA Norheim, RV Anderson, GA Smith, RD AF Garimella, Sandilya V. B. Hamid, Ahmed M. Deng, Liulin Ibrahim, Yehia M. Webb, Ian K. Baker, Erin S. Prost, Spencer A. Norheim, Randolph V. Anderson, Gordon A. Smith, Richard D. TI Squeezing of Ion Populations and Peaks in Traveling Wave Ion Mobility Separations and Structures for Lossless Ion Manipulations Using Compression Ratio Ion Mobility Programming SO ANALYTICAL CHEMISTRY LA English DT Article ID MASS-SPECTROMETRY; FUNDAMENTALS; MIXTURES AB In this work we report an approach for spatial and temporal gas-phase ion population manipulation, wherein we collapse ion distributions in ion mobility (IM) separations into tighter packets providing higher sensitivity measurements in conjunction with mass spectrometry (MS). We do this for ions moving from a conventional traveling wave (TW)-driven region to a region where the TW is intermittently halted or "stuttered". This approach causes the ion packets spanning a number of TW-created traveling traps (TT) to be redistributed into fewer TT, resulting in spatial compression. The degree of spatial compression is controllable and determined by the ratio of stationary time of the TW in the second region to its moving time. This compression ratio ion mobility programming (CRIMP) approach has been implemented using "structures for lossless ion manipulations" (SLIM) in conjunction with MS. CRIMP with the SLIM-MS platform is shown to provide increased peak intensities, reduced peak widths, and improved signal-to-noise (S/N) ratios with MS detection. CRIMP also provides a foundation for extremely long path length and multipass IM separations in SLIM providing greatly enhanced IM resolution by reducing the detrimental effects of diffusional peak broadening and increasing peak widths. C1 [Smith, Richard D.] Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99352 USA. Pacific Northwest Natl Lab, Environm Mol Sci Lab, Richland, WA 99352 USA. [Anderson, Gordon A.] Custom Engn LLC, Benton City, WA 99320 USA. RP Smith, RD (reprint author), Pacific Northwest Natl Lab, Div Biol Sci, Richland, WA 99352 USA. EM rds@pnnl.gov RI Smith, Richard/J-3664-2012; OI Smith, Richard/0000-0002-2381-2349; Garimella, Sandilya Venkata Bhaskara/0000-0001-6649-9842 FU Department of Energy Office of Biological and Environmental Research Program; National Institute of General Medical Sciences [P41 GM103493]; DOE [DE-AC05-76RL0 1830] FX Portions of this research were supported by the Department of Energy Office of Biological and Environmental Research Program under the Pan-Omics Program and by the National Institute of General Medical Sciences (P41 GM103493). Work was performed in the Environmental Molecular Sciences Laboratory (EMSL), a DOE national scientific user facility at the Pacific Northwest National Laboratory (PNNL) in Richland, WA. PNNL is operated by Battelle for the DOE under contract DE-AC05-76RL0 1830. NR 21 TC 2 Z9 2 U1 6 U2 6 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0003-2700 EI 1520-6882 J9 ANAL CHEM JI Anal. Chem. PD DEC 6 PY 2016 VL 88 IS 23 BP 11877 EP 11885 DI 10.1021/acs.analchem.6b03660 PG 9 WC Chemistry, Analytical SC Chemistry GA EE4FE UT WOS:000389556900086 PM 27934097 ER PT J AU Ridley, DA Heald, CL Kok, JF Zhao, C AF Ridley, David A. Heald, Colette L. Kok, Jasper F. Zhao, Chun TI An observationally constrained estimate of global dust aerosol optical depth SO ATMOSPHERIC CHEMISTRY AND PHYSICS LA English DT Article ID REMOTE-SENSING OBSERVATIONS; EARTH SYSTEM MODEL; SEA-SALT AEROSOLS; MINERAL DUST; UNITED-STATES; SIZE DISTRIBUTION; CLIMATE MODELS; SPATIAL-DISTRIBUTION; SURFACE OBSERVATIONS; DATA ASSIMILATION AB The role of mineral dust in climate and ecosystems has been largely quantified using global climate and chemistry model simulations of dust emission, transport, and deposition. However, differences between these model simulations are substantial, with estimates of global dust aerosol optical depth (AOD) that vary by over a factor of 5. Here we develop an observationally based estimate of the global dust AOD, using multiple satellite platforms, in situ AOD observations and four state-of-the-science global models over 2004-2008. We estimate that the global dust AOD at 550 nm is 0.030 +/- 0.005 (1 sigma), higher than the AeroCom model median (0.023) and substantially narrowing the uncertainty. The methodology used provides regional, seasonal dust AOD and the associated statistical uncertainty for key dust regions around the globe with which model dust schemes can be evaluated. Exploring the regional and seasonal differences in dust AOD between our observationally based estimate and the four models in this study, we find that emissions in Africa are often overrepresented at the expense of Asian and Middle Eastern emissions and that dust removal appears to be too rapid in most models. C1 [Ridley, David A.; Heald, Colette L.] MIT, Civil & Environm Engn, 77 Massachusetts Ave, Cambridge, MA 02139 USA. [Kok, Jasper F.] Univ Calif Los Angeles, Dept Atmospher & Ocean Sci, Los Angeles, CA USA. [Zhao, Chun] Pacific Northwest Natl Lab, Atmospher Sci & Global Change Div, Richland, WA 99352 USA. RP Ridley, DA (reprint author), MIT, Civil & Environm Engn, 77 Massachusetts Ave, Cambridge, MA 02139 USA. EM daridley@mit.edu RI Kok, Jasper/A-9698-2008 OI Kok, Jasper/0000-0003-0464-8325 NR 117 TC 3 Z9 3 U1 10 U2 10 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1680-7316 EI 1680-7324 J9 ATMOS CHEM PHYS JI Atmos. Chem. Phys. PD DEC 6 PY 2016 VL 16 IS 23 BP 15097 EP 15117 DI 10.5194/acp-16-15097-2016 PG 21 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA ED9QZ UT WOS:000389209000005 ER PT J AU Bonin, TA Newman, JF Klein, PM Chilson, PB Wharton, S AF Bonin, Timothy A. Newman, Jennifer F. Klein, Petra M. Chilson, Phillip B. Wharton, Sonia TI Improvement of vertical velocity statistics measured by a Doppler lidar through comparison with sonic anemometer observations SO ATMOSPHERIC MEASUREMENT TECHNIQUES LA English DT Article ID CONVECTIVE BOUNDARY-LAYER; EDDY-COVARIANCE MEASUREMENTS; IN-SITU MEASUREMENTS; SENSIBLE HEAT-FLUX; TURBULENCE MEASUREMENTS; WIND LIDARS; 4TH-ORDER MOMENTS; WATER-VAPOR; RAMAN LIDAR; URBAN AREA AB Since turbulence measurements from Doppler lidars are being increasingly used within wind energy and boundary-layer meteorology, it is important to assess and improve the accuracy of these observations. While turbulent quantities are measured by Doppler lidars in several different ways, the simplest and most frequently used statistic is vertical velocity variance ((w'(2)) over bar) from zenith stares. However, the competing effects of signal noise and resolution volume limitations, which respectively increase and decrease (w'(2)) over bar, reduce the accuracy of these measurements. Herein, an established method that utilises the autocovariance of the signal to remove noise is evaluated and its skill in correcting for volume-averaging effects in the calculation of (w'(2)) over bar is also assessed. Additionally, this autocovariance technique is further refined by defining the amount of lag time to use for the most accurate estimates of (w'(2)) over bar. Through comparison of observations from two Doppler lidars and sonic anemometers on a 300m tower, the autocovariance technique is shown to generally improve estimates of (w'(2)) over bar. After the autocovariance technique is applied, values of (w'(2)) over bar from the Doppler lidars are generally in close agreement (R-2 approximate to 0.95-0.98) with those calculated from sonic anemometer measurements. C1 [Bonin, Timothy A.; Newman, Jennifer F.; Klein, Petra M.; Chilson, Phillip B.] Univ Oklahoma, Sch Meteorol, Norman, OK 73019 USA. [Klein, Petra M.] Univ Oklahoma, Cooperat Inst Mesoscale Meteorol Studies, Norman, OK 73019 USA. [Chilson, Phillip B.] Univ Oklahoma, Adv Radar Res Ctr, Norman, OK 73019 USA. [Wharton, Sonia] Lawrence Livermore Natl Lab, Livermore, CA USA. [Bonin, Timothy A.] Cooperat Inst Res Environm Sci, Boulder, CO USA. [Bonin, Timothy A.] NOAA, Earth Syst Res Lab, Div Chem Sci, Boulder, CO USA. [Newman, Jennifer F.] Natl Renewable Energy Lab, Natl Wind Technol Ctr, Golden, CO USA. RP Bonin, TA (reprint author), Univ Oklahoma, Sch Meteorol, Norman, OK 73019 USA.; Bonin, TA (reprint author), Cooperat Inst Res Environm Sci, Boulder, CO USA.; Bonin, TA (reprint author), NOAA, Earth Syst Res Lab, Div Chem Sci, Boulder, CO USA. EM timothy.bonin@noaa.gov RI Klein, Petra/G-1894-2012; Bonin, Timothy /C-9125-2016 OI Klein, Petra/0000-0003-2943-7831; Bonin, Timothy /0000-0001-7679-2890 FU Office of the Vice President for Research at the University of Oklahoma; National Center for Atmospheric Research (NCAR); NCAR Earth Observing Laboratory FX We acknowledge NOAA ESRL and NCAR for all the support in deploying the instruments during LATTE and for allowing this experiment to be conducted at the BAO site. We thank Andreas Muschinski, Lucas Root, and Shiril Tichkule for their assistance in installing and maintaining the sonic anemometers on the tower. Input and comments from David Turner and Alan Shapiro were very helpful. This work was supported by funding from the Office of the Vice President for Research at the University of Oklahoma, the National Center for Atmospheric Research (NCAR) Faculty Fellowship Program, and NCAR Earth Observing Laboratory. NR 55 TC 0 Z9 0 U1 13 U2 13 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1867-1381 EI 1867-8548 J9 ATMOS MEAS TECH JI Atmos. Meas. Tech. PD DEC 6 PY 2016 VL 9 IS 12 BP 5833 EP 5852 DI 10.5194/amt-9-5833-2016 PG 20 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA ED9RM UT WOS:000389210300001 ER PT J AU Fossat, MJ Dao, TP Jenkins, K Dellarole, M Yang, YS McCallum, SA Garcia, AE Barrick, D Roumestand, C Royer, CA AF Fossat, Martin J. Dao, Thuy P. Jenkins, Kelly Dellarole, Mariano Yang, Yinshan McCallum, Scott A. Garcia, Angel E. Barrick, Doug Roumestand, Christian Royer, Catherine A. TI High-Resolution Mapping of a Repeat Protein Folding Free Energy Landscape SO BIOPHYSICAL JOURNAL LA English DT Article ID HYDROGEN-EXCHANGE; THERMAL-EXPANSION; TRANSITION-STATE; SPECTROSCOPY; MODELS; PP32; REPRESENTATIONS; COOPERATIVITY; INTERMEDIATE; FLUCTUATIONS AB A complete description of the pathways and mechanisms of protein folding requires a detailed structural and energetic characterization of the conformational ensemble along the entire folding reaction coordinate. Simulations can provide this level of insight for small proteins. In contrast, with the exception of hydrogen exchange, which does not monitor folding directly, experimental studies of protein folding have not yielded such structural and energetic detail. NMR can provide residue specific atomic level structural information, but its implementation in protein folding studies using chemical or temperature perturbation is problematic. Here we present a highly detailed structural and energetic map of the entire folding landscape of the leucine-rich repeat protein, pp32 (Anp32), obtained by combining pressure-dependent site-specific H-1-N-15 HSQC data with coarse-grained molecular dynamics simulations. The results obtained using this equilibrium approach demonstrate that the main barrier to folding of pp32 is quite broad and lies near the unfolded state, with structure apparent only in the C-terminal region. Significant deviation from two-state unfolding under pressure reveals an intermediate on the folded side of the main barrier in which the N-terminal region is disordered. A nonlinear temperature dependence of the population of this intermediate suggests a large heat capacity change associated with its formation. The combination of pressure, which favors the population of folding intermediates relative to chemical denaturants; NMR, which allows their observation; and constrained structure-based simulations yield unparalleled insight into protein folding mechanisms. C1 [Fossat, Martin J.; Jenkins, Kelly; Royer, Catherine A.] Rensselaer Polytech Inst, Biol Sci, Troy, NY 12180 USA. [Dao, Thuy P.; Barrick, Doug] Johns Hopkins Univ, Dept Biophys, Baltimore, MD USA. [Dellarole, Mariano] Inst Pasteur, CNRS, UMR 3569, Unite Virol Struct, Paris, France. [Yang, Yinshan; Roumestand, Christian] Univ Montpellier, INSERM, CNRS, Ctr Biochim Struct,UMR 5048, Montpellier, France. [McCallum, Scott A.] Rensselaer Polytech Inst, Ctr Biotechnol & Interdisciplinary Studies, Troy, NY USA. [Garcia, Angel E.] Rensselaer Polytech Inst, Dept Phys, Troy, NY USA. [Garcia, Angel E.] Los Alamos Natl Lab, Ctr Nonlinear Sci, Los Alamos, NM USA. RP Royer, CA (reprint author), Rensselaer Polytech Inst, Biol Sci, Troy, NY 12180 USA. EM royerc@rpi.edu FU National Science Foundation [MCB1514575, MCBI050966]; National Institutes of Health [GM068462]; French Infrastructure for Integrated Structural Biology grant [ANR-10-INSB-05-01] FX The work was supported by National Science Foundation grants No. MCB1514575 and No. MCBI050966 to C.A.R. and A.E.G., respectively; from National Institutes of Health grant No. GM068462 to D.B.; and from French Infrastructure for Integrated Structural Biology grant No. ANR-10-INSB-05-01 to C.R. NR 33 TC 1 Z9 1 U1 4 U2 4 PU CELL PRESS PI CAMBRIDGE PA 600 TECHNOLOGY SQUARE, 5TH FLOOR, CAMBRIDGE, MA 02139 USA SN 0006-3495 EI 1542-0086 J9 BIOPHYS J JI Biophys. J. PD DEC 6 PY 2016 VL 111 IS 11 BP 2368 EP 2376 DI 10.1016/j.bpj.2016.08.027 PG 9 WC Biophysics SC Biophysics GA EE4HW UT WOS:000389563900006 PM 27926838 ER PT J AU Yuan, K Lee, SS De Andrade, V Sturchio, NC Fenter, P AF Yuan, Ke Lee, Sang Soo De Andrade, Vincent Sturchio, Neil C. Fenter, Paul TI Replacement of Calcite (CaCO3) by Cerussite (PbCO3) SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID INTERFACIAL DISSOLUTION-REPRECIPITATION; X-RAY REFLECTIVITY; WATER INTERFACE; (104)-WATER INTERFACE; ADSORPTION COMPLEXES; PB(II) SORPTION; IMAGE-ANALYSIS; ION-EXCHANGE; GROWTH; PB AB The mobility of toxic elements, such as lead (Pb) can be attenuated by adsorption, incorporation, and precipitation on carbonate minerals in subsurface environments. Here, we report a study of the bulk transformation of single-crystal calcite (CaCO3) into polycrystalline cerussite (PbCO3) through reaction with acidic Pb-bearing solutions. This reaction began with the growth of a cerussite shell on top of calcite surfaces followed by the replacement of the remaining calcite core. The external shape of the original calcite was preserved by a balance between calcite dissolution and cerussite growth controlled by adjusting the Pb2+ concentration and pH. The relation between the rounded calcite core and the surrounding lath-shaped cerussite aggregates was imaged by transmission X-ray microscopy, which revealed preferentially elongated cerussite crystals parallel to the surface and edge directions of calcite. The replacement reaction involved concurrent development of similar to 100 nm wide pores parallel to calcite c-glide or (1 (2) over bar0) planes, which may have provided permeability for chemical exchange during the reaction. X-ray reflectivity measurements showed no clear epitaxial relation of cerussite to the calcite (104) surface. These results demonstrate Pb sequestration through mineral replacement reactions and the critical role of nanoporosity (3% by volume) on the solid phase transformation through a dissolution-recrystallization mechanism. C1 [Yuan, Ke; Lee, Sang Soo; Fenter, Paul] Argonne Natl Lab, Chem Sci & Engn Div, 9700 South Cass Ave, Argonne, IL 60439 USA. [De Andrade, Vincent] Argonne Natl Lab, Adv Photon Source, 9700 South Cass Ave, Argonne, IL 60439 USA. [Sturchio, Neil C.] Univ Delaware, Dept Geol Sci, Newark, DE 19716 USA. RP Yuan, K (reprint author), Argonne Natl Lab, Chem Sci & Engn Div, 9700 South Cass Ave, Argonne, IL 60439 USA. EM kyuan@anl.gov FU Geosciences Research Program, Office of Basic Energy Sciences, U.S. Department of Energy (DOE) [DE-AC02-06CH11357]; DOE Office of Science [DE-AC02-06CH11357]; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-AC02-06CH11357] FX The authors thank Dr. Magali S. Ferrandon for help with XRD measurements and Rachel E. Koritala and Jie Wang for help with SEM. This work is supported by the Geosciences Research Program, Office of Basic Energy Sciences, U.S. Department of Energy (DOE), under Contract No. DE-AC02-06CH11357. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. Use of the Center for Nanoscale Materials, an Office of Science user facility, was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, under Contract No. DE-AC02-06CH11357. NR 51 TC 0 Z9 0 U1 7 U2 7 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 6 PY 2016 VL 50 IS 23 BP 12984 EP 12991 DI 10.1021/acs.est.6b03911 PG 8 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EE4FG UT WOS:000389557100052 PM 27767299 ER PT J AU Juhasz, AL Scheckel, KG Betts, AR Smith, E AF Juhasz, Albert L. Scheckel, Kirk G. Betts, Aaron R. Smith, Euan TI Predictive Capabilities of in Vitro Assays for Estimating Pb Relative Bioavailability in Phosphate Amended Soils SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID CONTAMINATED SOILS; LEAD BIOACCESSIBILITY; SITU STABILIZATION; MANGANESE OXIDE; PHOSPHORIC-ACID; EXTRACTION TEST; RANGE SOILS; HOUSE-DUST; IMMOBILIZATION; CHLOROPYROMORPHITE AB In this study, the in vitro bioaccessibility (IVBA) of lead (Pb) in phosphate-amended Pb-contaminated soil was assessed using a variety of IVBA assays with an overarching aim of determining whether changes in Pb IVBA were congruent to those observed for Pb relative bioavailability (RBA) determined using an in vivo mouse assay. Amending soil with phosphoric acid or rock phosphate resulted in changes in Pb speciation, however, varying Pb IVBA results were obtained depending on the methodology utilized. In addition, IVBA assays influenced Pb speciation as a consequence of interactions between dissolved Pb and unreacted phosphate arising from the amendment or from assay constituents. When the relationship between Pb RBA and IVBA was assessed, a comparison of treatment effect ratios (Pb RBA or IVBA in treated soil divided by Pb RBA or IVBA for untreated soil) provided the best in vivo in vitro correlation particular for SBRC (r(2) = 0.83) and IVG (r(2) = 0.89) intestinal extraction. For these assays, the slope of the lines of best fit were close to 1 (1.12, 0.82; SBRC, IVG intestinal extraction respectively) with small y-intercepts (0.09, 0.08 respectively) indicating that the efficacy of phosphate amendments for reducing Pb RBA may be predicted using IVBA assays. C1 [Juhasz, Albert L.; Smith, Euan] Univ South Australia, Future Ind Inst, Mawson Lakes, SA 5095, Australia. [Scheckel, Kirk G.; Betts, Aaron R.] US EPA, Natl Risk Management Res Lab, Land Remediat & Pollut Control Div, Cincinnati, OH 45224 USA. [Betts, Aaron R.] Oak Ridge Inst Sci & Educ, Oak Ridge, TN 37831 USA. RP Juhasz, AL (reprint author), Univ South Australia, Future Ind Inst, Mawson Lakes, SA 5095, Australia. EM Albert.Juhasz@unisa.edu.au RI ID, MRCAT/G-7586-2011 FU Future Industries Institute, University of South Australia; National Risk Management Research Laboratory, U.S. EPA; Oak Ridge Institute for Science and Education; [DE-AC02-06CH11357] FX We acknowledge the support of the Future Industries Institute, University of South Australia, National Risk Management Research Laboratory, U.S. EPA and the Oak Ridge Institute for Science and Education. MRCAT operations are supported by the DOE and the MRCAT member institutions. This research used resources of the APS, a-U.S. DOE Office of Science User Facility operated by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. Although EPA contributed to this article, the research presented was not performed by or funded by EPA and was not subject to EPA's quality system requirements. Consequently, the views, interpretations, and conclusions expressed in this article are solely those of the authors and do not necessarily reflect or represent EPA's views or policies. ARB was supported in part by an appointment the Research Participation Program at the ORD, U.S. EPA, administered by the Oak Ridge Institute for Science and Education through an interagency agreement between the U.S DOE and EPA. NR 52 TC 0 Z9 0 U1 11 U2 11 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 6 PY 2016 VL 50 IS 23 BP 13086 EP 13094 DI 10.1021/acs.est.6b04059 PG 9 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EE4FG UT WOS:000389557100063 PM 27934280 ER PT J AU Maasakkers, JD Jacob, DJ Sulprizio, MP Turner, AJ Weitz, M Wirth, T Hight, C DeFigueiredo, M Desai, M Schmeltz, R Hockstad, L Bloom, AA Bowman, KW Jeong, S Fischer, ML AF Maasakkers, Joannes D. Jacob, Daniel J. Sulprizio, Melissa P. Turner, Alexander J. Weitz, Melissa Wirth, Tom Hight, Cate DeFigueiredo, Mark Desai, Mausami Schmeltz, Rachel Hockstad, Leif Bloom, Anthony A. Bowman, Kevin W. Jeong, Seongeun Fischer, Marc L. TI Gridded National Inventory of US Methane Emissions SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID SPATIALLY EXPLICIT INVENTORY; BARNETT SHALE REGION; UNITED-STATES; SATELLITE DATA; GAS; RETRIEVALS; RESOLUTION; SCIAMACHY; SYSTEM; FLUXES AB We present a gridded inventory of US anthropogenic methane emissions with 0.1 degrees X 0.1 degrees spatial resolution, monthly temporal resolution, and detailed scale-dependent error characterization. The inventory is designed to be consistent with the 2016 US Environmental Protection Agency (EPA) Inventory of US Greenhouse Gas Emissions and Sinks (GHGI) for 2012 The EPA inventory is available only as national totals for different source types. We use a wide range of databases at the state, county, local, and point source level to disaggregate the inventory and allocate the spatial and temporal distribution of emissions for individual source types. Results show large differences with the EDGAR v4.2 global gridded inventory commonly used as a priori estimate in inversions of atmospheric methane observations. We derive grid-dependent error statistics for individual source types from comparison with the Environmental Defense Fund (EDF) regional inventory for Northeast Texas. These error statistics are independently verified by comparison with the California Greenhouse Gas Emissions Measurement (CALGEM) grid-resolved emission inventory. Our gridded, time-resolved inventory provides an improved basis for inversion of atmospheric methane observations to estimate US methane emissions and interpret the results in terms of the underlying processes. C1 [Maasakkers, Joannes D.; Jacob, Daniel J.; Sulprizio, Melissa P.; Turner, Alexander J.] Harvard Univ, Sch Engn & Appl Sci, Pierce Hall,29 Oxford St, Cambridge, MA 02138 USA. [Weitz, Melissa; Wirth, Tom; Hight, Cate; DeFigueiredo, Mark; Desai, Mausami; Schmeltz, Rachel; Hockstad, Leif] US EPA, Climate Change Div, Washington, DC 20460 USA. [Bloom, Anthony A.; Bowman, Kevin W.] CALTECH, Jet Prop Lab, 4800 Oak Grove Dr, Pasadena, CA 91109 USA. [Jeong, Seongeun; Fischer, Marc L.] Lawrence Berkeley Natl Lab, Energy Technol Area, Berkeley, CA 94720 USA. RP Maasakkers, JD (reprint author), Harvard Univ, Sch Engn & Appl Sci, Pierce Hall,29 Oxford St, Cambridge, MA 02138 USA. EM Maasakkers@fas.harvard.edu FU NASA Carbon Monitoring System (CMS); Department of Energy (DOE); NASA; NASA CMS program [NNH13ZDA001N]; California Energy Commission Natural Gas Research Program under U.S. Department of Energy [DE-AC02-05CH11231] FX This research was funded by the NASA Carbon Monitoring System (CMS). A.J. Turner was supported by a Department of Energy (DOE) Computational Science Graduate Fellowship (CSGF). Part of this research was carried out at the Jet Propulsion Laboratory, California Institute of Technology under a contract with NASA. Work by M.L. Fischer and S. Jeong at LBNL was supported by the NASA CMS program (NNH13ZDA001N) and the California Energy Commission Natural Gas Research Program under U.S. Department of Energy Contract No. DE-AC02-05CH11231. We thank D.R. Lyon, D. Zavala-Araiza, and S.P. Hamburg for providing the EDF methane emissions over the Barnett Shale. We thank the anonymous reviewers for their thorough comments. NR 78 TC 3 Z9 3 U1 16 U2 16 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 6 PY 2016 VL 50 IS 23 BP 13123 EP 13133 DI 10.1021/acs.est.6b02878 PG 11 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EE4FG UT WOS:000389557100067 PM 27934278 ER PT J AU Lukens, WW Magnani, N Tyliszczak, T Pearce, CI Shuh, DK AF Lukens, Wayne W. Magnani, Nicola Tyliszczak, Tolek Pearce, Carolyn I. Shuh, David K. TI Incorporation of Technetium into Spinel Ferrites SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Article ID MAGNETIC CIRCULAR-DICHROISM; RAY-ABSORPTION SPECTROSCOPY; CRYSTAL-CHEMISTRY; AQUEOUS SUSPENSIONS; SITE OCCUPANCY; AIR OXIDATION; FERROUS IRON; PERTECHNETATE; SOLUBILITY; REDUCTION AB Technetium (Tc-99) is a problematic fission product for the long-term disposal of nuclear waste due to its long half-life, high fission yield, and to the environmental mobility of pertechnetate, the stable species in aerobic environments. One approach to preventing 99Tc contamination is using sufficiently durable waste forms. We report the incorporation of technetium into a family of synthetic spinel ferrites that have environmentally durable natural analogs. A combination of X-ray diffraction, X-ray absorption fine structure spectroscopy, and chemical analysis reveals that Tc(IV) replaces Fe(III) in octahedral sites and illustrates how the resulting charge mismatch is balanced. When a large excess of divalent metal ions is present, the charge is predominantly balanced by substitution of Fe(III) by M(II). When a large excess of divalent metal ions is absent, the charge is largely balanced by creation of vacancies among the Fe(III) sites (maghemitization). In most samples, Tc is present in Tc-rich regions rather than being homogeneously distributed. C1 [Lukens, Wayne W.; Magnani, Nicola; Shuh, David K.] Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. [Magnani, Nicola] European Commiss, Joint Res Ctr, Inst Transuranium Elements, D-76125 Karlsruhe, Germany. [Tyliszczak, Tolek] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. [Pearce, Carolyn I.] Pacific Northwest Natl Lab, Geosci Grp, Richland, WA 99354 USA. RP Lukens, WW (reprint author), Lawrence Berkeley Natl Lab, Div Chem Sci, Berkeley, CA 94720 USA. EM WWLukens@lbl.gov FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Biosciences, and Geosciences Division (CSGB); Geosciences Group at Pacific Northwest National Laboratory; U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences [DE-AC02-76SF00515]; Office of Science, Office of Basic Energy Sciences, CSGB Condensed Phase and Interfacial Molecular Sciences program, of the U.S. Department of Energy at Lawrence Berkeley National Laboratory [DE-AC02-05CH11231]; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work (W.W.L., D.K.S., N.M.) was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Chemical Sciences, Biosciences, and Geosciences Division (CSGB), Heavy Element Chemistry Program and was performed at Lawrence Berkeley National Laboratory under contract No. DE-AC02-05CH11231. CIP was supported by the Geosciences Group at Pacific Northwest National Laboratory. Tc K-edge XAFS spectra were obtained at the Stanford Synchrotron Radiation Lightsource, SLAC National Accelerator Laboratory, which is supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences under Contract No. DE-AC02-76SF00515. STXM and XMCD data were obtained at Beamline 11.0.2 at the ALS, which is supported by the Director, Office of Science, Office of Basic Energy Sciences, CSGB Condensed Phase and Interfacial Molecular Sciences program, of the U.S. Department of Energy at Lawrence Berkeley National Laboratory under Contract No. DE-AC02-05CH11231. The ALS and TT are supported by the Director, Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. NR 72 TC 0 Z9 0 U1 12 U2 12 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 6 PY 2016 VL 50 IS 23 BP 13160 EP 13168 DI 10.1021/acs.est.6b04209 PG 9 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EE4FG UT WOS:000389557100071 PM 27934274 ER PT J AU Willming, MM Lilavois, CR Barron, MG Raimondo, S AF Willming, Morgan M. Lilavois, Crystal R. Barron, Mace G. Raimondo, Sandy TI Acute Toxicity Prediction to Threatened and Endangered Species Using Interspecies Correlation Estimation (ICE) Models (vol 50, pg 10700, 2016) SO ENVIRONMENTAL SCIENCE & TECHNOLOGY LA English DT Correction C1 [Willming, Morgan M.] US EPA, Oak Ridge Inst Sci & Educ, Gulf Ecol Div, 1 Sabine Isl Dr, Gulf Breeze, FL 32561 USA. [Lilavois, Crystal R.; Barron, Mace G.; Raimondo, Sandy] US EPA, Natl Hlth & Environm Effects Lab, Gulf Ecol Div, 1 Sabine Isl Dr, Gulf Breeze, FL 32561 USA. RP Willming, MM (reprint author), US EPA, Oak Ridge Inst Sci & Educ, Gulf Ecol Div, 1 Sabine Isl Dr, Gulf Breeze, FL 32561 USA. NR 1 TC 0 Z9 0 U1 1 U2 1 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0013-936X EI 1520-5851 J9 ENVIRON SCI TECHNOL JI Environ. Sci. Technol. PD DEC 6 PY 2016 VL 50 IS 23 BP 13175 EP 13175 DI 10.1021/acs.est.6b05282 PG 1 WC Engineering, Environmental; Environmental Sciences SC Engineering; Environmental Sciences & Ecology GA EE4FG UT WOS:000389557100076 PM 27934276 ER PT J AU Wang, YH Li, P Jiang, Z Sinkkonen, A Wang, S Tu, J Wei, DZ Dong, HL Wang, YX AF Wang, Yanhong Li, Ping Jiang, Zhou Sinkkonen, Aki Wang, Shi Tu, Jin Wei, Dazhun Dong, Hailiang Wang, Yanxin TI Microbial Community of High Arsenic Groundwater in Agricultural Irrigation Area of Hetao Plain, Inner Mongolia SO FRONTIERS IN MICROBIOLOGY LA English DT Article DE arsenic; groundwater; irrigation; microbial community; illumina MiSeq; Hetao Plain ID REDUCING BACTERIA; SHALLOW AQUIFERS; DRINKING-WATER; RIVER-BASIN; CHINA; DIVERSITY; MOBILIZATION; IRON; CONTAMINATION; BANGLADESH AB Microbial communities can play important role in arsenic release in groundwater aquifers. To investigate the microbial communities in high arsenic groundwater aquifers in agricultural irrigation area, 17 groundwater samples with different arsenic concentrations were collected along the agricultural drainage channels of Hangjinhouqi County, Inner Mongolia and examined by illumina MiSeq sequencing approach targeting the V4 region of the 16S rRNA genes. Both principal component analysis and hierarchical clustering results indicated that these samples were divided into two groups (high and low arsenic groups) according to the variation of geochemical characteristics. Arsenic concentrations showed strongly positive correlations with NH4+ and total organic carbon (TOG). Sequencing results revealed that a total of 329-2823 operational taxonomic units (OTUs) were observed at the 97% OTU level. Microbial richness and diversity of high arsenic groundwater samples along the drainage channels were lower than those of low arsenic groundwater samples but higher than those of high arsenic groundwaters from strongly reducing areas. The microbial community structure in groundwater along the drainage channels was different from those in strongly reducing arsenic-rich aquifers of Hetao Plain and other high arsenic groundwater aquifers including Bangladesh, West Bengal, and Vietnam. Acinetobacter and Pseudomonas dominated with high percentages in both high and low arsenic groundwaters. Alishewanella, Psychrobacter, Methylotenera, and Crenothrix showed relatively high abundances in high arsenic groundwater, while Rheinheimera and the unidentified OP3 were predominant populations in low arsenic groundwater. Archaeal populations displayed a low occurrence and mainly dominated by methanogens such as Methanocorpusculum and Methanospirillum. Microbial community compositions were different between high and low arsenic groundwater samples based on the results of principal coordinate analysis and co-inertia analysis. Other geochemical variables including TOC, NH4+, oxidation-reduction potential, and Fe might also affect the microbial composition. C1 [Wang, Yanhong; Li, Ping; Jiang, Zhou; Tu, Jin; Wei, Dazhun; Dong, Hailiang; Wang, Yanxin] China Univ Geosci, State Key Lab Biogeol & Environm Geol, Wuhan, Peoples R China. [Jiang, Zhou; Wang, Yanxin] China Univ Geosci, Sch Environm Studies, Wuhan, Peoples R China. [Sinkkonen, Aki] Univ Helsinki, Dept Environm Sci, Lahti, Finland. [Sinkkonen, Aki; Wang, Shi] Lawrence Berkeley Natl Lab, Berkeley, CA USA. [Dong, Hailiang] Miami Univ, Dept Geol & Environm Earth Sci, Oxford, OH 45056 USA. RP Li, P; Wang, YX (reprint author), China Univ Geosci, State Key Lab Biogeol & Environm Geol, Wuhan, Peoples R China.; Wang, YX (reprint author), China Univ Geosci, Sch Environm Studies, Wuhan, Peoples R China. EM pli@cug.edu.cn; yx.wang@cug.edu.cn RI wang, shi/D-1485-2015; OI wang, shi/0000-0002-2408-2544; sinkkonen, aki/0000-0002-6821-553X FU National Natural Science Foundation of China [41372348, 41120124003, 41521001]; Research Fund for the Doctoral Program of Higher Education of China [2015M572221]; Fundamental Research Funds for the Central Universities, China University of Geosciences [CUG140505] FX This research was financially supported by National Natural Science Foundation of China (Grant No. 41372348, 41120124003, 41521001), Research Fund for the Doctoral Program of Higher Education of China (Grant No. 2015M572221), and the Fundamental Research Funds for the Central Universities, China University of Geosciences (Grant No. CUG140505). NR 46 TC 0 Z9 0 U1 15 U2 15 PU FRONTIERS MEDIA SA PI LAUSANNE PA PO BOX 110, EPFL INNOVATION PARK, BUILDING I, LAUSANNE, 1015, SWITZERLAND SN 1664-302X J9 FRONT MICROBIOL JI Front. Microbiol. PD DEC 6 PY 2016 VL 7 AR 1917 DI 10.3389/fmicb.2016.01917 PG 12 WC Microbiology SC Microbiology GA EE0MM UT WOS:000389269500001 PM 27999565 ER PT J AU Qiu, Y Xin, L Jia, F Xie, J Li, WZ AF Qiu, Yang Xin, Le Jia, Fan Xie, Jian Li, Wenzhen TI Three-Dimensional Phosphorus-Doped Graphitic-C3N4 Self-Assembly with NH2-Functionalized Carbon Composite Materials for Enhanced Oxygen Reduction Reaction SO LANGMUIR LA English DT Article ID HIGH ELECTROCATALYTIC ACTIVITY; METAL-FREE ELECTROCATALYSTS; NITRIDE NANOSHEETS; FUEL-CELLS; HYDROGEN EVOLUTION; CATHODE CATALYSTS; VISIBLE-LIGHT; GRAPHENE; PERFORMANCE; NITROGEN AB Oxygen reduction reaction (ORR) is the major reaction that occurs at the cathodes of fuel cells and metal-air batteries. Development of inexpensive, active, and durable heteroatom doped carbon-based ORR catalysts can lead to significant cost reduction of these electrochemical energy devices, which therefore has recently attracted enormous research attentions. This work reports a three-dimensional porous composite (P-g-C3N4@NH2-CB) for the highly efficient ORR catalyst. P-g-C3N4@NH2-CB was prepared by mixing phosphorus-doped graphitic carbon nitride nanosheets (P-g-C3N4 NSs) with NH2-functionalized carbon black (NH2-CB) via a novel self-assembly approach. The NH2-CB was rationally chosen as the spacer that enables the self-assembled with the P-g-C3N4. NSs driven by the electrostatic interaction. The intercalation of NH2-CB induces the transformation of 2-D P-g-C3N4 NSs into a 3-D composites material of higher surface area, thereby exposing more ORR active sites. The P-g-C(3)N4@NH2-CB exhibited a remarkable ORR activity with an electron transfer number of 3.83 and Tafel slope of 89 mV dec(-1) in alkaline electrolyte, which is comparable to the ORR performance on Pt/Vulcan XC-72. It is found that the incorporated P atoms as well as employing NH2-CB spacer not only reduces the overpotential of ORR, but also enhances the ORR activity of carbon nitride-based materials, owing to the synergistic effect between P and N in tri-s-triazine rings of carbon nitrides and the optimum interaction between the oppositely charged P-g-C3N4 and NH2-CB. C1 [Qiu, Yang; Jia, Fan; Li, Wenzhen] Iowa State Univ, Chem & Biol Engn, Biorenewables Res Lab, Ames, IA 50011 USA. [Xin, Le; Xie, Jian] Indiana Univ Purdue Univ, Purdue Sch Engn & Technol, Dept Mech Engn, Indianapolis, IN 46202 USA. [Li, Wenzhen] US DOE, Ames Lab, Ames, IA 50011 USA. RP Li, WZ (reprint author), Iowa State Univ, Chem & Biol Engn, Biorenewables Res Lab, Ames, IA 50011 USA.; Li, WZ (reprint author), US DOE, Ames Lab, Ames, IA 50011 USA. EM wzli@iastate.edu FU Iowa State University; Ames Lab Startup Funds; Iowa Energy Center Opportunity Grant Fund FX We acknowledge financial support from Iowa State University and Ames Lab Startup Funds, and Iowa Energy Center Opportunity Grant Fund. We are grateful to Dr. Dapeng Jing for XPS characterization on P-g-C3N4 materials. W. Li thanks his Richard Seagrave Professorship support. NR 45 TC 0 Z9 0 U1 89 U2 89 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0743-7463 J9 LANGMUIR JI Langmuir PD DEC 6 PY 2016 VL 32 IS 48 BP 12569 EP 12578 DI 10.1021/acs.langmuir.6b02498 PG 10 WC Chemistry, Multidisciplinary; Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EE4FJ UT WOS:000389557400001 PM 27805815 ER PT J AU Andreev, K Martynowycz, MW Ivankin, A Huang, ML Kuzmenko, I Meron, M Lin, BH Kirshenbaum, K Gidalevitz, D AF Andreev, Konstantin Martynowycz, Michael W. Ivankin, Andrey Huang, Mia L. Kuzmenko, Ivan Meron, Mati Lin, Binhua Kirshenbaum, Kent Gidalevitz, David TI Cyclization Improves Membrane Permeation by Antimicrobial Peptoids SO LANGMUIR LA English DT Article ID HOST-DEFENSE PEPTIDES; X-RAY REFLECTIVITY; GRAZING-INCIDENCE; LIPID MONOLAYERS; BIOLOGICAL-ACTIVITY; MODEL MEMBRANES; GRAMICIDIN-S; OLIGOMERS; DESIGN; DISCRIMINATION AB The peptidomimetic approach has emerged as a powerful tool for overcoming the inherent limitations of natural antimicrobial peptides, where the therapeutic potential can be improved by increasing the selectivity and bioavailability. Restraining the conformational flexibility of a molecule may reduce the entropy loss upon its binding to the membrane. Experimental findings demonstrate that the cyclization of linear antimicrobial peptoids increases their bactericidal activity against Staphylococcus aureus while maintaining high hemolytic concentrations. Surface X-ray scattering shows that macrocyclic peptoids intercalate into Langmuir monolayers of anionic lipids with greater efficacy than for their linear analogues. It is suggested that cyclization may increase peptoid activity by allowing the macrocycle to better penetrate the bacterial cell membrane. C1 [Andreev, Konstantin; Martynowycz, Michael W.; Ivankin, Andrey; Gidalevitz, David] IIT, Pritzker Inst Biomed Sci & Engn, Dept Phys, Ctr Mol Study Condensed Soft Matter CoSM, 3440 South Dearborn St, Chicago, IL 60616 USA. [Huang, Mia L.; Kirshenbaum, Kent] NYU, Dept Chem, 100 Washington Sq East, New York, NY 10003 USA. [Martynowycz, Michael W.; Kuzmenko, Ivan] Argonne Natl Lab, Adv Photon Source, 9700 South Cass Ave, Lemont, IL 60439 USA. [Meron, Mati; Lin, Binhua] Univ Chicago, Ctr Adv Radiat Sources, Chicago, IL 60637 USA. [Martynowycz, Michael W.] Howard Hughes Med Inst, Janelia Res Campus, Ashburn, VA 20147 USA. [Ivankin, Andrey] Northwestern Univ, Int Inst Nanotechnol, Evanston, IL 60208 USA. [Huang, Mia L.] Univ Calif San Diego, Dept Chem & Biochem, La Jolla, CA 92093 USA. RP Gidalevitz, D (reprint author), IIT, Pritzker Inst Biomed Sci & Engn, Dept Phys, Ctr Mol Study Condensed Soft Matter CoSM, 3440 South Dearborn St, Chicago, IL 60616 USA. EM gidalevitz@iit.edu FU NIH [R01 AI073892]; NSF [CHE-1507946]; DARPA [W911NF-09-1-378]; National Science Foundation [NSF/CHE-1346572]; DOE Office of Science [DE-AC02-06CH11357]; NSF via Adler Planetary & Astronomy Museum FX This research was supported by the NIH (R01 AI073892, D.G.), NSF (CHE-1507946, K.K.), and DARPA (W911NF-09-1-378, D.G.). ChemMatCARS Sector 15 is supported by the National Science Foundation under grant number NSF/CHE-1346572. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE), Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under contract no. DE-AC02-06CH11357. M.W.M. was partially supported by the NSF via a fellowship through the Adler Planetary & Astronomy Museum. NR 59 TC 0 Z9 0 U1 16 U2 16 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0743-7463 J9 LANGMUIR JI Langmuir PD DEC 6 PY 2016 VL 32 IS 48 BP 12905 EP 12913 DI 10.1021/acs.langmuir.6b03477 PG 9 WC Chemistry, Multidisciplinary; Chemistry, Physical; Materials Science, Multidisciplinary SC Chemistry; Materials Science GA EE4FJ UT WOS:000389557400039 PM 27793068 ER PT J AU Adare, A Afanasiev, S Aidala, C Ajitanand, NN Akiba, Y Akimoto, R Al-Bataineh, H Alexander, J Alfred, M Al-Ta'ani, H Angerami, A Aoki, K Apadula, N Aramaki, Y Asano, H Aschenauer, EC Atomssa, ET Averbeck, R Awes, TC Azmoun, B Babintsev, V Bai, M Baksay, G Baksay, L Bandara, NS Bannier, B Barish, KN Bassalleck, B Basye, AT Bathe, S Baublis, V Baumann, C Baumgart, S Bazilevsky, A Beaumier, M Beckman, S Belikov, S Belmont, R Bennett, R Berdnikov, A Berdnikov, Y Bickley, AA Blau, DS Bok, JS Boyle, K Brooks, ML Bryslawskyj, J Buesching, H Bumazhnov, V Bunce, G Butsyk, S Camacho, CM Campbell, S Castera, P Chen, CH Chi, CY Chiu, M Choi, IJ Choi, JB Choi, S Choudhury, RK Christiansen, P Chujo, T Chung, P Chvala, O Cianciolo, V Citron, Z Cole, BA Connors, M Constantin, P Csanad, M Csorgo, T Dahms, T Dairaku, S Danchev, I Danley, TW Das, K Datta, A Daugherity, MS David, G DeBlasio, K Dehmelt, K Denisov, A Deshpande, A Desmond, EJ Dharmawardane, KV Dietzsch, O Ding, L Dion, A Diss, PB Do, JH Donadelli, M D'Orazio, L Drapier, O Drees, A Drees, KA Durham, JM Durum, A Dutta, D Edwards, S Efremenko, YV Ellinghaus, F Engelmore, T Enokizono, A En'yo, H Esumi, S Eyser, KO Fadem, B Feege, N Fields, DE Finger, M Finger, M Fleuret, F Fokin, SL Fraenkel, Z Frantz, JE Franz, A Frawley, AD Fujiwara, K Fukao, Y Fusayasu, T Gainey, K Gal, C Gallus, P Garg, P Garishvili, A Garishvili, I Ge, H Giordano, F Glenn, A Gong, H Gong, X Gonin, M Goto, Y de Cassagnac, RG Grau, N Greene, SV Perdekamp, MG Gunji, T Guo, L Gustafsson, HA Hachiya, T Haggerty, JS Hahn, KI Hamagaki, H Hamblen, J Hamilton, HF Han, R Han, SY Hanks, J Hartouni, EP Hasegawa, S Haseler, TOS Hashimoto, K Haslum, E Hayano, R He, X Heffner, M Hemmick, TK Hester, T Hill, JC Hohlmann, M Hollis, RS Holzmann, W Homma, K Hong, B Horaguchi, T Hori, Y Hornback, D Hoshino, T Hotvedt, N Huang, J Huang, S Ichihara, T Ichimiya, R Ide, J Iinuma, H Ikeda, Y Imai, K Imrek, J Inaba, M Iordanova, A Isenhower, D Ishihara, M Isobe, T Issah, M Isupov, A Ivanishchev, D Jacak, BV Javani, M Jezghani, M Jezghani, M Jia, J Jiang, X Jin, J Johnson, BM Joo, KS Jouan, D Jumper, DS Kajihara, F Kametani, S Kamihara, N Kamin, J Kanda, S Kaneti, S Kang, BH Kang, JH Kang, JS Kapustinsky, J Karatsu, K Kasai, M Kawall, D Kawashima, M Kazantsev, AV Kempel, T Key, JA Khachatryan, V Khanzadeev, A Kijima, KM Kim, BI Kim, C Kim, DH Kim, DJ Kim, E Kim, EJ Kim, GW Kim, HJ Kim, KB Kim, M Kim, SH Kim, YJ Kim, YK Kimelman, B Kinney, E Kiriluk, K Kiss, A Kistenev, E Kitamura, R Klatsky, J Kleinjan, D Kline, P Koblesky, T Kochenda, L Komatsu, Y Komkov, B Konno, M Koster, J Kotchetkov, D Kotov, D Kozlov, A Kral, A Kravitz, A Krizek, F Kunde, GJ Kurita, K Kurosawa, M Kwon, Y Kyle, GS Lacey, R Lai, YS Lajoie, JG Lebedev, A Lee, B Lee, DM Lee, J Lee, K Lee, KB Lee, KS Lee, S Lee, SH Lee, SR Leitch, MJ Leite, MAL Leitgab, M Leitner, E Lenzi, B Lewis, B Li, X Liebing, P Lim, SH Levy, LAL Liska, T Litvinenko, A Liu, H Liu, MX Love, B Luechtenborg, R Lynch, D Maguire, CF Makdisi, YI Makek, M Malakhov, A Malik, MD Manion, A Manko, VI Mannel, E Mao, Y Masui, H Masumoto, S Matathias, F McCumber, M McGaughey, PL McGlinchey, D McKinney, C Means, N Meles, A Mendoza, M Meredith, B Miake, Y Mibe, T Mignerey, AC Mikes, P Miki, K Milov, A Mishra, DK Mishra, M Mitchell, JT Miyachi, Y Miyasaka, S Mizuno, S Mohanty, AK Mohapatra, S Montuenga, P Moon, HJ Moon, T Morino, Y Morreale, A Morrison, DP Motschwiller, S Moukhanova, TV Murakami, T Murata, J Mwai, A Nagae, T Nagamiya, S Nagashima, K Nagle, JL Naglis, M Nagy, MI Nakagawa, I Nakagomi, H 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Tomasek, L. Tomasek, M. Torii, H. Towell, C. L. Towell, R. Towell, R. S. Tserruya, I. Tsuchimoto, Y. Tsuji, T. Vale, C. Valle, H. van Hecke, H. W. Vargyas, M. Vazquez-Zambrano, E. Veicht, A. Velkovska, J. Vertesi, R. Vinogradov, A. A. Virius, M. Vossen, A. Vrba, V. Vznuzdaev, E. Wang, X. R. Watanabe, D. Watanabe, K. Watanabe, Y. Watanabe, Y. S. Wei, F. Wei, R. Wessels, J. White, A. S. White, S. N. Winter, D. Wolin, S. Wood, J. P. Woody, C. L. Wright, R. M. Wysocki, M. Xia, B. Xie, W. Xue, L. Yalcin, S. Yamaguchi, Y. L. Yamaura, K. Yang, R. Yanovich, A. Ying, J. Yokkaichi, S. Yoo, J. H. Yoon, I. You, Z. Young, G. R. Younus, I. Yu, H. Yushmanov, I. E. Zajc, W. A. Zelenski, A. Zhang, C. Zhou, S. Zolin, L. Zou, L. TI Azimuthally anisotropic emission of low-momentum direct photons in Au plus Au collisions at root S-NN=200 GeV SO PHYSICAL REVIEW C LA English DT Article ID HEAVY-ION COLLISIONS; DETECTORS; FLOW AB The PHENIX experiment at the BNL Relativistic Heavy Ion Collider has measured second- and third-order Fourier coefficients of the azimuthal distributions of direct photons emitted at midrapidity in Au + Au collisions at root S-NN = 200 GeV for various collision centralities. Combining two different analysis techniques, results were obtained in the transverse momentum range of 0.4 < p(T) < 4.0 GeV/c. At low p(T) the second-order coefficients, nu(2), are similar to the ones observed in hadrons. Third-order coefficients, nu(3), are nonzero and almost independent of centrality. These new results on nu(2) and nu(3), combined with previously published results on yields, are compared to model calculations that provide yields and asymmetries in the same framework. 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[Belmont, R.; Danchev, I.; Greene, S. V.; Huang, S.; Issah, M.; Leitner, E.; Love, B.; Maguire, C. F.; Roach, D.; Schaefer, B.; Tarafdar, S.; Valle, H.; Velkovska, J.] Vanderbilt Univ, Nashville, TN 37235 USA. [Sano, S.] Waseda Univ, Adv Res Inst Sci & Engn, Shinjuku Ku, 17 Kikui Cho, Tokyo 1620044, Japan. [Citron, Z.; Fraenkel, Z.; Kozlov, A.; Makek, M.; Milov, A.; Naglis, M.; Ravinovich, I.; Sharma, D.; Tarafdar, S.; Tserruya, I.] Weizmann Inst Sci, IL-76100 Rehovot, Israel. [Csorgo, T.; Novak, T.; Ster, A.; Sziklai, J.; Vargyas, M.; Vertesi, R.] Hungarian Acad Sci, Wigner Res Ctr Phys, Inst Particle & Nucl Phys, Wigner RCP RMKI, Budapest 114,POB 49, H-1525 Budapest, Hungary. [Bok, J. S.; Choi, I. J.; Do, J. H.; Kang, J. H.; Kim, H. J.; Kim, S. H.; Kwon, Y.; Lee, S.; Lim, S. H.; Moon, T.; White, S. N.] Yonsei Univ, IPAP, Seoul 120749, South Korea. [Makek, M.] Univ Zagreb, Fac Sci, Dept Phys, Bijenicka 32, Zagreb HR-10002, Croatia. RP Morrison, DP (reprint author), Brookhaven Natl Lab, Phys Dept, Upton, NY 11973 USA. EM morrison@bnl.gov; jamie.nagle@colorado.edu RI Nattrass, Christine/J-6752-2016; Durum, Artur/C-3027-2014; Yokkaichi, Satoshi/C-6215-2017; Hayano, Ryugo/F-7889-2012; Taketani, Atsushi/E-1803-2017 OI Nattrass, Christine/0000-0002-8768-6468; Hayano, Ryugo/0000-0002-1214-7806; Taketani, Atsushi/0000-0002-4776-2315 FU Office of Nuclear Physics in the Office of Science of the Department of Energy (U.S.A); National Science Foundation (U.S.A); Abilene Christian University Research Council (U.S.A); Research Foundation of SUNY (U.S.A); College of Arts and Sciences, Vanderbilt University (U.S.A); Ministry of Education, Culture, Sports, Science, and Technology (Japan); Japan Society for the Promotion of Science (Japan); Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (Brazil); Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (Brazil); Natural Science Foundation of China (People's Republic of China); Croatian Science Foundation (Croatia); Ministry of Science, Education, and Sports (Croatia); Ministry of Education, Youth and Sports (Czech Republic); Centre National de la Recherche Scientifique (France); Commissariat a l'Energie Atomique (France); Institut National de Physique Nucleaire et de Physique des Particules (France); Bundesministerium fur Bildung und Forschung (Germany); Deutscher Akademischer Austausch Dienst (Germany); Alexander von Humboldt Stiftung (Germany); National Science Fund (Hungary); OTKA (Hungary); Karoly Robert University College (Hungary); Ch. Simonyi Fund (Hungary); Department of Atomic Energy (India); Department of Science and Technology (India); Israel Science Foundation (Israel); Basic Science Research Program through the NRF of the Ministry of Education (Korea); Physics Department, Lahore University of Management Sciences (Pakistan); Ministry of Education and Science, Russian Academy of Sciences, Federal Agency of Atomic Energy (Russia); VR (Sweden); Wallenberg Foundation (Sweden); U.S. Civilian Research and Development Foundation for the Independent States of the Former Soviet Union; Hungarian American Enterprise Scholarship Fund; U.S.-Israel Binational Science Foundation FX We thank the staff of the Collider-Accelerator and Physics Departments at Brookhaven National Laboratory and the staff of the other PHENIX participating institutions for their vital contributions. We acknowledge support from the Office of Nuclear Physics in the Office of Science of the Department of Energy, the National Science Foundation, the Abilene Christian University Research Council, the Research Foundation of SUNY, and the Dean of the College of Arts and Sciences, Vanderbilt University (U.S.A); the Ministry of Education, Culture, Sports, Science, and Technology and the Japan Society for the Promotion of Science (Japan); the Conselho Nacional de Desenvolvimento Cientifico e Tecnologico and the Fundacao de Amparo a Pesquisa do Estado de Sao Paulo (Brazil); the Natural Science Foundation of China (People's Republic of China); the Croatian Science Foundation and the Ministry of Science, Education, and Sports (Croatia); the Ministry of Education, Youth and Sports (Czech Republic); the Centre National de la Recherche Scientifique, the Commissariat a l'Energie Atomique, and the Institut National de Physique Nucleaire et de Physique des Particules (France); the Bundesministerium fur Bildung und Forschung, the Deutscher Akademischer Austausch Dienst, and the Alexander von Humboldt Stiftung (Germany); the National Science Fund, OTKA, Karoly Robert University College, and the Ch. Simonyi Fund (Hungary); the Department of Atomic Energy and the Department of Science and Technology (India); the Israel Science Foundation (Israel); the Basic Science Research Program through the NRF of the Ministry of Education (Korea); the Physics Department, Lahore University of Management Sciences (Pakistan); the Ministry of Education and Science, Russian Academy of Sciences, Federal Agency of Atomic Energy (Russia); VR and the Wallenberg Foundation (Sweden); the U.S. Civilian Research and Development Foundation for the Independent States of the Former Soviet Union; the Hungarian American Enterprise Scholarship Fund; and the U.S.-Israel Binational Science Foundation. NR 49 TC 1 Z9 1 U1 25 U2 25 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 6 PY 2016 VL 94 IS 6 AR 064901 DI 10.1103/PhysRevC.94.064901 PG 14 WC Physics, Nuclear SC Physics GA EE3PI UT WOS:000389504300004 ER PT J AU Casten, RF Jolie, J Cakirli, RB Couture, A AF Casten, R. F. Jolie, J. Cakirli, R. B. Couture, A. TI Finite valence nucleon number and rotation-vibration interactions SO PHYSICAL REVIEW C LA English DT Article ID BOSON APPROXIMATION; DEFORMED-NUCLEI AB Background: A characteristic observable of nuclear collective motion is the relative B(E2) values from the gamma band to the ground band in even-even deformed nuclei. TheAlaga rules provide an idealized set of benchmarks for these observables. However, deviations from the Alaga rules are universally observed and have been traditionally and successfully interpreted in terms of parameterized gamma-band-ground-band bandmixing. An alternate approach, partial dynamical symmetries, has no bandmixing whatsoever and is parameter free, yet mimics closely the effects of bandmixing, due solely to the effects of finite valence nucleon number. Purpose: To investigate the relation between these two seemingly contradictory approaches to understand how they can produce such similar results. Method: To derive approximate relations between the two formalisms. Results: A consistent relationship is found linking bandmixing to finite valence nucleon number effects on interband gamma to ground-band B(E2) values. Conclusions: Two disparate approaches to one of the iconic characteristics of deformed nuclei are shown to be intimately related. Moreover, a systematic difference in their predictions also emerges naturally from the derivation. The qualitative linkage of valence nucleon number and the separation of vibrational and rotational degrees of freedom has long been assumed but never before explicitly demonstrated through complementary models. C1 [Casten, R. F.] Yale Univ, Wright Lab, New Haven, CT 06520 USA. [Casten, R. F.] Michigan State Univ, Facil Rare Isotope Beams, 640 South Shaw Lane, E Lansing, MI 48824 USA. [Jolie, J.] Univ Cologne, Inst Nucl Phys, Zulpicherstr 77, D-50937 Cologne, Germany. [Cakirli, R. B.] Istanbul Univ, Dept Phys, Istanbul, Turkey. [Couture, A.] Los Alamos Natl Lab, P-27, Los Alamos, NM 87545 USA. RP Casten, RF (reprint author), Yale Univ, Wright Lab, New Haven, CT 06520 USA.; Casten, RF (reprint author), Michigan State Univ, Facil Rare Isotope Beams, 640 South Shaw Lane, E Lansing, MI 48824 USA. FU US DOE [DE-FG02-91ER-40609]; FRIB laboratory; Max-Planck Partner group; TUBA-GEBIP; Istanbul University Scientific Research Project [26435]; US Department of Energy by Los Alamos National Security, LLC [DE-AC52-06NA25396] FX We are grateful to A. Leviatan, P. Van Isacker, and F. Iachello for useful discussions and to the anonymous referee for suggesting including the generalized relations shown in Table IV. Work supported in part by the US DOE under Grant No. DE-FG02-91ER-40609, and by the FRIB laboratory. R.B.C. acknowledges support from the Max-Planck Partner group, TUBA-GEBIP, and Istanbul University Scientific Research Project No. 26435. Work performed under the auspices of the US Department of Energy by Los Alamos National Security, LLC, under Contract No. DE-AC52-06NA25396. NR 13 TC 0 Z9 0 U1 5 U2 5 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 6 PY 2016 VL 94 IS 6 AR 061303 DI 10.1103/PhysRevC.94.061303 PG 5 WC Physics, Nuclear SC Physics GA EE3PI UT WOS:000389504300002 ER PT J AU Good, P Booth, BBB Chadwick, R Hawkins, E Jonko, A Lowe, JA AF Good, Peter Booth, Ben B. B. Chadwick, Robin Hawkins, Ed Jonko, Alexandra Lowe, Jason A. TI Large differences in regional precipitation change between a first and second 2 K of global warming SO NATURE COMMUNICATIONS LA English DT Article ID CLIMATE-CHANGE; PART II; CIRCULATION; PATTERNS; IMPACTS; MODEL; PROJECTIONS; UNCERTAINTY; FEEDBACK AB For adaptation and mitigation planning, stakeholders need reliable information about regional precipitation changes under different emissions scenarios and for different time periods. A significant amount of current planning effort assumes that each K of global warming produces roughly the same regional climate change. Here using 25 climate models, we compare precipitation responses with three 2 K intervals of global ensemble mean warming: a fast and a slower route to a first 2 K above pre-industrial levels, and the end-of-century difference between high-emission and mitigation scenarios. We show that, although the two routes to a first 2 K give very similar precipitation changes, a second 2 K produces quite a different response. In particular, the balance of physical mechanisms responsible for climate model uncertainty is different for a first and a second 2 K of warming. The results are consistent with a significant influence from nonlinear physical mechanisms, but aerosol and land-use effects may be important regionally. C1 [Good, Peter; Booth, Ben B. B.; Chadwick, Robin; Lowe, Jason A.] Met Off Hadley Ctr, Exeter EX1 3PB, Devon, England. [Hawkins, Ed] Univ Reading, NCAS Climate, Reading RG6 6BB, Berks, England. [Jonko, Alexandra] Los Alamos Natl Lab, Los Alamos, NM 87545 USA. RP Good, P (reprint author), Met Off Hadley Ctr, Exeter EX1 3PB, Devon, England. EM peter.good@metoffice.gov.uk OI Hawkins, Ed/0000-0001-9477-3677 FU Joint UK DECC/Defra Met Office Hadley Centre Climate Programme [GA01101]; Office of Science (BER), US Department of Energy; NERC Advanced Fellowship; UK National Centre for Atmospheric Science; DfID/NERC [NE/M02038X/1, NE/M019977/1] FX This work was supported by the Joint UK DECC/Defra Met Office Hadley Centre Climate Programme (GA01101) and by the Office of Science (BER), US Department of Energy. E.H. was supported by a NERC Advanced Fellowship and the UK National Centre for Atmospheric Science. B.B.B.B. was also partially funded by the DfID/NERC HyCRISTAL (NE/M02038X/1) and AMMA-2050 (NE/M019977/1) projects. We acknowledge the World Climate Research Programme's Working Group on Coupled Modelling, which is responsible for CMIP, and we thank the climate modelling groups (listed in Supplementary Table 1 of this paper) for producing and making available their model output. For CMIP, the US Department of Energy's Program for Climate Model Diagnosis and Intercomparison provides coordinating support and led development of software infrastructure in partnership with the Global Organization for Earth System Science Portals. Some helpful discussion with Hugo Lambert improved the manuscript. NR 41 TC 0 Z9 0 U1 5 U2 5 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 6 PY 2016 VL 7 AR 13667 DI 10.1038/ncomms13667 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA ED9HG UT WOS:000389180200001 PM 27922014 ER PT J AU Khachatryan, V Sirunyan, AM Tumasyan, A Adam, W Asilar, E Bergauer, T Brandstetter, J Brondolin, E Dragicevic, M Ero, J Flechl, M Friedl, M Fruhwirth, R Ghete, VM Hartl, C Hormann, N Hrubec, J Jeitler, M Konig, A Kratschmer, I Liko, D Matsushita, T Mikulec, I Rabady, D Rad, N Rahbaran, B Rohringer, H Schieck, J Strauss, J Treberer-Treberspurg, W Waltenberger, W Wulz, CE Mossolov, V Shumeiko, N Gonzalez, JS Alderweireldt, S De Wolf, EA Janssen, X Lauwers, J Van de Klundert, M Van Haevermaet, H Van Mechelen, P Van Remortel, N Van Spilbeeck, A Abu Zeid, S Blekman, F D'Hondt, J Daci, N De Bruyn, I Deroover, K Heracleous, N Lowette, S Moortgat, S Moreels, L Olbrechts, A Python, Q Tavernier, S Van Doninck, W Van Mulders, P Van Parijs, I Brun, H Caillol, C Clerbaux, B De Lentdecker, G Delannoy, H Fasanella, G 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CA CMS Collaboration TI Search for new physics in final states with two opposite-sign, same-flavor leptons, jets, and missing transverse momentum in pp collisions at TeV SO JOURNAL OF HIGH ENERGY PHYSICS LA English DT Article DE Beyond Standard Model; Hadron-Hadron scattering (experiments); Supersymmetry ID SUPERGAUGE TRANSFORMATIONS; MODEL; SUPERSYMMETRY; EXTENSION; INVARIANT; NEUTRINO AB A search is presented for physics beyond the standard model in final states with two opposite-sign, same-flavor leptons, jets, and missing transverse momentum. The data sample corresponds to an integrated luminosity of 2.3 fb(-1) of proton-proton collisions at TeV collected with the CMS detector at the LHC in 2015. The analysis uses the invariant mass of the lepton pair, searching for a kinematic edge or a resonant-like excess compatible with the Z boson mass. Both search modes use several event categories in order to increase the sensitivity to new physics. These categories are based on the rapidity of the leptons, the multiplicity of jets and b jets, the scalar sum of jet transverse momenta, and missing transverse momentum. The observations in all signal regions are consistent with the expectations from the standard model, and the results are interpreted in the context of simplified models of supersymmetry. C1 [Khachatryan, V.; Sirunyan, A. M.; Tumasyan, A.] Yerevan Phys Inst, Yerevan, Armenia. [Adam, W.; Asilar, E.; Bergauer, T.; Brandstetter, J.; Brondolin, E.; Dragicevic, M.; Eroe, J.; Flechl, M.; Friedl, M.; Fruehwirth, R.; Ghete, V. M.; Hartl, C.; Hoermann, N.; Hrubec, J.; Jeitler, M.; Koenig, A.; Kraetschmer, I.; Liko, D.; Matsushita, T.; Mikulec, I.; Rabady, D.; Rad, N.; Rahbaran, B.; Rohringer, H.; Schieck, J.; Strauss, J.; Treberer-Treberspurg, W.; Waltenberger, W.; Wulz, C. -E.] OeAW, Inst Hochenergiephys, Vienna, Austria. [Mossolov, V.; Shumeiko, N.; Gonzalez, J. Suarez] Natl Ctr Particle & High Energy Phys, Minsk, Byelarus. 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[Abbrescia, M.; Calabria, C.; Caputo, C.; Colaleo, A.; Creanza, D.; Cristella, L.; De Filippis, N.; De Palma, M.; Fiore, L.; Iaselli, G.; Maggi, G.; Maggi, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Pugliese, G.; Radogna, R.; Ranieri, A.; Selvaggi, G.; Silvestris, L.; Venditti, R.; Verwilligen, P.] INFN, Sez Bari, Bari, Italy. [Abbrescia, M.; Calabria, C.; Caputo, C.; Cristella, L.; De Palma, M.; Miniello, G.; My, S.; Nuzzo, S.; Pompili, A.; Radogna, R.; Selvaggi, G.; Venditti, R.] Univ Bari, Bari, Italy. [Creanza, D.; De Filippis, N.; Iaselli, G.; Maggi, G.; Pugliese, G.] Politecn Bari, Bari, Italy. [Abbiendi, G.; Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Cavallo, F. R.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Dallavalle, G. M.; Fabbri, F.; Fanfani, A.; Fasanella, D.; Giacomelli, P.; Grandi, C.; Guiducci, L.; Marcellini, S.; Masetti, G.; Montanari, A.; Navarria, F. L.; Perrotta, A.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] INFN, Sez Bologna, Bologna, Italy. [Bonacorsi, D.; Braibant-Giacomelli, S.; Brigliadori, L.; Campanini, R.; Capiluppi, P.; Castro, A.; Chhibra, S. S.; Codispoti, G.; Cuffiani, M.; Fanfani, A.; Fasanella, D.; Guiducci, L.; Navarria, F. L.; Rossi, A. M.; Rovelli, T.; Siroli, G. P.; Tosi, N.] Univ Bologna, Bologna, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Di Mattia, A.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] INFN, Sez Catania, Catania, Italy. [Albergo, S.; Chiorboli, M.; Costa, S.; Giordano, F.; Potenza, R.; Tricomi, A.; Tuve, C.] Univ Catania, Catania, Italy. [Barbagli, G.; Ciulli, V.; Civinini, C.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Meschini, M.; Paoletti, S.; Sguazzoni, G.; Viliani, L.] INFN, Sez Firenze, Florence, Italy. [Ciulli, V.; D'Alessandro, R.; Focardi, E.; Gori, V.; Lenzi, P.; Viliani, L.] Univ Firenze, Florence, Italy. [Fabbri, F.; Benussi, L.; Bianco, S.; Piccolo, D.; Primavera, F.] INFN, Lab Nazl Frascati, Frascati, Italy. [Calvelli, V.; Ferro, F.; Lo Vetere, M.; Monge, M. R.; Robutti, E.; Tosi, S.] INFN, Sez Genova, Genoa, Italy. [Calvelli, V.; Lo Vetere, M.; Monge, M. R.; Tosi, S.] Univ Genoa, Genoa, Italy. [Dinardo, M. E.; Fiorendi, S.; Gennai, S.; Ghezzi, A.; Govoni, P.; Malvezzi, S.; Manzoni, R. A.; Marzocchi, B.; Menasce, D.; Moroni, L.; Paganoni, M.; Pedrini, D.; Ragazzi, S.; de Fatis, T. Tabarelli] INFN, Sez Milano Bicocca, Milan, Italy. [Dinardo, M. E.; Fiorendi, S.; Ghezzi, A.; Govoni, P.; Manzoni, R. A.; Marzocchi, B.; Paganoni, M.; Ragazzi, S.; de Fatis, T. Tabarelli] Univ Milano Bicocca, Milan, Italy. [Buontempo, S.; Cavallo, N.; Di Guida, S.; Esposito, M.; Fabozzi, F.; Iorio, A. O. M.; Lanza, G.; Lista, L.; Meola, S.; Paolucci, P.; Sciacca, C.] INFN, Sez Napoli, Naples, Italy. [Esposito, M.; Iorio, A. O. M.; Sciacca, C.] Univ Naples Federico II, Naples, Italy. [Cavallo, N.; Fabozzi, F.] Univ Basilicata, Potenza, Italy. [Di Guida, S.; Meola, S.] Univ G Marconi, Rome, Italy. [Azzi, P.; Bacchetta, N.; Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; De Oliveira, A. Carvalho Antunes; Checchia, P.; Dall'Osso, M.; Manzano, P. De Castro; Dorigo, T.; Dosselli, U.; Gasparini, F.; Gasparini, U.; Gozzelino, A.; Lacaprara, S.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Torassa, E.; Zotto, P.; Zucchetta, A.; Zumerle, G.] INFN, Sez Padova, Padua, Italy. [Benato, L.; Bisello, D.; Boletti, A.; Carlin, R.; De Oliveira, A. Carvalho Antunes; Dall'Osso, M.; Gasparini, F.; Gasparini, U.; Margoni, M.; Meneguzzo, A. T.; Pazzini, J.; Pozzobon, N.; Ronchese, P.; Simonetto, F.; Zotto, P.; Zucchetta, A.; Zumerle, G.] Univ Padua, Padua, Italy. Univ Trento, Trento, Italy. [Braghieri, A.; Magnani, A.; Montagna, P.; Ratti, S. P.; Re, V.; Riccardi, C.; Salvini, P.; Vai, I.; Vitulo, P.] INFN, Sez Pavia, Pavia, Italy. [Magnani, A.; Montagna, P.; Ratti, S. P.; Riccardi, C.; Vai, I.; Vitulo, P.] Univ Pavia, Pavia, Italy. [Solestizi, L. Alunni; Bilei, G. M.; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Menichelli, M.; Saha, A.; Santocchia, A.] INFN, Sez Perugia, Perugia, Italy. [Solestizi, L. Alunni; Ciangottini, D.; Fano, L.; Lariccia, P.; Leonardi, R.; Mantovani, G.; Santocchia, A.] Univ Perugia, Perugia, Italy. [Androsov, K.; Azzurri, P.; Bagliesi, G.; Bernardini, J.; Boccali, T.; Castaldi, R.; Ciocci, M. A.; Dell'Orso, R.; Donato, S.; Giassi, A.; Grippo, M. T.; Ligabue, F.; Lomtadze, T.; Martini, L.; Messineo, A.; Palla, F.; Rizzi, A.; Savoy-Navarro, A.; Spagnolo, P.; Tenchini, R.; Tonelli, G.; Venturi, A.; Verdini, P. C.] INFN, Sez Pisa, Pisa, Italy. [Martini, L.; Messineo, A.; Rizzi, A.; Antonelli, L.] Univ Pisa, Pisa, Italy. [Donato, S.; Ligabue, F.] Scuola Normale Super Pisa, Pisa, Italy. [Barone, L.; Cavallari, F.; Cipriani, M.; D'imperio, G.; Del Re, D.; Diemoz, M.; Gelli, S.; Jorda, C.; Longo, E.; Margaroli, F.; Meridiani, P.; Organtini, G.; Paramatti, R.; Preiato, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.] INFN, Sez Roma, Rome, Italy. [Barone, L.; Cipriani, M.; D'imperio, G.; Del Re, D.; Gelli, S.; Longo, E.; Margaroli, F.; Organtini, G.; Preiato, F.; Rahatlou, S.; Santanastasio, F.] Univ Roma, Rome, Italy. [Amapane, N.; Arcidiacono, R.; Argiro, S.; Arneodo, M.; Bartosik, N.; Bellan, R.; Biino, C.; Cartiglia, N.; Cenna, F.; Costa, M.; Covarelli, R.; Degano, A.; Demaria, N.; Finco, L.; Kiani, B.; Mariotti, C.; Maselli, S.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Pastrone, N.; Pelliccioni, M.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Ruspa, M.; Sacchi, R.; Shchelina, K.; Sola, V.; Solano, A.; Staiano, A.; Traczyk, P.] INFN, Sez Torino, Turin, Italy. [Amapane, N.; Argiro, S.; Bellan, R.; Cenna, F.; Costa, M.; Covarelli, R.; Degano, A.; Finco, L.; Kiani, B.; Migliore, E.; Monaco, V.; Monteil, E.; Obertino, M. M.; Pacher, L.; Angioni, G. L. Pinna; Ravera, F.; Romero, A.; Sacchi, R.; Shchelina, K.; Solano, A.; Traczyk, P.] Univ Torino, Turin, Italy. [Arcidiacono, R.; Arneodo, M.; Ruspa, M.] Univ Piemonte Orientale, Novara, Italy. [Belforte, S.; Casarsa, M.; Cossutti, F.; Della Ricca, G.; La Licata, C.; Schizzi, A.; Zanetti, A.] INFN, Sez Trieste, Trieste, Italy. [Della Ricca, G.; La Licata, C.; Schizzi, A.] Univ Trieste, Trieste, Italy. [Kim, D. H.; Kim, G. N.; Kim, M. S.; Lee, S.; Lee, S. W.; Oh, Y. D.; Sekmen, S.; Son, D. C.; Yang, Y. C.] Kyungpook Natl Univ, Daegu, South Korea. [Lee, A.] Chonbuk Natl Univ, Jeonju, South Korea. [Cifuentes, J. A. Brochero; Kim, T. J.] Hanyang Univ, Seoul, South Korea. [Lee, S.; Choi, S.; Go, Y.; Gyun, D.; Ha, S.; Hong, B.; Jo, Y.; Kim, Y.; Lee, B.; Lee, K.; Lee, K. S.; Lim, J.; Park, S. K.; Roh, Y.] Korea Univ, Seoul, South Korea. [Almond, J.; Kim, J.; Oh, S. B.; Seo, S. H.; Yang, U. K.; Yoo, H. D.; Yu, G. B.] Seoul Natl Univ, Seoul, South Korea. [Choi, M.; Kim, H.; Kim, J. H.; Lee, J. S. H.; Park, I. C.; Ryu, G.; Ryu, M. S.] Univ Seoul, Seoul, South Korea. [Choi, Y.; Goh, J.; Hwang, C.; Lee, J.; Yu, I.] Sungkyunkwan Univ, Suwon, South Korea. [Dudenas, V.; Juodagalvis, A.; Vaitkus, J.] Vilnius Univ, Vilnius, Lithuania. [Ahmed, I.; Ibrahim, Z. A.; Komaragiri, J. R.; Ali, M. A. B. Md; Idris, F. Mohamad; Abdullah, W. A. T. Wan; Yusli, M. N.; Zolkapli, Z.] Univ Malaya, Natl Ctr Particle Phys, Kuala Lumpur, Malaysia. [Castilla-Valdez, H.; De La Cruz-Burelo, E.; Heredia-De La Cruz, I.; Hernandez-Almada, A.; Lopez-Fernandez, R.; Mejia Guisao, J.; Sanchez-Hernandez, A.] IPN, Ctr Invest & Estudios Avanzados, Mexico City, DF, Mexico. [Carrillo Moreno, S.; Oropeza Barrera, C.; Acosta, M. Vazquez] Univ Iberoamer, Mexico City, DF, Mexico. [Carpinteyro, S.; Pedraza, I.; Salazar Ibarguen, H. A.; Uribe Estrada, C.] Benemerita Univ Autonoma Puebla, Puebla, Mexico. [Morelos Pineda, A.] Univ Autonoma San Luis Potosi, San Luis Potosi, Mexico. [Krofcheck, D.] Univ Auckland, Auckland, New Zealand. [Butler, P. H.] Univ Canterbury, Christchurch, New Zealand. [Ahmad, M.; Ahmad, A.; Hassan, Q.; Hoorani, H. R.; Khan, W. A.; Shah, M. A.; Shoaib, M.; Waqas, M.] Quaid I Azam Univ, Natl Ctr Phys, Islamabad, Pakistan. [Bialkowska, H.; Bluj, M.; Boimska, B.; Frueboes, T.; Gorski, M.; Kazana, M.; Nawrocki, K.; Romanowska-Rybinska, K.; Szleper, M.; Zalewski, P.] Natl Ctr Nucl Res, Otwock, Poland. [Bunkowski, K.; Byszuk, A.; Doroba, K.; Kalinowski, A.; Konecki, M.; Krolikowski, J.; Misiura, M.; Olszewski, M.; Walczak, M.] Univ Warsaw, Fac Phys, Inst Expt Phys, Warsaw, Poland. [Bargassa, P.; Da Cruz E Silva, C. Beirao; Di Francesco, A.; Faccioli, P.; Ferreira Parracho, P. G.; Gallinaro, M.; Hollar, J.; Leonardo, N.; Lloret Iglesias, L.; Nemallapudi, M. V.; Rodrigues Antunes, J.; Seixas, J.; Toldaiev, O.; Vadruccio, D.; Varela, J.; Vischia, P.] Lab Instrumentacao & Fis Expt Particulas, Lisbon, Portugal. [Afanasiev, S.; Bunin, P.; Gavrilenko, M.; Golutvin, I.; Gorbunov, I.; Kamenev, A.; Karjavin, V.; Laney, A.; Malakhov, A.; Matveev, V.; Moisenz, P.; Palichik, V.; Perelygin, V.; Shmatov, S.; Shulha, S.; Skatchkov, N.; Smirnov, V.; Voytishin, N.; Zarubin, A.] Joint Inst Nucl Res, Dubna, Russia. [Chtchipounov, L.; Golovtsov, V.; Ivanov, Y.; Kim, V.; Kuznetsova, E.; Murzin, V.; Oreshkin, V.; Sulimov, V.; Vorobyev, A.] Petersburg Nucl Phys Inst, St Petersburg, Russia. [Andreev, Yu.; Dermenev, A.; Gninenko, S.; Golubev, N.; Karneyeu, A.; Kirsanov, M.; Krasnikov, N.; Pashenkov, A.; Tlisov, D.; Toropin, A.] Inst Nucl Res, Moscow, Russia. [Epshteyn, V.; Gavrilov, V.; Lychkovskaya, N.; Popov, V.; Pozdnyakov, I.; Safronov, G.; Spiridonov, A.; Toms, M.; Vlasov, E.; Zhokin, A.] Inst Theoret & Expt Phys, Moscow, Russia. [Chistov, R.; Rusinov, V.; Tarkovskii, E.] Natl Res Nucl Univ, Moscow Engn Phys Inst MEPhI, Moscow, Russia. [Andreev, V.; Azarkin, M.; Dremin, I.; Kirakosyan, M.; Leonidov, A.; Rusakov, S. V.; Terkulov, A.] PN Lebedev Phys Inst, Moscow, Russia. [Baskakov, A.; Belyaev, A.; Boos, E.; Dubinin, M.; Dudko, L.; Ershov, A.; Gribushin, A.; Klyukhin, V.; Kodolova, O.; Lokhtin, I.; Miagkov, I.; Obraztsov, S.; Petrushanko, S.; Savrin, V.; Snigirev, A.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Azhgirey, I.; Bayshev, I.; Bitioukov, S.; Elumakhov, D.; Kachanov, V.; Kalinin, A.; Konstantinov, D.; Krychkine, V.; Petrov, V.; Ryutin, R.; Sobol, A.; Troshin, S.; Tyurin, N.; Uzunian, A.; Volkov, A.] State Res Ctr Russian Federat, Inst High Energy Phys, Protvino, Russia. [Adzic, P.; Cirkovic, P.; Devetak, D.; Milosevic, J.; Rekovic, V.] Univ Belgrade, Fac Phys, Belgrade, Serbia. [Alcaraz Maestre, J.; Calvo, E.; Cerrada, M.; Chamizo Llatas, M.; Colino, N.; De La Cruz, B.; Delgado Peris, A.; Escalante Del Valle, A.; Fernandez Bedoya, C.; Fernandez Ramos, J. P.; Flix, J.; Fouz, M. C.; Garcia-Abia, P.; Gonzalez Lopez, O.; Goy Lopez, S.; Hernandez, J. M.; Josa, M. I.; Navarro De Martino, E.; Perez-Calero Yzquierdo, A.; Puerta Pelayo, J.; Quintario Olmeda, A.; Redondo, I.; Romero, L.; Soares, M. S.] CIEMAT, Madrid, Spain. [de Troconiz, J. F.; Missiroli, M.; Moran, D.] Univ Autonoma Madrid, Madrid, Spain. [Cuevas, J.; Fernandez Menendez, J.; Gonzalez Caballero, I.; Gonzalez Fernandez, J. R.; Palencia Cortezon, E.; Sanchez Cruz, S.; Suarez Andres, I.; Vizan Garcia, J. M.] Univ Oviedo, Oviedo, Spain. [Cabrillo, I. J.; Calderon, A.; Castineiras De Saa, J. R.; Curras, E.; Fernandez, M.; Garcia-Ferrero, J.; Gomez, G.; Lopez Virto, A.; Marco, J.; Martinez Rivero, C.; Matorras, F.; Piedra Gomez, J.; Rodrigo, T.; Ruiz-Jimeno, A.; Scodellaro, L.; Trevisani, N.; Vila, I.; Vilar Cortabitarte, R.] Univ Cantabria, CSIC, Inst Fis Cantabria IFCA, Santander, Spain. [Organtini, G.; Abbaneo, D.; Auffray, E.; Auzinger, G.; Bachtis, M.; Baillon, P.; Ball, A. H.; Barney, D.; Bloch, P.; Bocci, A.; Bonato, A.; Botta, C.; Camporesi, T.; Castello, R.; Cepeda, M.; Cerminara, G.; D'Alfonso, M.; d'Enterria, D.; Dabrowski, A.; Daponte, V.; David, A.; De Gruttola, M.; De Guio, F.; De Roeck, A.; Di Marco, E.; Dobson, M.; Dordevic, M.; Dorney, B.; du Pree, T.; Duggan, D.; Dunser, M.; Dupont, N.; Elliott-Peisert, A.; Fartoukh, S.; Franzoni, G.; Fulcher, J.; Funk, W.; Gigi, D.; Gill, K.; Girone, M.; Glege, F.; Gulhan, D.; Gundacker, S.; Guthoff, M.; Hammer, J.; Harris, P.; Hegeman, J.; Innocente, V.; Janot, P.; Kirschenmann, H.; Knunz, V.; Kornmayer, A.; Kortelainen, M. J.; Kousouris, K.; Krammer, M.; Lecoq, P.; Lourenco, C.; Lucchini, M. T.; Malgeri, L.; Mannelli, M.; Martelli, A.; Meijers, F.; Mersi, S.; Meschi, E.; Moortgat, F.; Morovic, S.; Mulders, M.; Neugebauer, H.; Orsini, L.; Pape, L.; Perez, E.; Peruzzi, M.; Petrilli, A.; Petrucciani, G.; Pfeiffer, A.; Pierini, M.; Racz, A.; Reis, T.; Rolandi, G.; Rovere, M.; Ruan, M.; Sakulin, H.; Sauvan, J. B.; Schafer, C.; Schwick, C.; Seidel, M.; Sharma, A.; Silva, P.; Simon, M.; Sphicas, P.; Steggemann, J.; Stoye, M.; Takahashi, Y.; Tosi, M.; Treille, D.; Triossi, A.; Tsirou, A.; Veckalns, V.; Veres, G. I.; Wardle, N.; Zagozdzinska, A.; Zeuner, W. D.] CERN, European Org Nucl Res, Geneva, Switzerland. [Bertl, W.; Deiters, K.; Erdmann, W.; Horisberger, R.; Ingram, Q.; Kaestli, H. C.; Kotlinski, D.; Langenegger, U.; Rohe, T.] Paul Scherrer Inst, Villigen, Switzerland. [Bachmair, F.; Bani, L.; Bianchini, L.; Casal, B.; Dissertori, G.; Dittmar, M.; Donega, M.; Eller, P.; Grab, C.; Heidegger, C.; Hits, D.; Hoss, J.; Kasieczka, G.; Lecomte, P.; Lustermann, W.; Mangano, B.; Marionneau, M.; del Arbol, P. Martinez Ruiz; Masciovecchio, M.; Meinhard, M. T.; Meister, D.; Micheli, F.; Musella, P.; Nessi-Tedaldi, F.; Pandolfi, F.; Pata, J.; Pauss, F.; Perrin, G.; Perrozzi, L.; Quittnat, M.; Rossini, M.; Schonenberger, M.; Starodumov, A.; Takahashi, M.; Tavolaro, V. R.; Theofilatos, K.; Wallny, R.] Swiss Fed Inst Technol, Inst Particle Phys, Zurich, Switzerland. [Aarrestad, T. K.; Amsler, C.; Caminada, L.; Canelli, M. F.; Chiochia, V.; De Cosa, A.; Galloni, C.; Hinzmann, A.; Hreus, T.; Kilminster, B.; Lange, C.; Ngadiuba, J.; Pinna, D.; Rauco, G.; Robmann, P.; Salerno, D.; Yang, Y.] Univ Zurich, Zurich, Switzerland. [Candelise, V.; Doan, T. H.; Jain, Sh.; Khurana, R.; Konyushikhin, M.; Kuo, C. M.; Lin, W.; Lu, Y. J.; Pozdnyakov, A.; Yu, S. S.] Natl Cent Univ, Chungli, Taiwan. [Kumar, Arun; Chang, P.; Chang, Y. H.; Chang, Y. W.; Chao, Y.; Chen, K. F.; Chen, P. H.; Dietz, C.; Fiori, F.; Hou, W. -S.; Hsiung, Y.; Liu, Y. F.; Lu, R-S.; Moya, M. Minano; Paganis, E.; Psallidas, A.; Tsai, J. F.; Tzeng, Y. M.] Natl Taiwan Univ, Taipei, Taiwan. [Asavapibhop, B.; Singh, G.; Srimanobhas, N.; Suwonjandee, N.] Chulalongkorn Univ, Dept Phys, Fac Sci, Bangkok, Thailand. [Adiguzel, A.; Cerci, S.; Damarseckin, S.; Demiroglu, Z. S.; Dozen, C.; Dumanoglu, I.; Girgis, S.; Gokbulut, G.; Guler, Y.; Gurpinar, E.; Hos, I.; Kangal, E. E.; Kara, O.; Topaksu, A. Kayis; Kiminsu, U.; Oglakci, M.; Onengut, G.; Ozdemir, K.; Cerci, D. Sunar; Turkcapar, S.; Zorbakir, I. S.; Zorbilmez, C.] Cukurova Univ, Adana, Turkey. [Bilin, B.; Bilmis, S.; Isildak, B.; Karapinar, G.; Yalvac, M.; Zeyrek, M.] Middle East Tech Univ, Dept Phys, Ankara, Turkey. [Gulmez, E.; Kaya, M.; Kaya, O.; Yetkin, E. A.; Yetkin, T.] Bogazici Univ, Istanbul, Turkey. [Cakir, A.; Cankocak, K.; Sen, S.] Istanbul Tech Univ, Istanbul, Turkey. [Grynyov, B.] Natl Acad Sci Ukraine, Inst Scintillat Mat, Kharkov, Ukraine. [Levchuk, L.; Sorokin, P.] Kharkov Inst Phys & Technol, Natl Sci Ctr, Kharkov, Ukraine. [Aggleton, R.; Ball, F.; Beck, L.; Brooke, J. J.; Burns, D.; Clement, E.; Cussans, D.; Flacher, H.; Goldstein, J.; Grimes, M.; Heath, G. P.; Heath, H. F.; Jacob, J.; Kreczko, L.; Lucas, C.; Newbold, D. M.; Paramesvaran, S.; Poll, A.; Sakuma, T.; El Nasr-Storey, S. Seif; Smith, D.; Smith, V. J.] Univ Bristol, Bristol, Avon, England. [Bell, K. W.; Belyaev, A.; Brew, C.; Brown, R. M.; Calligaris, L.; Cieri, D.; Cockerill, D. J. A.; Coughlan, J. A.; Harder, K.; Harper, S.; Olaiya, E.; Petyt, D.; Shepherd-Themistocleous, C. H.; Thea, A.; Tomalin, I. R.; Williams, T.] Rutherford Appleton Lab, Didcot, Oxon, England. [Baber, M.; Bainbridge, R.; Buchmuller, O.; Bundock, A.; Burton, D.; Casasso, S.; Citron, M.; Colling, D.; Corpe, L.; Dauncey, P.; Davies, G.; De Wit, A.; Della Negra, M.; Dunne, P.; Elwood, A.; Futyan, D.; Haddad, Y.; Hall, G.; Iles, G.; Lane, R.; Laner, C.; Lucas, R.; Lyons, L.; Magnan, A. -M.; Malik, S.; Mastrolorenzo, L.; Nash, J.; Nikitenko, A.; Pela, J.; Uchida, K.; Acosta, M. Vazquez; Virdee, T.; Zenz, S. C.] Imperial Coll, London, England. [Cole, J. E.; Hobson, P. R.; Khan, A.; Kyberd, P.; Leslie, D.; Reid, I. D.; Symonds, P.; Teodorescu, L.; Turner, M.] Brunel Univ, Uxbridge, Middx, England. [Borzou, A.; Call, K.; Dittmann, J.; Hatakeyama, K.; Liu, H.; Pastika, N.] Baylor Univ, Waco, TX 76798 USA. [Charaf, O.; Cooper, S. I.; Henderson, C.; Rumerio, P.] Univ Alabama, Tuscaloosa, AL USA. [Arcaro, D.; Avetisyan, A.; Bose, T.; Gastler, D.; Rankin, D.; Richardson, C.; Rohlf, J.; Sulak, L.; Zou, D.] Boston Univ, Boston, MA 02215 USA. [Benelli, G.; Berry, E.; Cutts, D.; Garabedian, A.; Hakala, J.; Heintz, U.; Hogan, J. M.; Jesus, O.; Laird, E.; Landsberg, G.; Mao, Z.; Narain, M.; Piperov, S.; Sagir, S.; Spencer, E.; Syarif, R.] Brown Univ, Providence, RI 02912 USA. [Chauhan, S.; Burns, D.; Breedon, R.; Breto, G.; Sanchez, M. Calderon De La Barca; Chertok, M.; Conway, J.; Conway, R.; Cox, P. T.; Erbacher, R.; Flores, C.; Funk, G.; Gardner, M.; Ko, W.; Lander, R.; Mclean, C.; Mulhearn, M.; Pellett, D.; Pilot, J.; Ricci-Tam, F.; Shalhout, S.; Smith, J.; Squires, M.; Stolp, D.; Tripathi, M.; Wilbur, S.; Yohay, R.] Univ Calif Davis, Davis, CA 95616 USA. [Weber, M.; Cousins, R.; Everaerts, P.; Florent, A.; Hauser, J.; Ignatenko, M.; Saltzberg, D.; Takasugi, E.; Valuev, V.] Univ Calif Los Angeles, Los Angeles, CA USA. [Burt, K.; Clare, R.; Ellison, J.; Gary, J. W.; Hanson, G.; Heilman, J.; Jandir, P.; Kennedy, E.; Lacroix, F.; Long, O. R.; Malberti, M.; Negrete, M. Olmedo; Paneva, M. I.; Shrinivas, A.; Wei, H.; Wimpenny, S.; Yates, B. R.] Univ Calif Riverside, Riverside, CA 92521 USA. [Sharma, V.; Branson, J. G.; Cerati, G. B.; Cittolin, S.; Derdzinski, M.; Gerosa, R.; Holzner, A.; Klein, D.; Krutelyov, V.; Letts, J.; Macneill, I.; Olivito, D.; Padhi, S.; Pieri, M.; Sani, M.; Simon, S.; Tadel, M.; Vartak, A.; Wasserbaech, S.; Welke, C.; Wood, J.; Wurthwein, F.; Yagil, A.; Della Porta, G. Zevi] Univ Calif San Diego, La Jolla, CA 92093 USA. [Bhandari, R.; Bradmiller-Feld, J.; Campagnari, C.; Dishaw, A.; Dutta, V.; Flowers, K.; Sevilla, M. Franco; Geffert, P.; George, C.; Golf, F.; Gouskos, L.; Gran, J.; Heller, R.; Incandela, J.; Mccoll, N.; Mullin, S. D.; Ovcharova, A.; Richman, J.; Stuart, D.; Suarez, I.; West, C.; Yoo, J.] Univ Calif Santa Barbara, Santa Barbara, CA 93106 USA. [Anderson, D.; Apresyan, A.; Bendavid, J.; Bornheim, A.; Bunn, J.; Chen, Y.; Duarte, J.; Mott, A.; Newman, H. B.; Pena, C.; Spiropulu, M.; Vlimant, J. R.; Xie, S.; Zhu, R. Y.] CALTECH, Pasadena, CA 91125 USA. [Andrews, M. B.; Azzolini, V.; Carlson, B.; Ferguson, T.; Paulini, M.; Russ, J.; Sun, M.; Vogel, H.; Vorobiev, I.] Carnegie Mellon Univ, Pittsburgh, PA 15213 USA. [Cumalat, J. P.; Ford, W. T.; Jensen, F.; Johnson, A.; Krohn, M.; Mulholland, T.; Stenson, K.; Wagner, S. R.] Univ Colorado Boulder, Boulder, CO USA. [Alexander, J.; Chaves, J.; Chu, J.; Dittmer, S.; Mcdermott, K.; Mirman, N.; Kaufman, G. Nicolas; Patterson, J. R.; Rinkevicius, A.; Ryd, A.; Skinnari, L.; Soffi, L.; Tan, S. M.; Tao, Z.; Thom, J.; Tucker, J.; Wittich, P.; Zientek, M.] Cornell Univ, Ithaca, NY USA. [Winn, D.] Fairfield Univ, Fairfield, CT 06430 USA. [Banerjee, S.; Abdullin, S.; Albrow, M.; Apollinari, G.; Bauerdick, L. A. T.; Beretvas, A.; Berryhill, J.; Bhat, P. C.; Bolla, G.; Burkett, K.; Butler, J. N.; Cheung, H. W. K.; Chlebana, F.; Cihangir, S.; Cremonesi, M.; Elvira, V. D.; Fisk, I.; Freeman, J.; Gottschalk, E.; Gray, L.; Green, D.; Grunendahl, S.; Gutsche, O.; Hare, D.; Harris, R. M.; Hasegawa, S.; Hirschauer, J.; Hu, Z.; Jayatilaka, B.; Jindariani, S.; Johnson, M.; Joshi, U.; Klima, B.; Kreis, B.; Lammel, S.; Linacre, J.; Lincoln, D.; Lipton, R.; Liu, T.; De Sa, R. Lopes; Lykken, J.; Maeshima, K.; Magini, N.; Marraffino, J. M.; Maruyama, S.; Mason, D.; McBride, P.; Merkel, P.; Mrenna, S.; Nahn, S.; Newman-Holmes, C.; O'Dell, V.; Pedro, K.; Prokofyev, O.; Rakness, G.; Ristori, L.; Sexton-Kennedy, E.; Soha, A.; Spalding, W. J.; Spiegel, L.; Stoynev, S.; Strobbe, N.; Taylor, L.; Tkaczyk, S.; Tran, N. V.; Uplegger, L.; Vaandering, E. W.; Vernieri, C.; Verzocchi, M.; Vidal, R.; Wang, M.; Weber, H. A.; Whitbeck, A.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Acosta, D.; Avery, P.; Bortignon, P.; Bourilkov, D.; Brinkerhoff, A.; Carnes, A.; Carver, M.; Curry, D.; Das, S.; Field, R. D.; Furic, I. K.; Konigsberg, J.; Korytov, A.; Ma, P.; Matchev, K.; Mei, H.; Milenovic, P.; Mitselmakher, G.; Rank, D.; Shchutska, L.; Sperka, D.; Thomas, L.; Wang, J.; Wang, S.; Yelton, J.] Univ Florida, Gainesville, FL USA. [Linn, S.; Markowitz, P.; Martinez, G.; Rodriguez, J. L.] Florida Int Univ, Miami, FL 33199 USA. [Ackert, A.; Adams, J. R.; Adams, T.; Askew, A.; Bein, S.; Diamond, B.; Hagopian, S.; Hagopian, V.; Johnson, K. F.; Khatiwada, A.; Prosper, H.; Santra, A.; Weinberg, M.] Florida State Univ, Tallahassee, FL 32306 USA. [Baarmand, M. M.; Bhopatkar, V.; Colafranceschi, S.; Hohlmann, M.; Noonan, D.; Roy, T.; Yumiceva, F.] Florida Inst Technol, Melbourne, FL 32901 USA. [Adams, M. R.; Apanasevich, L.; Berry, D.; Betts, R. R.; Bucinskaite, I.; Cavanaugh, R.; Evdokimov, O.; Gauthier, L.; Gerber, C. E.; Hofman, D. J.; Kurt, P.; O'Brien, C.; Gonzalez, I. D. Sandoval; Turner, P.; Varelas, N.; Wang, H.; Wu, Z.; Zakaria, M.; Zhang, J.] Univ Illinois, Chicago, IL USA. [Bilki, B.; Clarida, W.; Dilsiz, K.; Durgut, S.; Gandrajula, R. P.; Haytmyradov, M.; Khristenko, V.; Merlo, J-P.; Mermerkaya, H.; Mestvirishvili, A.; Moeller, A.; Nachtman, J.; Ogul, H.; Onel, Y.; Ozok, F.; Penzo, A.; Snyder, C.; Tiras, E.; Wetzel, J.; Yi, K.] Univ Iowa, Iowa City, IA USA. [Anderson, I.; Blumenfeld, B.; Cocoros, A.; Eminizer, N.; Fehling, D.; Feng, L.; Gritsan, A. V.; Maksimovic, P.; Osherson, M.; Roskes, J.; Sarica, U.; Swartz, M.; Xiao, M.; Xin, Y.; You, C.] Johns Hopkins Univ, Baltimore, MD USA. [Al-Bataineh, A.; Baringer, P.; Bean, A.; Bowen, J.; Bruner, C.; Castle, J.; Kenny, R. P., III; Kropivnitskaya, A.; Majumder, D.; Mcbrayer, W.; Murray, M.; Sanders, S.; Stringer, R.; Takaki, J. D. Tapia; Wang, Q.] Univ Kansas, Lawrence, KS 66045 USA. [Ivanov, A.; Kaadze, K.; Khalil, S.; Makouski, M.; Maravin, Y.; Mohammadi, A.; Saini, L. K.; Skhirtladze, N.; Toda, S.] Kansas State Univ, Manhattan, KS 66506 USA. [Lange, D.; Rebassoo, F.; Wright, D.] Lawrence Livermore Natl Lab, Livermore, CA USA. [Anelli, C.; Baden, A.; Baron, O.; Belloni, A.; Calvert, B.; Eno, S. C.; Ferraioli, C.; Gomez, J. A.; Hadley, N. J.; Jabeen, S.; Kellogg, R. G.; Kolberg, T.; Kunkle, J.; Lu, Y.; Mignerey, A. C.; Shin, Y. H.; Skuja, A.; Tonjes, M. B.; Tonwar, S. C.] Univ Maryland, College Pk, MD 20742 USA. [Wang, J.; Abercrombie, D.; Allen, B.; Apyan, A.; Barbieri, R.; Baty, A.; Bi, R.; Bierwagen, K.; Brandt, S.; Busza, W.; Cali, I. A.; Demiragli, Z.; Di Matteo, L.; Ceballos, G. Gomez; Goncharov, M.; Hsu, D.; Iiyama, Y.; Innocenti, G. M.; Klute, M.; Kovalskyi, D.; Krajczar, K.; Lai, Y. S.; Lee, Y. -J.; Levin, A.; Luckey, P. D.; Marini, A. C.; Mcginn, C.; Mironov, C.; Narayanan, S.; Niu, X.; Paus, C.; Roland, C.; Roland, G.; Salfeld-Nebgen, J.; Stephans, G. S. F.; Sumorok, K.; Tatar, K.; Varma, M.; Velicanu, D.; Veverka, J.; Wang, T. 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[Cooperstein, S.; Driga, O.; Elmer, P.; Hardenbrook, J.; Hebda, P.; Luo, J.; Marlow, D.; Medvedeva, T.; Mooney, M.; Olsen, J.; Palmer, C.; Piroue, P.; Stickland, D.; Tully, C.; Zuranski, A.] Princeton Univ, Princeton, NJ 08544 USA. [Malik, S.] Univ Puerto Rico, Mayaguez, PR USA. [Barker, A.; Barnes, V. E.; Benedetti, D.; Folgueras, S.; Gutay, L.; Jha, M. K.; Jones, M.; Jung, A. W.; Jung, K.; Miller, D. H.; Neumeister, N.; Radburn-Smith, B. C.; Shi, X.; Sun, J.; Svyatkovskiy, A.; Wang, F.; Xie, W.; Xu, L.] Purdue Univ, W Lafayette, IN 47907 USA. [Parashar, N.; Stupak, J.] Purdue Univ Calumet, Hammond, LA USA. [Adair, A.; Akgun, B.; Chen, Z.; Ecklund, K. M.; Geurts, F. J. M.; Guilbaud, M.; Li, W.; Michlin, B.; Northup, M.; Padley, B. P.; Redjimi, R.; Roberts, J.; Rorie, J.; Tu, Z.; Zabel, J.] Rice Univ, Houston, TX USA. [Betchart, B.; Bodek, A.; de Barbaro, P.; Demina, R.; Duh, Y. T.; Ferbel, T.; Galanti, M.; Garcia-Bellido, A.; Han, J.; Hindrichs, O.; Khukhunaishvili, A.; Lo, K. 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K.; Silvestris, L.; Viliani, L.; Primavera, F.; Manzoni, R. A.; Di Guida, S.; Meola, S.; Paolucci, P.; Azzi, P.; Pazzini, J.; Azzurri, P.; D'imperio, G.; Del Re, D.; Arcidiacono, R.; Kornmayer, A.; Virdee, T.] CERN, European Org Nucl Res, Geneva, Switzerland. [Popov, A.; Zhukov, V.; Katkov, I.] Lomonosov Moscow State Univ, Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Toriashvili, T.] Tbilisi State Univ, Tbilisi, Rep of Georgia. [Borras, K.] Rhein Westfal TH Aachen, Phys Inst A3, Aachen, Germany. [Gallo, E.] Univ Hamburg, Hamburg, Germany. [Hempel, M.; Karacheban, O.; Lohmann, W.] Brandenburg Tech Univ Cottbus, Cottbus, Germany. [Horvath, D.] Inst Nucl Res ATOMKI, Debrecen, Hungary. [Vesztergombi, G.; Bartok, M.; Veres, G. I.] Eotvos Lorand Univ, MTA ELTE Lendulet CMS Particle & Nucl Phys Grp, Budapest, Hungary. [Karancsi, J.] Univ Debrecen, Debrecen, Hungary. [Choudhury, S.] Indian Inst Sci Educ & Res, Bhopal, India. [Nayak, A.] Inst Phys, Bhubaneswar, Orissa, India. 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RP Khachatryan, V (reprint author), Yerevan Phys Inst, Yerevan, Armenia. RI Manganote, Edmilson/K-8251-2013; Konecki, Marcin/G-4164-2015; Puljak, Ivica/D-8917-2017; Lokhtin, Igor/D-7004-2012; Della Ricca, Giuseppe/B-6826-2013; Fernandez Menendez, Javier/B-6550-2014; TUVE', Cristina/P-3933-2015; Terkulov, Adel/M-8581-2015; Goh, Junghwan/Q-3720-2016 OI Konecki, Marcin/0000-0001-9482-4841; Della Ricca, Giuseppe/0000-0003-2831-6982; Fernandez Menendez, Javier/0000-0002-5213-3708; TUVE', Cristina/0000-0003-0739-3153; Goh, Junghwan/0000-0002-1129-2083 FU BMWFW (Austria); FWF (Austria); FNRS (Belgium); FWO (Belgium); CNPq (Brazil); CAPES (Brazil); FAPERJ (Brazil); FAPESP (Brazil); MES (Bulgaria); CERN (China); CAS (China); MoST (China); NSFC (China); COLCIENCIAS (Colombia); MSES (Croatia); CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER (Estonia); ERC IUT (Estonia); ERDF (Estonia); Academy of Finland (Finland); MEC (Finland); HIP (Finland); CEA (France); CNRS/IN2P3 (France); BMBF (Germany); DFG (Germany); HGF (Germany); GSRT (Greece); OTKA (Hungary); NIH (Hungary); DAE (India); DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP (Republic of Korea); NRF (Republic of Korea); LAS (Lithuania); MOE (Malaysia); UM (Malaysia); BUAP (Mexico); CINVESTAV (Mexico); CONACYT (Mexico); LNS (Mexico); SEP (Mexico); UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE (Poland); NSC (Poland); FCT (Portugal); JINR (Dubna); MON (Russia); RosAtom (Russia); RAS (Russia); RFBR (Russia); MESTD (Serbia); SEIDI (Spain); CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter (Thailand); IPST (Thailand); STAR (Thailand); NSTDA (Thailand); TUBITAK (Turkey); TAEK (Turkey); NASU (Ukraine); SFFR (Ukraine); STFC (United Kingdom); DOE (U.S.A.); NSF (U.S.A.); Marie-Curie program; European Research Council; EPLANET (European Union); Leventis Foundation; A. P. Sloan Foundation; Alexander von Humboldt Foundation; Belgian Federal Science Policy Office; Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; Council of Science and Industrial Research, India; HOMING PLUS program of the Foundation for Polish Science; European Union; Regional Development Fund; Mobility Plus program of the Ministry of Science and Higher Education; OPUS program [2014/13/B/ST2/02543]; National Science Center (Poland) [Sonata-bis DEC2012/07/E/ST2/01406]; Thalis program - EU-ESF; Aristeia program - EU-ESF; Greek NSRF; National Priorities Research Program by Qatar National Research Fund; Programa Clarin-COFUND del Principado de Asturias; Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University; Chulalongkorn Academic; Welch Foundation [C-1845] FX We congratulate our colleagues in the CERN accelerator departments for the excellent performance of the LHC and thank the technical and administrative staffs at CERN and at other CMS institutes for their contributions to the success of the CMS effort. In addition, we gratefully acknowledge the computing centers and personnel of the Worldwide LHC Computing Grid for delivering so effectively the computing infrastructure essential to our analyses. Finally, we acknowledge the enduring support for the construction and operation of the LHC and the CMS detector provided by the following funding agencies: BMWFW and FWF (Austria); FNRS and FWO (Belgium); CNPq, CAPES, FAPERJ, and FAPESP (Brazil); MES (Bulgaria); CERN; CAS, MoST, and NSFC (China); COLCIENCIAS (Colombia); MSES and CSF (Croatia); RPF (Cyprus); SENESCYT (Ecuador); MoER, ERC IUT and ERDF (Estonia); Academy of Finland, MEC, and HIP (Finland); CEA and CNRS/IN2P3 (France); BMBF, DFG, and HGF (Germany); GSRT (Greece); OTKA and NIH (Hungary); DAE and DST (India); IPM (Iran); SFI (Ireland); INFN (Italy); MSIP and NRF (Republic of Korea); LAS (Lithuania); MOE and UM (Malaysia); BUAP, CINVESTAV, CONACYT, LNS, SEP, and UASLP-FAI (Mexico); MBIE (New Zealand); PAEC (Pakistan); MSHE and NSC (Poland); FCT (Portugal); JINR (Dubna); MON, RosAtom, RAS and RFBR (Russia); MESTD (Serbia); SEIDI and CPAN (Spain); Swiss Funding Agencies (Switzerland); MST (Taipei); ThEPCenter, IPST, STAR and NSTDA (Thailand); TUBITAK and TAEK (Turkey); NASU and SFFR (Ukraine); STFC (United Kingdom); DOE and NSF (U.S.A.).; Individuals have received support from the Marie-Curie program and the European Research Council and EPLANET (European Union); the Leventis Foundation; the A. P. Sloan Foundation; the Alexander von Humboldt Foundation; the Belgian Federal Science Policy Office; the Fonds pour la Formation a la Recherche dans l'Industrie et dans l'Agriculture (FRIA-Belgium); the Agentschap voor Innovatie door Wetenschap en Technologie (IWT-Belgium); the Ministry of Education, Youth and Sports (MEYS) of the Czech Republic; the Council of Science and Industrial Research, India; the HOMING PLUS program of the Foundation for Polish Science, cofinanced from European Union, Regional Development Fund, the Mobility Plus program of the Ministry of Science and Higher Education, the OPUS program contract 2014/13/B/ST2/02543 and contract Sonata-bis DEC2012/07/E/ST2/01406 of the National Science Center (Poland); the Thalis and Aristeia programs cofinanced by EU-ESF and the Greek NSRF; the National Priorities Research Program by Qatar National Research Fund; the Programa Clarin-COFUND del Principado de Asturias; the Rachadapisek Sompot Fund for Postdoctoral Fellowship, Chulalongkorn University and the Chulalongkorn Academic into Its 2nd Century Project Advancement Project (Thailand); and the Welch Foundation, contract C-1845. NR 41 TC 1 Z9 1 U1 21 U2 21 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1029-8479 J9 J HIGH ENERGY PHYS JI J. High Energy Phys. 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Zhao, X. Zhao, Y. Zhao, Z. Zhemchugov, A. Zhong, J. Zhou, B. Zhou, C. Zhou, L. Zhou, L. Zhou, M. Zhou, N. Zhu, C. G. Zhu, H. Zhu, J. Zhu, Y. Zhuang, X. Zhukov, K. Zibell, A. Zieminska, D. Zimine, N. I. Zimmermann, C. Zimmermann, S. Zinonos, Z. Zinser, M. Ziolkowski, M. Zivkovic, L. Zobernig, G. Zoccoli, A. zur Nedden, M. Zurzolo, G. Zwalinski, L. CA ATLAS Collaboration TI Measurement of the b(b)over-bar dijet cross section in pp collisions at root s=7TeV with the ATLAS detector SO EUROPEAN PHYSICAL JOURNAL C LA English DT Article ID HEAVY-QUARK PRODUCTION; P(P)OVER-BAR COLLISIONS; 1.8 TEV; HADRONIC COLLISIONS; ROOT-S AB The dijet production cross section for jets containing a b-hadron (b-jets) has been measured in protonproton collisions with a centre-of-mass energy of root s = 7TeV, using the ATLAS detector at the LHC. The data used correspond to an integrated luminosity of 4.2 fb(-1). The cross section is measured for events with two identified b-jets with a transverse momentum pT > 20GeV and a minimum separation in the eta-phi plane of Delta R = 0.4. At least one of the jets in the event is required to have p(T) > 270GeV. The cross section is measured differentially as a function of dijet invariant mass, dijet transverse momentum, boost of the dijet system, and the rapidity difference, azimuthal angle and angular distance between the b-jets. The results are compared to different predictions of leading order and next-to-leading order perturbative quantum chromodynamics matrix elements supplemented with models for parton-showers and hadronization. C1 [Jackson, P.; Lee, L.; Petridis, A.; White, M. J.] Univ Adelaide, Dept Phys, Adelaide, SA, Australia. [Bouffard, J.; Ernst, J.; Fischer, A.; Guindon, S.; Jain, V.] SUNY Albany, Dept Phys, Albany, NY 12222 USA. [Czodrowski, P.; Dassoulas, J.; Dehghanian, N.; Gingrich, D. M.; Jabbar, S.; Karamaoun, A.; Moore, R. 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A.; Cristinziani, M.; Davey, W.; Desch, K.; Dingfelder, J.; Gaycken, G.; Geich-Gimbel, Ch.; Ghneimat, M.; Grefe, C.; Haefner, P.; Hageboeck, S.; Hansen, M. C.; Hohn, D.; Huegging, F.; Janssen, J.; Kostyukhin, V. V.; Kraus, J. K.; Kroseberg, J.; Krueger, H.; Lantzsch, K.; Lenz, T.; Leyko, A. M.; Liebal, J.; Mijovic, L.; Moles-Valls, R.; Obermann, T.; Pohl, D.; Ricken, O.; Sarrazin, B.; Schaepe, S.; Schopf, E.; Schultens, M. J.; Schwindt, T.; Seema, P.; Stillings, J. A.; von Toerne, E.; Wagner, P.; Wang, T.; Wermes, N.; Wienemann, P.; Wiik-Fuchs, L. A. M.; Winter, B. T.; Wong, K. H. Yau; Yuen, S. P. Y.; Zhang, R.] Univ Bonn, Inst Phys, Bonn, Germany. [Ahlen, S. P.; Black, K. M.; Butler, J. M.; Dell'Asta, L.; Helary, L.; Kruskal, M.; Long, B. A.; Shank, J. T.; Yan, Z.; Youssef, S.] Boston Univ, Dept Phys, 590 Commonwealth Ave, Boston, MA 02215 USA. [Amelung, C.; Amundsen, G.; Barone, G.; Bensinger, J. R.; Bianchini, L.; Blocker, C.; Coffey, L.; Dhaliwal, S.; Loew, K. 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V.; Pleier, M. -A.; Polychronakos, V.; Protopopescu, S.; Purohit, M.; Radeka, V.; Rajagopalan, S.; Redlinger, G.; Snyder, S.; Steinberg, P.; Takai, H.; Tricoli, A.; Undrus, A.; Wenaus, T.; Xu, L.; Ye, J.] Brookhaven Natl Lab, Dept Phys, Upton, NY 11973 USA. Transilvania Univ Brasov, Brasov, Romania. [Alexa, C.; Caprini, I.; Caprini, M.; Chitan, A.; Ciubancan, M.; Constantinescu, S.; Dita, P.; Dita, S.; Dobre, M.; Jinaru, A.; Martoiu, V. S.; Maurer, J.; Olariu, A.; Pantea, D.; Rotaru, M.; Stoicea, G.; Tudorache, A.; Tudorache, V.] Natl Inst Phys & Nucl Engn, Bucharest, Romania. [Popeneciu, G. A.] Natl Inst Res & Dev Isotop & Mol Technol, Dept Phys, Cluj Napoca, Romania. Univ Politeh Bucharest, Bucharest, Romania. [Gravila, P. M.] West Univ Timisoara, Timisoara, Romania. [Bossio Sola, J. D.; Marceca, G.; Otero y Garzon, G.; Piegaia, R.; Reisin, H.; Sacerdoti, S.] Univ Buenos Aires, Dept Fis, Buenos Aires, DF, Argentina. [Arratia, M.; Barlow, N.; Batley, J. R.; Brochu, F. M.; Brunt, Bh; Carter, J. R.; Chapman, J. D.; Cottin, G.; Gillam, T. P. S.; Hill, J. C.; Kaneti, S.; Lester, C. G.; Mueller, T.; Parker, M. A.; Potter, C. J.; Robinson, D.; Rosten, J. H. N.; Thomson, E.; Ward, C. P.; Yusuff, I.] Univ Cambridge, Cavendish Lab, Cambridge, England. [Bellerive, A.; Cree, G.; Di Valentino, D.; Gillberg, D.; Koffas, T.; Lacey, J.; Leight, W. A.; Nomidis, I.; Oakham, F. G.; Pasztor, G.; Ruiz-Martinez, A.; Ueno, R.; Vincter, M. G.] Carleton Univ, Dept Phys, Ottawa, ON, Canada. [Aleksa, M.; Aloisio, A.; Alonso, A.; Gonzalez, B. Alvarez; Amoroso, S.; Anders, G.; Anghinolfi, F.; Arnaez, O.; Avolio, G.; Baak, M. A.; Backes, M.; Backhaus, M.; Barak, L.; Beddall, A.; Beermann, T. A.; Beltramello, O.; Bianco, M.; Bogaerts, J. A.; Boveia, A.; Boyd, J.; Burckhart, H.; Camarda, S.; Campana, S.; Garrido, M. D. M. Capeans; Carli, T.; Carrillo-Montoya, G. D.; Catinaccio, A.; Cattai, A.; Cerv, M.; Chromek-Burckhart, D.; Colombo, T.; Conti, G.; Dell'Acqua, A.; Deviveiros, P. O.; Di Girolamo, A.; Di Girolamo, B.; Di Nardo, R.; Dittus, F.; Dobos, D.; Dudarev, A.; Duhrssen, M.; Eifert, T.; Ellis, N.; Elsing, M.; Farthouat, P.; Fassnacht, P.; Feng, E. J.; Francis, D.; Fressard-Batraneanu, S. M.; Froidevaux, D.; Gadatsch, S.; Glatzer, J.; Goossens, L.; Gorini, B.; Gray, H. M.; Gumpert, C.; Hawkings, R. J.; Helsens, C.; Correia, A. M. Henriques; Hervas, L.; Hoecker, A.; Huhtinen, M.; Iengo, P.; Jakobsen, S.; Jenni, P.; Klioutchnikova, T.; Krasznahorkay, A.; Lapoire, C.; Lassnig, M.; Miotto, G. Lehmann; Lenzi, B.; Lichard, P.; Malyukov, S.; Mandelli, B.; Manousos, A.; Mapelli, L.; Marzin, A.; Berlingen, J. Montejo; Mornacchi, G.; Nairz, A. M.; Nakahama, Y.; Nessi, M.; Nordberg, M.; Oide, H.; Palestini, S.; Pauly, T.; Pernegger, H.; Petersen, B. A.; Pommes, K.; Poppleton, A.; Poulard, G.; Poveda, J.; Astigarraga, M. E. Pozo; Rammensee, M.; Raymond, M.; Rembser, C.; Ritsch, E.; Roe, S.; Ruthmann, N.; Salzburger, A.; Schaefer, D.; Schlenker, S.; Schmieden, K.; Sforza, F.; Sanchez, C. A. Solans; Spigo, G.; Starz, S.; Stelzer, H. J.; Teischinger, F. A.; Ten Kate, H.; Unal, G.; van Woerden, M. C.; Vandelli, W.; Voss, R.; Vuillermet, R.; Wells, P. S.; Wengler, T.; Wenig, S.; Werner, P.; Wilkens, H. G.; Wotschack, J.; Young, C. J. S.; Zwalinski, L.] CERN, Geneva, Switzerland. [Alison, J.; Anderson, K. J.; Bassalat, A.; Beddall, A.; Bryant, P.; Toro, R. Camacho; Cheng, Y.; Dandoy, J. R.; Facini, G.; Gardner, R. W.; Kapliy, A.; Kim, Y. K.; Krizka, K.; Li, H. L.; Merritt, F. S.; Miller, D. W.; Okumura, Y.; Oreglia, M. J.; Pilcher, J. E.; Saxon, J.; Shochet, M. J.; Stark, G. H.; Swiatlowski, M.; Vukotic, I.; Wu, M.] Univ Chicago, Enrico Fermi Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA. [Blunier, S.; Diaz, M. A.; Ochoa-Ricoux, J. P.] Pontificia Univ Catolica Chile, Dept Fis, Santiago, Chile. [Brooks, W. K.; Carquin, E.; Kuleshov, S.; Pezoa, R.; Prokoshin, F.; Loyola, J. E. Salazar; Tapia Araya, S.; White, R.] Univ Tecn Federico Santa Maria, Dept Fis, Valparaiso, Chile. [Bai, Y.; da Costa, J. Barreiro Guimaraes; Cheng, H. J.; Fang, Y.; Jin, S.; Li, Q.; Liang, Z.; Merino, J. Llorente; Lou, X.; Mansour, J. D.; Ouyang, Q.; Peng, C.; Ren, H.; Shan, L. Y.; Sun, X.; Xu, D.; Zhu, H.; Zhuang, X.] Chinese Acad Sci, Inst High Energy Phys, Beijing, Peoples R China. [Beddall, A.; Gao, J.; Geng, C.; Guo, Y.; Han, L.; Hu, Q.; Jiang, Y.; Li, B.; Liu, J. B.; Liu, M.; Liu, Y. L.; Liu, Y.; Peng, H.; Song, H. Y.; Wang, W.; Zhang, G.; Zhang, R.; Zhao, Z.; Zhu, Y.] Univ Sci & Technol China, Dept Modern Phys, Hefei, Anhui, Peoples R China. [Chen, S.; Wang, C.; Zhang, H.] Nanjing Univ, Dept Phys, Nanjing, Jiangsu, Peoples R China. [Du, Y.; Feng, C.; Liu, B.; Ma, L. L.; Ma, Y.; Wang, C.; Zaidan, R.; Zhang, X.; Zhao, Y.; Zhu, C. G.] Shandong Univ, Sch Phys, Jinan, Shandong, Peoples R China. [Bret, M. Cano; Guo, J.; Li, L.; Yang, H.] Shanghai Jiao Tong Univ, Dept Phys & Astron, Shanghai Key Lab Particle Phys & Cosmol, Shanghai, Peoples R China. [Bret, M. Cano; Guo, J.; Li, L.; Yang, H.] PKU CHEP, Shanghai, Peoples R China. [Chen, X.; Zhou, N.] Tsinghua Univ, Dept Phys, Beijing 100084, Peoples R China. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Pallin, D.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] Univ Clermont Ferrand, Phys Corpusculaire Lab, Clermont Ferrand, France. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Pallin, D.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] Univ Clermont Ferrand, Clermont Ferrand, France. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Pallin, D.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] CNRS, IN2P3, Clermont Ferrand, France. [Alkire, S. P.; Angerami, A.; Brooijmans, G.; Carbone, R. M.; Clark, M. R.; Cole, B.; Hu, D.; Hughes, E. W.; Iordanidou, K.; Klein, M. H.; Mohapatra, S.; Ochoa, I.; Parsons, J. A.; Smith, M. N. K.; Smith, R. W.; Thompson, E. N.; Tuts, P. M.; Wang, T.; Zhou, L.] Columbia Univ, Nevis Lab, Irvington, NY USA. [Alonso, A.; Besjes, G. J.; Dam, M.; Galster, G.; Hansen, J. B.; Hansen, J. D.; Hansen, P. H.; Loevschall-Jensen, A. E.; Monk, J.; Mortensen, S. S.; Pedersen, L. E.; Petersen, T. C.; Pingel, A.; Wiglesworth, C.; Xella, S.] Univ Copenhagen, Niels Bohr Inst, Copenhagen, Denmark. [Cairo, V. M.; Capua, M.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Grp Collegato Cosenza, Frascati, Italy. [Cairo, V. M.; Capua, M.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Univ Calabria, Dipartimento Fis, Arcavacata Di Rende, Italy. [Adamczyk, L.; Basalaev, A.; Bold, T.; Dabrowski, W.; Gach, G. P.; Grabowska-Bold, I.; Kisielewska, D.; Koperny, S.; Kowalski, T. Z.; Mindur, B.; Przybycien, M.; Zemla, A.] AGH Univ Sci & Technol, Fac Phys & Appl Comp Sci, Krakow, Poland. [Palka, M.; Richter-Was, E.] Jagiellonian Univ, Marian Smoluchowski Inst Phys, Krakow, Poland. [Banas, E.; de Renstrom, P. A. Bruckman; Chwastowski, J. J.; Derendarz, D.; Godlewski, J.; Gornicki, E.; Hajduk, Z.; Iwanski, W.; Kaczmarska, A.; Knapik, J.; Korcyl, K.; Kowalewska, A. B.; Malecki, Pa.; Olszewski, A.; Stanecka, E.; Staszewski, R.; Trzebinski, M.; Trzupek, A.; Wolter, M. W.; Wosiek, B. K.; Wozniak, K. W.; Zabinski, B.] Polish Acad Sci, Inst Nucl Phys, Krakow, Poland. [Cao, T.; Firan, A.; Hetherly, J. W.; Kama, S.; Kehoe, R.; Sekula, S. J.; Stroynowski, R.; Turvey, A. J.; Varol, T.; Wang, H.; Ye, J.; Zhao, X.; Zhou, L.] Southern Methodist Univ, Dept Phys, Dallas, TX 75275 USA. [Bassalat, A.; Izen, J. M.; Leyton, M.; Meirose, B.; Namasivayam, H.; Reeves, K.] Univ Texas Dallas, Dept Phys, Richardson, TX 75083 USA. [Asbah, N.; Behr, J. K.; Bertsche, C.; Bessner, M.; Bloch, I.; Britzger, D.; Deterre, C.; Dutta, B.; Dyndal, M.; Eckardt, C.; Filipuzzi, M.; Flaschel, N.; Bravo, A. Gascon; Glazov, A.; Gregor, I. M.; Haleem, M.; Hamnett, P. G.; Hiller, K. H.; Howarth, J.; Huang, Y.; Katzy, J.; Keller, J. S.; Kondrashova, N.; Kuhl, T.; Lobodzinska, E.; Lohwasser, K.; Madsen, A.; Medinnis, M.; Moenig, K.; Garcia, R. F. Naranjo; Naumann, T.; O'Rourke, A. A.; Peschke, R.; Peters, K.; Pirumov, H.; Poley, A.; Robinson, J. E. M.; Schaefer, R.; Schmitt, S.; South, D.; Stanescu-Bellu, M.; Stanitzki, M. M.; Styles, N. A.; Tackmann, K.; Trofymov, A.; Wang, J.; Zakharchuk, N.] DESY, Zeuthen, Germany. [Burmeister, I.; Dette, K.; Erdmann, J.; Esch, H.; Gossling, C.; Homann, M.; Jentzsch, J.; Klingenberg, R.; Kroeninger, K.] Tech Univ Dortmund, Inst Expt Phys 4, Dortmund, Germany. [Anger, P.; Duschinger, D.; Friedrich, F.; Grohs, J. P.; Gutschow, C.; Hauswald, L.; Kobel, M.; Mader, W. F.; Novgorodova, O.; Siegert, F.; Socher, F.; Straessner, A.; Vest, A.; Wahrmund, S.] Tech Univ Dresden, Inst Kern & Teilchenphys, Dresden, Germany. [Arce, A. T. H.; Benjamin, D. P.; Bjergaard, D. M.; Bocci, A.; Cerio, B. C.; Goshaw, A. T.; Kajomovitz, E.; Kotwal, A.; Kruse, M. C.; Li, L.; Li, S.; Liu, M.; Oh, S. H.; Zhou, C.] Duke Univ, Dept Phys, Durham, NC 27706 USA. [Bristow, T. M.; Clark, P. J.; Dias, F. A.; Edwards, N. C.; Gao, Y.; Walls, F. M. Garay; Glaysher, P. C. F.; Harrington, R. D.; Leonidopoulos, C.; Martin, V. J.; Mills, C.; Pino, S. A. Olivares; Proissl, M.; Washbrook, A.; Wynne, B. M.] Univ Edinburgh, SUPA Sch Phys & Astron, Edinburgh, Midlothian, Scotland. [Antonelli, M.; Beretta, M.; Bilokon, H.; Chiarella, V.; Curatolo, M.; Esposito, B.; Gatti, C.; Laurelli, P.; Maccarrone, G.; Mancini, G.; Sansoni, A.; Testa, M.; Vilucchi, E.] Ist Nazl Fis Nucl, Lab Nazl Frascati, Frascati, Italy. [Arnold, H.; Betancourt, C.; Boehler, M.; Bruneliere, R.; Buehrer, F.; Burgard, C. D.; Buescher, D.; Cardillo, F.; Coniavitis, E.; Consorti, V.; Dang, N. P.; Dao, V.; Di Simone, A.; Gonella, G.; Herten, G.; Jakobs, K.; Javurek, T.; Jenni, P.; Kiss, F.; Koeneke, K.; Kopp, A. K.; Kuehn, S.; Landgraf, U.; Luedtke, C.; Nagel, M.; Pagacova, M.; Parzefall, U.; Ronzani, M.; Rosbach, K.; Ruehr, F.; Rurikova, Z.; Sammel, D.; Schillo, C.; Schnoor, U.; Schumacher, M.; Sommer, P.; Sundermann, J. E.; Ta, D.; Temming, K. K.; Tsiskaridze, V.; Weiser, C.; Werner, M.; Zimmermann, S.] Univ Freiburg, Fak Math & Phys, Freiburg, Germany. [Ancu, L. S.; De Mendizabal, J. Bilbao; Calace, N.; Chatterjee, A.; Clark, A.; Coccaro, A.; Delitzsch, C. M.; della Volpe, D.; Ferrere, D.; Gadomski, S.; Golling, T.; Gonzalez-Sevilla, S.; Gramling, J.; Guescini, F.; Iacobucci, G.; Katre, A.; Khoo, T. J.; Lionti, A. E.; March, L.; Mermod, P.; Miucci, A.; Nackenhorst, O.; Nessi, M.; Paolozzi, L.; Ristic, B.; Schramm, S.; Sfyrla, A.; Vallecorsa, S.; Wu, X.] Univ Geneva, Sect Phys, Geneva, Switzerland. [Barberis, D.; Darbo, G.; Favareto, A.; Parodi, A. Ferretto; Gaudiello, A.; Gemme, C.; Guido, E.; Miglioranzi, S.; Morettini, P.; Osculati, B.; Parodi, F.; Passaggio, S.; Rossi, L. P.; Sannino, M.; Schiavi, C.] Ist Nazl Fis Nucl, Sez Genova, Genoa, Italy. [Barberis, D.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Guido, E.; Miglioranzi, S.; Osculati, B.; Parodi, F.; Sannino, M.; Schiavi, C.] Univ Genoa, Dipartimento Fis, Genoa, Italy. [Jejelava, J.; Tskhadadze, E. G.] Iv Javakhishvili Tbilisi State Univ, E Andronikashvili Inst Phys, Tbilisi, Rep of Georgia. [Djobava, T.; Durglishvili, A.; Khubua, J.; Mosidze, M.] Tbilisi State Univ, Inst High Energy Phys, Tbilisi, Rep of Georgia. [Dueren, M.; Heinz, C.; Kreutzfeldt, K.; Stenzel, H.] Univ Giessen, Inst Phys 2, Giessen, Germany. [Bates, R. L.; Boutle, S. K.; Madden, W. D. Breaden; Britton, D.; Buckley, A. G.; Bussey, P.; Buttar, C. M.; Buzatu, A.; Cinca, D.; Crawley, S. J.; D'Auria, S.; Doyle, A. T.; Ferrando, J.; Gul, U.; Knue, A.; Mullen, P.; O'Shea, V.; Owen, M.; Pollard, C. S.; Qin, G.; Qin, Y.; Quilty, D.; Ravenscroft, T.; Robson, A.; St Denis, R. D.; Stewart, G. A.; Thompson, A. S.] Univ Glasgow, SUPA Sch Phys & Astron, Glasgow, Lanark, Scotland. [Agricola, J.; Bindi, M.; Blumenschein, U.; Brandt, G.; DeMarco, D. A.; Drechsler, E.; Graber, L.; Grosse-Knetter, J.; Janus, M.; Kareem, M. J.; Kawamura, G.; Lai, S.; Lemmer, B.; Magradze, E.; Mantoani, M.; Mchedlidze, G.; Llacer, M. Moreno; Musheghyan, H.; Quadt, A.; Rieger, J.; Rosien, N. -A.; Rzehorz, G. F.; Shabalina, E.; Stolte, P.; Veatch, J.; Weingarten, J.; Zinonos, Z.] Univ Gottingen, Inst Phys 2, Gottingen, Germany. [Albrand, S.; Berlendis, S.; Camincher, C.; Collot, J.; Crepe-Renaudin, S.; Delsart, P. A.; Gabaldon, C.; Genest, M. H.; Gradin, P. O. J.; Hostachy, J-Y.; Ledroit-Guillon, F.; Lleres, A.; Lucotte, A.; Malek, F.; Petit, E.; Stark, J.; Trocme, B.; Wu, M.] Univ Grenoble Alpes, Lab Phys Subat & Cosmol, CNRS, IN2P3, Grenoble, France. [McFarlane, K. W.] Hampton Univ, Dept Phys, Hampton, VA 23668 USA. [Chan, S. K.; Clark, B. L.; Franklin, M.; Giromini, P.; Huth, J.; Ippolito, V.; Lazovich, T.; Mateos, D. Lopez; Morris, J. D.; Rogan, C. S.; Skottowe, H. P.; Sun, S.; Tolley, E.; Tong, B.; Tuna, A. N.; Yen, A. L.; Zambito, S.] Harvard Univ, Lab Particle Phys & Cosmol, Cambridge, MA 02138 USA. [Andrei, V.; Baas, A. E.; Brandt, O.; Djuvsland, J. I.; Dunford, M.; Geisler, M. P.; Hanke, P.; Jongmanns, J.; Kluge, E. -E.; Lang, V. S.; Meier, K.; Zu Theenhausen, H. Meyer; Villar, D. I. Narrias; Sahinsoy, M.; Scharf, V.; Schultz-Coulon, H. -C.; Stamen, R.; Starovoitov, P.; Suchek, S.; Wessels, M.] Heidelberg Univ, Kirchhoff Inst Phys, Heidelberg, Germany. [Anders, C. F.; de Lima, D. E. Ferreira; Giulini, M.; Kolb, M.; Lisovyi, M.; Radescu, V.; Schaetzel, S.; Schoening, A.; Sosa, D.] Heidelberg Univ, Inst Phys, Heidelberg, Germany. [Kretz, M.; Kugel, A.] Heidelberg Univ, ZITI Inst Tech Informat, Mannheim, Germany. [Nagasaka, Y.] Hiroshima Inst Technol, Fac Appl Informat Sci, Hiroshima, Japan. [Bortolotto, V.; Chan, Y. L.; Castillo, L. R. Flores; Lu, H.; Salvucci, A.; Tsui, K. M.] Chinese Univ Hong Kong, Dept Phys, Shatin, Hong Kong, Peoples R China. [Bortolotto, V.; Orlando, N.] Univ Hong Kong, Dept Phys, Hong Kong, Hong Kong, Peoples R China. [Bortolotto, V.; Prokofiev, K.] Hong Kong Univ Sci & Technol, Dept Phys, Kowloon, Hong Kong, Peoples R China. [Choi, K.; Dattagupta, A.; Evans, H.; Gagnon, P.; Kopeliansky, R.; Lammers, S.; Martinez, N. Lorenzo; Luehring, F.; Ogren, H.; Penwell, J.; Weinert, B.; Zieminska, D.] Indiana Univ, Dept Phys, Bloomington, IN 47405 USA. [Jansky, R.; Kneringer, E.; Lukas, W.; Milic, A.; Usanova, A.; Vigne, R.] Leopold Franzens Univ, Inst Astro & Teilchenphys, Innsbruck, Austria. [Abdallah, J.; Argyropoulos, S.; Benitez, J.; Mallik, U.] Univ Iowa, Iowa City, IA USA. [Chen, C.; Cochran, J.; De Lorenzi, F.; Jiang, H.; Krumnack, N.; Pluth, D.; Prell, S.; Werner, M. D.; Yu, J.] Iowa State Univ, Dept Phys & Astron, Ames, IA USA. [Ahmadov, F.; Aleksandrov, I. N.; Bednyakov, V. A.; Boyko, I. R.; Budagov, I. A.; Chelkov, G. A.; Cheplakov, A.; Chizhov, M. V.; Dedovich, D. V.; Demichev, M.; Gongadze, A.; Gostkin, M. I.; Huseynov, N.; Javadov, N.; Karpov, S. N.; Karpova, Z. M.; Khramov, E.; Kruchonak, U.; Kukhtin, V.; Ladygin, E.; Lyubushkin, V.; Minashvili, I. A.; Mineev, M.; Peshekhonov, V. D.; Plotnikova, E.; Potrap, I. N.; Pozdnyakov, V.; Rusakovich, N. A.; Sadykov, R.; Sapronov, A.; Shiyakova, M.; Soloshenko, A.; Vinogradov, V. B.; Yeletskikh, I.; Zhemchugov, A.; Zimine, N. I.] Joint Inst Nucl Res Dubna, Dubna, Russia. [Amako, K.; Aoki, M.; Arai, Y.; Hanagaki, K.; Ikegami, Y.; Ikeno, M.; Iwasaki, H.; Kanzaki, J.; Kondo, T.; Makida, Y.; Nagai, R.; Nagano, K.; Nakamura, K.; Nozaki, M.; Odaka, S.; Okuyama, T.; Suzuki, S.; Takubo, Y.; Tanaka, S.; Terada, S.; Tokushuku, K.; Tsuno, S.; Unno, Y.; Yamamoto, A.; Yasu, Y.] High Energy Accelerator Res Org, KEK, Tsukuba, Ibaraki, Japan. [Chen, Y.; Hasegawa, M.; Kido, S.; Kishimoto, T.; Kurashige, H.; Maeda, J.; Ochi, A.; Shimizu, S.; Yakabe, R.; Yamazaki, Y.; Yuan, L.] Kobe Univ, Grad Sch Sci, Kobe, Hyogo, Japan. [Ishino, M.; Kunigo, T.; Monden, R.; Sumida, T.; Tashiro, T.] Kyoto Univ, Fac Sci, Kyoto, Japan. [Takashima, R.] Kyoto Univ, Kyoto, Japan. [Kawagoe, K.; Oda, S.; Otono, H.; Tojo, J.] Kyushu Univ, Dept Phys, Fukuoka, Japan. [Alconada Verzini, M. J.; Alonso, F.; Arduh, F. A.; Dova, M. T.; Monticelli, F.; Wahlberg, H.] Univ Nacl La Plata, Inst Fis La Plata, La Plata, Buenos Aires, Argentina. [Alconada Verzini, M. J.; Alonso, F.; Arduh, F. A.; Dova, M. T.; Monticelli, F.; Wahlberg, H.] Consejo Nacl Invest Cient & Tecn, La Plata, Buenos Aires, Argentina. [Barton, A. E.; Beattie, M. D.; Bertram, I. A.; Borissov, G.; Bouhova-Thacker, E. V.; Cheatham, S.; Dearnaley, W. J.; Fox, H.; Grimm, K.; Henderson, R. C. W.; Hughes, G.; Jones, R. W. L.; Kartvelishvili, V.; Long, R. E.; Love, P. A.; Muenstermann, D.; Parker, A. J.; Skinner, M. B.; Smizanska, M.; Walder, J.; Wharton, A. M.] Univ Lancaster, Dept Phys, Lancaster, England. [Aliev, M.; Bachas, K.; Chiodini, G.; Gorini, E.; Longo, L.; Primavera, M.; Reale, M.; Spagnolo, S.; Ventura, A.] Ist Nazl Fis Nucl, Sez Lecce, Lecce, Italy. [Aliev, M.; Bachas, K.; Gorini, E.; Longo, L.; Reale, M.; Spagnolo, S.; Ventura, A.] Univ Salento, Dipartimento Matemat & Fis, Lecce, Italy. [Affolder, A. A.; Anders, J. K.; Burdin, S.; D'Onofrio, M.; Dervan, P.; Gwilliam, C. B.; Hayward, H. S.; Jackson, M.; Jones, T. J.; King, B. T.; Klein, M.; Klein, U.; Kretzschmar, J.; Laycock, P.; Lehan, A.; Maxfield, S. J.; Mehta, A.; Readioff, N. P.; Vossebeld, J. H.] Univ Liverpool, Oliver Lodge Lab, Liverpool, Merseyside, England. [Cindro, V.; Deliyergiyev, M.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Jozef Stefan Inst, Dept Phys, Ljubljana, Slovenia. [Cindro, V.; Deliyergiyev, M.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Univ Ljubljana, Ljubljana, Slovenia. [Armitage, L. J.; Bevan, A. J.; Bona, M.; Cerrito, L.; Hays, J. M.; Hickling, R.; Landon, M. P. J.; Lewis, D.; Lloyd, S. L.; Morris, J. D.; Nooney, T.; Piccaro, E.; Rizvi, E.; Sandbach, R. L.] Queen Mary Univ London, Sch Phys & Astron, London, England. [Berry, T.; Blanco, J. E.; Boisvert, V.; Brooks, T.; Connelly, I. A.; Cowan, G.; Duguid, L.; Giannelli, M. Faucci; George, S.; Gibson, S. M.; Kempster, J. J.; Vazquez, J. G. Panduro; Pastore, Fr.; Savage, G.; Sowden, B. C.; Spano, F.; Teixeira-Dias, P.; Thomas-Wilsker, J.] Royal Holloway Univ London, Dept Phys, Surrey, England. [Bell, A. S.; Butterworth, J. M.; Campanelli, M.; Christodoulou, V.; Cooper, B. D.; Davison, P.; Falla, R. J.; Freeborn, D.; Gregersen, K.; Ortiz, N. G. Gutierrez; Hesketh, G. G.; Jansen, E.; Jiggins, S.; Konstantinidis, N.; Korn, A.; Kucuk, H.; Leney, K. J. C.; Martyniuk, A. C.; McClymont, L. I.; Mcfayden, J. A.; Nurse, E.; Richter, S.; Scanlon, T.; Sherwood, P.; Simmons, B.; Wardrope, D. R.; Waugh, B. M.] UCL, Dept Phys & Astron, London, England. [Greenwood, Z. D.; Grossi, G. C.; Jana, D. K.; Sawyer, L.; Subramaniam, R.] Louisiana Tech Univ, Ruston, LA 71270 USA. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] UPMC, Lab Phys Nucl & Hautes Energies, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] Univ Paris Diderot, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] CNRS, IN2P3, Paris, France. [Akesson, T. P. A.; Bocchetta, S. S.; Bryngemark, L.; Doglioni, C.; Floderus, A.; Hedberg, V.; Jarlskog, G.; Lytken, E.; Mjornmark, J. U.; Smirnova, O.; Viazlo, O.] Lund Univ, Inst Fys, Lund, Sweden. [Barreiro, F.; De la Torre, H.; Del Peso, J.; Glasman, C.; Terron, J.] Univ Autonoma Madrid, Dept Fis Teor C15, Madrid, Spain. [Artz, S.; Becker, M.; Bertella, C.; Blum, W.; Buescher, V.; Caputo, R.; Caudron, J.; Cuth, J.; Endner, O. C.; Ertel, E.; Fiedler, F.; Torregrosa, E. Fullana; Geisen, M.; Groh, S.; Heck, T.; Huelsing, T. A.; Jakobi, K. B.; Kaluza, A.; Karnevskiy, M.; Kleinknecht, K.; Koepke, L.; Lin, T. H.; Masetti, L.; Mattmann, J.; Meyer, C.; Moritz, S.; Pleskot, V.; Rave, S.; Sander, H. G.; Schaeffer, J.; Schaefer, U.; Schmitt, C.; Schmitz, S.; Schott, M.; Schuh, N.; Simioni, E.; Simon, M.; Tapprogge, S.; Urrejola, P.; Webb, S.; Wollstadt, S. J.; Yildirim, E.; Zimmermann, C.; Zinser, M.] Johannes Gutenberg Univ Mainz, Inst Phys, Mainz, Germany. [Barnes, S. L.; Bielski, R.; Cox, B. E.; Dann, N. S.; David, C.; Forcolin, G. T.; Forti, A.; Ponce, J. M. Iturbe; Li, X.; Loebinger, F. K.; Marsden, S. P.; Masik, J.; Sanchez, F. J. Munoz; Oh, A.; Ospanov, R.; Pater, J. R.; Peters, R. F. Y.; Pilkington, A. D.; Pin, A. W. J.; Price, D.; Qin, Y.; Queitsch-Maitland, M.; Raine, J. A.; Schweiger, H.; Shaw, S. M.; Tomlinson, L.; Wilk, F.; Woudstra, M. J.; Wyatt, T. R.] Univ Manchester, Sch Phys & Astron, Manchester, Lancs, England. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Diglio, S.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Gao, J.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.] Aix Marseille Univ, CPPM, Marseille, France. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Diglio, S.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Gao, J.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.] CNRS, IN2P3, Marseille, France. [Bellomo, M.; Bernard, N. R.; Brau, B.; Dallapiccola, C.; Daya-Ishmukhametova, R. K.; Moyse, E. J. W.; Pais, P.; Pettersson, N. E.; Picazio, A.; Willocq, S.] Univ Massachusetts, Dept Phys, Amherst, MA USA. [Belanger-Champagne, C.; Chuinard, A. J.; Corriveau, F.; Keyes, R. A.; Mantifel, R.; Prince, S.; Robertson, S. H.; Robichaud-Veronneau, A.; Stockton, M. C.; Stoebe, M.; Vachon, B.; Schroeder, T. Vazquez; Wang, K.; Warburton, A.] McGill Univ, Dept Phys, Montreal, PQ H3A 2T5, Canada. [Barberio, E. L.; Brennan, A. J.; Dawe, E.; Jennens, D.; Kubota, T.; Le, B.; McDonald, E. F.; Milesi, M.; Nuti, F.; Rados, P.; Scutti, F.; Spiller, L. A.; Tan, K. G.; Taylor, G. N.; Taylor, P. T. E.; Ungaro, F. C.; Urquijo, P.; Volpi, M.; Zanzi, D.] Univ Melbourne, Sch Phys, Melbourne, Vic, Australia. [Amidei, D.; Chelstowska, M. A.; Cheng, H. C.; Dai, T.; Diehl, E. B.; Edgar, R. C.; Feng, H.; Ferretti, C.; Fleischmann, P.; Goldfarb, S.; Guan, L.; Levin, D.; Liu, H.; Lu, N.; Marley, D. E.; Mc kee, S. P.; McCarn, A.; Neal, H. A.; Qian, J.; Schwarz, T. A.; Searcy, J.; Sekhon, K.; Wu, Y.; Yu, J. M.; Zhang, D.; Zhou, B.; Zhu, J.] Univ Michigan, Dept Phys, Ann Arbor, MI 48109 USA. [Arabidze, G.; Brock, R.; Chegwidden, A.; Fisher, W. C.; Halladjian, G.; Hauser, R.; Hayden, D.; Huston, J.; Martin, B.; Mondragon, M. C.; Plucinski, P.; Pope, B. G.; Schoenrock, B. D.; Schwienhorst, R.; Willis, C.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Alimonti, G.; Andreazza, A.; Camplani, A.; Carminati, L.; Cavalli, D.; Citterio, M.; Costa, G.; Fanti, M.; Giugni, D.; Lari, T.; Lazzaroni, M.; Mandelli, L.; Manzoni, S.; Mazza, S. M.; Meroni, C.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Shojaii, S.; Stabile, A.; Tartarelli, G. F.; Troncon, C.; Turra, R.; Perez, M. Villaplana] Ist Nazl Fis Nucl, Sez Milano, Milan, Italy. [Andreazza, A.; Camplani, A.; Carminati, L.; Fanti, M.; Lazzaroni, M.; Manzoni, S.; Mazza, S. M.; Perini, L.; Ragusa, F.; Ratti, M. G.; Shojaii, S.; Turra, R.; Perez, M. Villaplana] Univ Milan, Dipartimento Fis, Milan, Italy. [Harkusha, S.; Kulchitsky, Y.; Kurochkin, Y. A.; Tsiareshka, P. V.] Natl Acad Sci Belarus, BI Stepanov Phys Inst, Minsk, Byelarus. [Hrynevich, A.] Natl Sci & Educ Ctr Particle & High Energy Phys, Minsk, Byelarus. [Arguin, J-F.; Azuelos, G.; Dallaire, F.; Ducu, O. A.; Gagnon, L. G.; Gauthier, L.; Leroy, C.; Mochizuki, K.; Nguyen Manh, T.; Rezvani, R.; Saadi, D. Shoaleh] Univ Montreal, Grp Particle Phys, Montreal, PQ, Canada. [Akimov, A. V.; Gavrilenko, I. L.; Komar, A. A.; Mashinistov, R.; Mouraviev, S. V.; Nechaeva, P. Yu; Shmeleva, A.; Snesarev, A. A.; Sulin, V. V.; Tikhomirov, V. O.; Zhukov, K.] Russian Acad Sci, PN Lebedev Phys Inst, Moscow, Russia. [Artamonov, A.; Gorbounov, P. A.; Khovanskiy, V.; Shatalov, P. B.; Tsukerman, I. I.] Inst Theoret & Expt Phys, Moscow, Russia. [Antonov, A.; Belotskiy, K.; Belyaev, N. L.; Bulekov, O.; Dolgoshein, B. A.; Kantserov, V. A.; Krasnopevtsev, D.; Romaniouk, A.; Shulga, E.; Smirnov, S. Yu.; Smirnov, Y.; Soldatov, E. Yu.; Timoshenko, S.; Vorobev, K.] Natl Res Nucl Univ, MEPhI, Moscow, Russia. [Gladilin, L. K.; Kramarenko, V. A.; Maevskiy, A.; Sivoklokov, S. Yu.; Smirnova, L. N.; Turchikhin, S.] Moscow MV Lomonosov State Univ, DV Skobeltsyn Inst Nucl Phys, Moscow, Russia. [Adomeit, S.; Bender, M.; Biebel, O.; Bock, C.; Bortfeldt, J.; Calfayan, P.; Chow, B. K. B.; Duckeck, G.; Hartmann, N. M.; Heinrich, J. J.; Hertenberger, R.; Hoenig, F.; Legger, F.; Lorenz, J.; Loesel, P. J.; Maier, T.; Mann, A.; Mehlhase, S.; Meineck, C.; Mitrevski, J.; Mueller, R. S. P.; Rauscher, F.; Ruschke, A.; Schachtner, B. M.; Schaile, D.; Unverdorben, C.; Valderanis, C.; Walker, R.; Wittkowski, J.] Univ Munich, Fak Phys, Munich, Germany. [Barillari, T.; Bethke, S.; Compostella, G.; Cortiana, G.; Ecker, K. M.; Flowerdew, M. J.; Giuliani, C.; Goblirsch-Kolb, M.; Ince, T.; Kiryunin, A. E.; Kluth, S.; Kortner, O.; Kortner, S.; Kroha, H.; La Rosa, A.; Macchiolo, A.; Maier, A. A.; McCarthy, T. G.; Menke, S.; Mueller, F.; Nisius, R.; Nowak, S.; Oberlack, H.; Richter, R.; Salihagic, D.; Sandstroem, R.; Schacht, P.; Schmidt-Sommerfeld, K. R.; Schwegler, Ph.; Spettel, F.; Stonjek, S.; Terzo, S.; von der Schmitt, H.; Wildauer, A.] Werner Heisenberg Inst, Max Planck Inst Phys, Munich, Germany. [Fusayasu, T.; Shimojima, M.] Nagasaki Inst Appl Sci, Nagasaki, Japan. [Horii, Y.; Kentaro, K.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Grad Sch Sci, Nagoya, Aichi, Japan. [Horii, Y.; Kentaro, K.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Kobayashi Maskawa Inst, Nagoya, Aichi, Japan. [Aloisio, A.; Alviggi, M. G.; Canale, V.; Carlino, G.; Cirotto, F.; Conventi, F.; de Asmundis, R.; Della Pietra, M.; Doria, A.; Izzo, V.; Merola, L.; Perrella, S.; Rossi, E.; Sanchez, A.; Sekhniaidze, G.; Zurzolo, G.] Ist Nazl Fis Nucl, Sez Napoli, Naples, Italy. [Aloisio, A.; Alviggi, M. G.; Canale, V.; Cirotto, F.; Merola, L.; Perrella, S.; Rossi, E.; Sanchez, A.; Zurzolo, G.] Univ Naples Federico II, Dipartimento Fis, Naples, Italy. [Gorelov, I.; Hoeferkamp, M. R.; Seidel, S. C.; Taylor, A. C.; Toms, K.] Univ New Mexico, Dept Phys & Astron, Albuquerque, NM 87131 USA. [Caron, S.; Colasurdo, L.; Croft, V.; De Groot, N.; Filthaut, F.; Galea, C.; Konig, A. C.; Nektarijevic, S.; Strubig, A.] Radboud Univ Nijmegen, Nikhef, Inst Math Astrophys & Particle Phys, Nijmegen, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Deluca, C.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der Geer, R.; van der Graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.] Nikhef Natl Inst Subat Phys, Amsterdam, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Deluca, C.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der Geer, R.; van der Graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.] Nikhef Natl Inst Subat Phys, Amsterdam, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Deluca, C.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valencic, N.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der Geer, R.; van der Graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.] Univ Amsterdam, Amsterdam, Netherlands. [Adelman, J.; Andari, N.; Burghgrave, B.; Chakraborty, D.; Saha, P.] Northern Illinois Univ, Dept Phys, De Kalb, IL 60115 USA. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Bogdanchikov, A. G.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] Budker Inst Nucl Phys, SB RAS, Novosibirsk, Russia. [Becot, C.; Bernius, C.; Cranmer, K.; Haas, A.; Heinrich, L.; Kaplan, B.; Karthik, K.; Konoplich, R.; Mincer, A. I.; Nemethy, P.; Neves, R. M.] NYU, Dept Phys, 4 Washington Pl, New York, NY 10003 USA. [Beacham, J. B.; Che, S.; Gan, K. K.; Ishmukhametov, R.; Kagan, H.; Kass, R. D.; Looper, K. A.; Shrestha, S.; Tannenwald, B. B.] Ohio State Univ, Columbus, OH 43210 USA. [Nakano, I.] Okayama Univ, Fac Sci, Okayama, Japan. [Abbott, B.; Alhroob, M.; Bertsche, D.; De Benedetti, A.; Gutierrez, P.; Hasib, A.; Norberg, S.; Pearson, B.; Rifki, O.; Severini, H.; Skubic, P.; Strauss, M.] Univ Oklahoma, Homer L Dodge Dept Phys & Astron, Norman, OK 73019 USA. [Cantero, J.; Haley, J.; Jamin, D. O.; Khanov, A.; Rizatdinova, F.; Sidorov, D.] Oklahoma State Univ, Dept Phys, Stillwater, OK 74078 USA. [Chytka, L.; Hamal, P.; Hrabovsky, M.; Kvita, J.; Nozka, L.] Palacky Univ, RCPTM, Olomouc, Czech Republic. [Abreu, R.; Allen, B. W.; Brau, J. E.; Brost, E.; Hopkins, W. H.; Majewski, S.; Potter, C. T.; Radloff, P.; Sinev, N. B.; Strom, D. M.; Torrence, E.; Wanotayaroj, C.; Whalen, K.; Winklmeier, F.] Univ Oregon, Ctr High Energy Phys, Eugene, OR 97403 USA. [Abeloos, B.; Ayoub, M. K.; Bassalat, A.; Binet, S.; Bourdarios, C.; De Regie, J. B. De Vivie; Delgove, D.; Duflot, L.; Escalier, M.; Fayard, L.; Fournier, D.; Gkougkousis, E. L.; Goudet, C. R.; Grivaz, J. -F.; Hariri, F.; Henrot-Versille, S.; Hrivnac, J.; Iconomidou-Fayard, L.; Kado, M.; Lounis, A.; Maiani, C.; Makovec, N.; Morange, N.; Nellist, C.; Petroff, P.; Poggioli, L.; Puzo, P.; Rousseau, D.; Rybkin, G.; Schaffer, A. C.; Serin, L.; Simion, S.; Tanaka, R.; Zerwas, D.; Zhang, Z.] Univ Paris 11, CNRS IN2P3, Univ Paris Saclay, LAL, Orsay, France. [Endo, M.; Nomachi, M.; Sugaya, Y.; Teoh, J. J.; Yamaguchi, Y.] Osaka Univ, Grad Sch Sci, Osaka, Japan. [Bugge, M. K.; Cameron, D.; Catmore, J. R.; Feigl, S.; Franconi, L.; Garonne, V.; Gjelsten, B. K.; Gramstad, E.; Morisbak, V.; Nilsen, J. K.; Ould-Saada, F.; Pajchel, K.; Pedersen, M.; Raddum, S.; Read, A. L.; Rohne, O.; Sandaker, H.; Serfon, C.; Stapnes, S.; Strandlie, A.] Univ Oslo, Dept Phys, Oslo, Norway. [Artoni, G.; Barr, A. J.; Becker, K.; Beresford, L.; Bortoletto, D.; Cooper-Sarkar, A. M.; Ortuzar, M. Crispin; Fawcett, W. J.; Frost, J. A.; Gallas, E. J.; Giuli, F.; Gupta, S.; Gwenlan, C.; Hays, C. P.; Henderson, J.; Huffman, T. B.; Issever, C.; Kalderon, C. W.; Nagai, K.; Nickerson, R. B.; Norjoharuddeen, N.; Petrov, M.; Pickering, M. A.; Tseng, J. C-L.; Viehhauser, G. H. A.; Vigani, L.; Weidberg, A. R.; Zhong, J.] Univ Oxford, Dept Phys, Oxford, England. [Dondero, P.; Ferrari, R.; Fraternali, M.; Gaudio, G.; Introzzi, G.; Lanza, A.; Livan, M.; Negri, A.; Polesello, G.; Rebuzzi, D. M.; Rimoldi, A.; Vercesi, V.] Ist Nazl Fis Nucl, Sez Pavia, Pavia, Italy. [Dondero, P.; Fraternali, M.; Introzzi, G.; Livan, M.; Negri, A.; Rebuzzi, D. M.; Rimoldi, A.] Univ Pavia, Dipartimento Fis, Pavia, Italy. [Balunas, W. K.; Brendlinger, K.; Di Clemente, W. K.; Fletcher, R. R. M.; Haney, B.; Heim, S.; Hines, E.; Jackson, B.; Kroll, J.; Lipeles, E.; Miguens, J. Machado; Meyer, C.; Mistry, K. P.; Reichert, J.; Thomson, E.; Vanguri, R.; Williams, H. H.; Yoshihara, K.] Univ Penn, Dept Phys, Philadelphia, PA 19104 USA. [Basalaev, A.; Ezhilov, A.; Fedin, O. L.; Gratchev, V.; Levchenko, M.; Maleev, V. P.; Naryshkin, I.; Ryabov, Y. F.; Schegelsky, V. A.; Seliverstov, D. M.; Solovyev, V.] BP Konstantinov Petersburg Nucl Phys Inst, Kurchatov Inst, Natl Res Ctr, St Petersburg, Russia. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Univ Pisa, Dipartimento Fis E Fermi, Pisa, Italy. [Bianchi, R. M.; Boudreau, J.; Escobar, C.; Farina, C.; Hong, T. M.; Mueller, J.; Sapp, K.; Su, J.] Univ Pittsburgh, Dept Phys & Astron, Pittsburgh, PA 15260 USA. [Aguilar-Saavedra, J. A.; Dos Santos, S. P. Amor; Amorim, A.; Araque, J. P.; Cantrill, R.; Carvalho, J.; Castro, N. F.; Muino, P. Conde; De Sousa, M. J. Da Cunha Sargedas; Fiolhais, M. C. N.; Galhardo, B.; Gomes, A.; Goncalo, R.; Jorge, P. M.; Lopes, L.; Maio, A.; Maneira, J.; Seabra, L. F. Oleiro; Onofre, A.; Palma, A.; Pedro, R.; Santos, H.; Saraiva, J. G.; Silva, J.; Delgado, A. Tavares; Veloso, F.; Wolters, H.] Lab Instrumentacao & Fis Expt Particulas LIP, Lisbon, Portugal. [Amorim, A.; Muino, P. Conde; De Sousa, M. J. Da Cunha Sargedas; Gomes, A.; Jorge, P. M.; Miguens, J. Machado; Maio, A.; Maneira, J.; Palma, A.; Pedro, R.; Delgado, A. Tavares] Univ Lisbon, Fac Ciencias, Lisbon, Portugal. [Dos Santos, S. P. Amor; Carvalho, J.; Fiolhais, M. C. N.; Galhardo, B.; Veloso, F.; Wolters, H.] Univ Coimbra, Dept Phys, Coimbra, Portugal. [Gomes, A.; Maio, A.; Saraiva, J. G.; Silva, J.] Univ Lisbon, Ctr Fis Nucl, P-1699 Lisbon, Portugal. [Onofre, A.] Univ Minho, Dept Fis, Braga, Portugal. [Aguilar-Saavedra, J. A.] Univ Granada, Dept Fis Teor & Cosmos, Granada, Spain. [Aguilar-Saavedra, J. A.] Univ Granada, CAFPE, Granada, Spain. Univ Nova Lisboa, Dep Fis, Caparica, Portugal. Univ Nova Lisboa, CEFITEC, Fac Ciencias & Tecnol, Caparica, Portugal. [Chudoba, J.; Havranek, M.; Hejbal, J.; Jakoubek, T.; Kepka, O.; Kupco, A.; Kus, V.; Lokajicek, M.; Lysak, R.; Marcisovsky, M.; Mikestikova, M.; Nemecek, S.; Penc, O.; Sicho, P.; Staroba, P.; Svatos, M.; Tasevsky, M.; Vrba, V.] Acad Sci Czech Republic, Inst Phys, Prague, Czech Republic. [Augsten, K.; Caforio, D.; Gallus, P.; Guenther, J.; Hubacek, Z.; Myska, M.; Pospisil, S.; Seifert, F.; Simak, V.; Slavicek, T.; Smolek, K.; Solar, M.; Sopczak, A.; Sopko, V.; Suk, M.; Turecek, D.; Vacek, V.; Vlasak, M.; Vokac, P.; Vykydal, Z.; Zeman, M.] Czech Tech Univ, Prague, Czech Republic. [Balek, P.; Berta, P.; Carli, I.; Davidek, T.; Dolejsi, J.; Dolezal, Z.; Faltova, J.; Kodys, P.; Kosek, T.; Leitner, R.; Reznicek, P.; Scheirich, D.; Slovak, R.; Spousta, M.; Sykora, T.; Tas, P.; Todorova-Nova, S.; Valkar, S.; Vorobel, V.] Charles Univ Prague, Fac Math & Phys, Prague, Czech Republic. [Borisov, A.; Cheremushkina, E.; Denisov, S. P.; Fakhrutdinov, R. M.; Fenyuk, A. B.; Golubkov, D.; Kamenshchikov, A.; Karyukhin, A. N.; Kozhin, A. S.; Minaenko, A. A.; Myagkov, A. G.; Nikolaenko, V.; Ryzhov, A.; Solodkov, A. A.; Solovyanov, O. V.; Starchenko, E. A.; Vaniachine, A.; Zaitsev, A. M.; Zenin, O.] State Res Ctr, Inst High Energy Phys, Protvino, Russia. [Adye, T.; Baines, J. T.; Barnett, B. M.; Burke, S.; Dewhurst, A.; Dopke, J.; Emeliyanov, D.; Gallop, B. J.; Gee, C. N. P.; Haywood, S. J.; Kirk, J.; Martin-Haugh, S.; McMahon, S. J.; Middleton, R. P.; Murray, W. J.; Phillips, P. W.; Sankey, D. P. C.; Sawyer, C.; Tyndel, M.; Wickens, F. J.; Wielers, M.] NRC KI, Rutherford Appleton Lab, Particle Phys Dept, Didcot, Oxon, England. [Anulli, F.; Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; De Pedis, D.; De Salvo, A.; Di Donato, C.; Falciano, S.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Luminari, L.; Messina, A.; Nisati, A.; Pasqualucci, E.; Petrolo, E.; Pontecorvo, L.; Rescigno, M.; Rosati, S.; Tehrani, F. Safai; Vanadia, M.; Vari, R.; Veneziano, S.; Verducci, M.; Zanello, L.] Ist Nazl Fis Nucl, Sez Roma, Rome, Italy. [Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; Di Donato, C.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Messina, A.; Vanadia, M.; Verducci, M.; Zanello, L.] Univ Roma La Sapienza, Dipartimento Fis, Rome, Italy. [Aielli, G.; Camarri, P.; Cardarelli, R.; Di Ciaccio, A.; Iuppa, R.; Liberti, B.; Salamon, A.; Santonico, R.] Ist Nazl Fis Nucl, Sez Roma Tor Vergata, Rome, Italy. [Aielli, G.; Camarri, P.; Di Ciaccio, A.; Iuppa, R.; Salamon, A.; Santonico, R.] Univ Roma Tor Vergata, Dipartimento Fis, Rome, Italy. [Baroncelli, A.; Biglietti, M.; Ceradini, F.; Di Micco, B.; Farilla, A.; Graziani, E.; Iodice, M.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Stanescu, C.; Taccini, C.] Ist Nazl Fis Nucl, Sez Roma Tre, Rome, Italy. [Ceradini, F.; Di Micco, B.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Taccini, C.] Univ Rome Tre, Dipartimento Matemat & Fis, Rome, Italy. [Benchekroun, D.; Chafaq, A.; Hoummada, A.] Univ Hassan 2, Reseau Univ Phys Hautes Energies, Fac Sci Ain Chock, Casablanca, Morocco. [Ghazlane, H.] Ctr Natl Energie Sci Tech Nucl, Rabat, Morocco. [El Kacimi, M.; Goujdami, D.] Univ Cadi Ayyad, LPHEA Marrakech, Fac Sci Semlalia, Marrakech, Morocco. [Aaboud, M.; Derkaoui, J. E.; Ouchrif, M.; Tayalati, Y.] Univ Mohamed Premier, Fac Sci, Oujda, Morocco. [Aaboud, M.; Derkaoui, J. E.; Ouchrif, M.; Tayalati, Y.] LPTPM, Oujda, Morocco. [El Moursli, R. Cherkaoui; Fassi, F.; Haddad, N.; Idrissi, Z.] Univ Mohammed 5, Fac Sci, Rabat, Morocco. [Bachacou, H.; Balli, F.; Bauer, F.; Besson, N.; Blanchard, J. -B.; Boonekamp, M.; Chevalier, L.; Hoffmann, M. Dano; Deliot, F.; Denysiuk, D.; Etienvre, A. I.; Formica, A.; Giraud, P. F.; Da Costa, J. Goncalves Pinto Firmino; Guyot, C.; Hanna, R.; Hassani, S.; Jeanneau, F.; Kivernyk, O.; Kozanecki, W.; Kukla, R.; Lancon, E.; Laporte, J. F.; Le Quilleuc, E. P.; Lesage, A. A. J.; Mansoulie, B.; Meyer, J-P.; Nicolaidou, R.; Ouraou, A.; Rodriguez, L. Pacheco; Perego, M. M.; Peyaud, A.; Royon, C. R.; Saimpert, M.; Schoeffel, L.; Schune, Ph.; Schwemling, Ph.; Schwindling, J.] CEA Saclay, DSM IRFU, Gif Sur Yvette, France. [AbouZeid, O. S.; Battaglia, M.; Debenedetti, C.; Grillo, A. A.; Hance, M.; Kuhl, A.; Law, A. T.; Litke, A. M.; Lockman, W. S.; Nielsen, J.; Reece, R.; Rose, P.; Sadrozinski, H. F-W.; Schier, S.; Schumm, B. A.; Seiden, A.] Univ Calif Santa Cruz, Santa Cruz Inst Particle Phys, Santa Cruz, CA 95064 USA. [Alpigiani, C.; Blackburn, D.; Goussiou, A. G.; Hsu, S. -C.; Johnson, W. J.; Lubatti, H. J.; Marx, M.; Meehan, S.; Rompotis, N.; Rosten, R.; Rothberg, J.; Russell, H. L.; De Bruin, P. H. Sales; Pastor, E. Torro; Watts, G.; Whallon, N. L.] Univ Washington, Dept Phys, Seattle, WA 98195 USA. [Anastopoulos, C.; Costanzo, D.; Donszelmann, T. Cuhadar; Dawson, I.; Fletcher, G. T.; Hamity, G. N.; Hodgkinson, M. C.; Hodgson, P.; Johansson, P.; Klinger, J. A.; Korolkova, E. V.; Kyriazopoulos, D.; Paredes, B. Lopez; Macdonald, C. M.; Miyagawa, P. S.; Parker, K. A.; Tovey, D. R.; Vickey, T.; Boeriu, O. E. Vickey] Univ Sheffield, Dept Phys & Astron, Sheffield, S Yorkshire, England. [Baroncelli, A.; Hasegawa, Y.; Takeshita, T.] Shinshu Univ, Dept Phys, Nagano, Japan. [Atlay, N. B.; Buchholz, P.; Campoverde, A.; Czirr, H.; Fleck, I.; Gaur, B.; Ghasemi, S.; Ibragimov, I.; Li, Y.; Rosenthal, O.; Walkowiak, W.; Ziolkowski, M.] Univ Siegen, Fachbereich Phys, Siegen, Germany. [Buat, Q.; Horton, A. J.; Mori, D.; O'Neil, D. C.; Pachal, K.; Stelzer, B.; Temple, D.; Torres, H.; Van Nieuwkoop, J.; Vetterli, M. C.] Simon Fraser Univ, Dept Phys, Burnaby, BC, Canada. [Aloisio, A.; Armbruster, A. J.; Barklow, T.; Bartoldus, R.; Bassalat, A.; Bawa, H. S.; Black, J. E.; Calandri, A.; Gao, Y. S.; Garelli, N.; Grenier, P.; Ilic, N.; Kagan, M.; Kocian, M.; Koi, T.; Malone, C.; Moss, J.; Mount, R.; Nachman, B. P.; Nef, P. D.; Piacquadio, G.; Rubbo, F.; Salnikov, A.; Schwartzman, A.; Su, D.; Tompkins, L.; Wittgen, M.; Young, C.; Zeng, Q.] SLAC Natl Accelerator Lab, Stanford, CA USA. [Astalos, R.; Bartos, P.; Blazek, T.; Dado, T.; Melo, M.; Plazak, L.; Smiesko, J.; Sykora, I.; Tokar, S.; Zenis, T.] Comenius Univ, Fac Math Phys & Informat, Bratislava, Slovakia. [Bruncko, D.; Kladiva, E.; Strizenec, P.; Urban, J.] Slovak Acad Sci, Inst Expt Phys, Dept Subnucl Phys, Kosice, Slovakia. [Castaneda-Miranda, E.; Hamilton, A.; Yacoob, S.] Univ Cape Town, Dept Phys, Cape Town, South Africa. [Connell, S. H.; Govender, N.] Univ Johannesburg, Dept Phys, Johannesburg, South Africa. [Hsu, C.; Kar, D.; Garcia, B. R. Mellado; Ruan, X.] Univ Witwatersrand, Sch Phys, Johannesburg, South Africa. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Bohm, C.; Clement, C.; Cribbs, W. A.; Hellman, S.; Jon-And, K.; Klimek, P.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Silverstein, S. B.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Santurio, E. Valdes; Wallangen, V.] Stockholm Univ, Dept Phys, Stockholm, Sweden. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Clement, C.; Cribbs, W. A.; Hellman, S.; Jon-And, K.; Klimek, P.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Santurio, E. Valdes; Wallangen, V.] Oskar Klein Ctr, Stockholm, Sweden. [Lund-Jensen, B.; Sidebo, P. E.; Strandberg, J.] Royal Inst Technol, Dept Phys, Stockholm, Sweden. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Li, H.; Lindquist, B. E.; McCarthy, R. L.; Montalbano, A.; Morvaj, L.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; McCarthy, R. L.; Montalbano, A.; Morvaj, L.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA. [Abraham, N. L.; Allbrooke, B. M. M.; Asquith, L.; Cerri, A.; Barajas, C. A. Chavez; De Sanctis, U.; De Santo, A.; Grout, Z. J.; Lerner, G.; Miano, F.; Salvatore, F.; Castillo, I. Santoyo; Shehu, C. Y.; Suruliz, K.; Sutton, M. R.; Vivarelli, I.; Winston, O. J.] Univ Sussex, Dept Phys & Astron, Brighton, E Sussex, England. [Black, C. W.; Cuthbert, C.; Finelli, K. D.; Jeng, G. -Y.; Limosani, A.; Morley, A. K.; Saavedra, A. F.; Scarcella, M.; Varvell, K. E.; Wang, J.; Yabsley, B.] Univ Sydney, Sch Phys, Sydney, NSW, Australia. [Hou, S.; Hsu, P. J.; Lee, S. C.; Lin, S. C.; Liu, B.; Liu, D.; Lo Sterzo, F.; Mazini, R.; Shi, L.; Soh, D. A.; Song, H. Y.; Teng, P. K.; Wang, S. M.; Yang, Y.; Zhang, G.] Acad Sinica, Inst Phys, Taipei, Taiwan. [Abreu, H.; Gozani, E.; Rozen, Y.; Tarem, S.; van Eldik, N.] Technion Israel Inst Technol, Dept Phys, Haifa, Israel. [Abramowicz, H.; Alexander, G.; Ashkenazi, A.; Bella, G.; Benary, O.; Benhammou, Y.; Davies, M.; Duarte-Campderros, J.; Etzion, E.; Gershon, A.; Gueta, O.; Oren, Y.; Soffer, A.; Taiblum, N.] Tel Aviv Univ, Raymond & Beverly Sackler Sch Phys & Astron, Tel Aviv, Israel. [Gkaitatzis, S.; Gkialas, I.; Iliadis, D.; Kimura, N.; Kordas, K.; Kourkoumeli-Charalampidi, A.; Leisos, A.; Papageorgiou, K.; Petridou, C.; Sampsonidis, D.] Aristotle Univ Thessaloniki, Dept Phys, Thessaloniki, Greece. [Asai, S.; Dohmae, T.; Enari, Y.; Hanawa, K.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kazama, S.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Saito, T.; Sakamoto, H.; Sasaki, Y.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Int Ctr Elementary Particle Phys, Tokyo, Japan. [Asai, S.; Brandt, A.; Chen, S.; Dohmae, T.; Enari, Y.; Hanawa, K.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kazama, S.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Saito, T.; Sakamoto, H.; Sasaki, Y.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Dept Phys, Tokyo, Japan. [Bratzler, U.; Fukunaga, C.] Tokyo Metropolitan Univ, Grad Sch Sci & Technol, Tokyo, Japan. [Baroncelli, A.; Hirose, M.; Ishitsuka, M.; Jinnouchi, O.; Kobayashi, D.; Kuze, M.; Motohashi, K.; Todome, K.; Yamaguchi, D.] Tokyo Inst Technol, Dept Phys, Tokyo, Japan. [Batista, S. J.; Chau, C. C.; Cormier, K. J. R.; DeMarco, D. A.; Di Sipio, R.; Diamond, M.; Keoshkerian, H.; Krieger, P.; Liblong, A.; Mc Goldrick, G.; Orr, R. S.; Pascuzzi, V. R.; Polifka, R.; Rudolph, M. S.; Savard, P.; Sinervo, P.; Taenzer, J.; Teuscher, R. J.; Trischuk, W.; Veloce, L. M.; Venturi, N.] Univ Toronto, Dept Phys, Toronto, ON, Canada. [Azuelos, G.; Canepa, A.; Chekulaev, S. V.; Gingrich, D. M.; Hod, N.; Jovicevic, J.; Oakham, F. G.; Codina, E. Perez; Savard, P.; Schneider, B.; Stelzer-Chilton, O.; Tafirout, R.; Trigger, I. M.; Vetterli, M. C.] TRIUMF, Vancouver, BC, Canada. [Ramos, J. Manjarres; Palacino, G.; Taylor, W.] York Univ, Dept Phys & Astron, Toronto, ON, Canada. [Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Fac Pure & Appl Sci, Tsukuba, Ibaraki, Japan. [Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Ctr Integrated Res Fundamental Sci & Engn, Tsukuba, Ibaraki, Japan. [Beauchemin, P. H.; Meoni, E.; Sliwa, K.; Son, H.; Wetter, J.] Tufts Univ, Dept Phys & Astron, Medford, MA 02155 USA. [Casper, D. W.; Corso-Radu, A.; Frate, M.; Guest, D.; Lankford, A. J.; Mete, A. S.; Nelson, A.; Scannicchio, D. A.; Schernau, M.; Shimmin, C. O.; Taffard, A.; Unel, G.; Whiteson, D.] Univ Calif Irvine, Dept Phys & Astron, Irvine, CA USA. [Acharya, B. S.; Boldyrev, A. S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Quayle, W. B.; Serkin, L.; Shaw, K.; Soualah, R.; Truong, L.] Ist Nazl Fis Nucl, Sez Trieste, Grp Collegato Udine, Udine, Italy. [Acharya, B. S.; Quayle, W. B.; Serkin, L.; Shaw, K.] Abdus Salaam Int Ctr Theoret Phys, Trieste, Italy. [Boldyrev, A. S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Soualah, R.; Truong, L.] Univ Udine, Dipartimento Chim Fis & Ambiente, Udine, Italy. [Kuutmann, E. Bergeaas; Brenner, R.; Ekelof, T.; Ellert, M.; Ferrari, A.; Maddocks, H. J.; Ohman, H.; Pelikan, D.; Rangel-Smith, C.] Uppsala Univ, Dept Phys & Astron, Uppsala, Sweden. [Atkinson, M.; Armadans, R. Caminal; Cavaliere, V.; Chang, P.; Hooberman, B. H.; Lie, K.; Liss, T. M.; Liu, L.; Long, J. D.; Neubauer, M. S.; Rybar, M.; Shang, R.; Sickles, A. M.; Vichou, I.; Zeng, J. C.] Univ Illinois, Dept Phys, 1110 W Green St, Urbana, IL 61801 USA. [Alvarez Piqueras, D.; Navarro, L. Barranco; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Inst Fis Corpuscular IFIC, Valencia, Spain. [Alvarez Piqueras, D.; Navarro, L. Barranco; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Dept Fis Atom Mol & Nucl, Valencia, Spain. [Alvarez Piqueras, D.; Navarro, L. Barranco; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Pilkington, A. D.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Dept Ingn Elect, Valencia, Spain. [Alvarez Piqueras, D.; Navarro, L. Barranco; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Inst Microelect Barcelona IMB CNM, Valencia, Spain. [Alvarez Piqueras, D.; Navarro, L. Barranco; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] CSIC, Valencia, Spain. [Danninger, M.; Fedorko, W.; Gay, C.; Gecse, Z.; Gignac, M.; Henkelmann, S.; King, S. B.; Lister, A.] Univ British Columbia, Dept Phys, Vancouver, BC, Canada. [Albert, J.; David, C.; Elliot, A. A.; Fincke-Keeler, M.; Hamano, K.; Hill, E.; Keeler, R.; Kowalewski, R.; Kuwertz, E. S.; Kwan, T.; LeBlanc, M.; Lefebvre, M.; McPherson, R. A.; Pearce, J.; Seuster, R.; Sobie, R.; Trovatelli, M.; Venturi, M.] Univ Victoria, Dept Phys & Astron, Victoria, BC, Canada. [Beckingham, M.; Ennis, J. S.; Farrington, S. M.; Harrison, P. F.; Jeske, C.; Jones, G.; Martin, T. A.; Murray, W. J.; Pianori, E.; Spangenberg, M.] Univ Warwick, Dept Phys, Coventry, W Midlands, England. [Iizawa, T.; Mitani, T.; Sakurai, Y.; Yorita, K.] Waseda Univ, Tokyo, Japan. [Bressler, S.; Citron, Z. H.; Duchovni, E.; Dumancic, M.; Gross, E.; Kohler, M. K.; Lellouch, D.; Levinson, L. J.; Mikenberg, G.; Milov, A.; Pitt, M.; Ravinovich, I.; Roth, I.; Schaarschmidt, J.; Smakhtin, V.; Turgeman, D.] Weizmann Inst Sci, Dept Particle Phys, Rehovot, Israel. [Banerjee, Sw.; Guan, W.; Hard, A. S.; Heng, Y.; Ji, H.; Ju, X.; Kaplan, L. S.; Kashif, L.; Kruse, A.; Ming, Y.; Wang, F.; Wiedenmann, W.; Wu, S. L.; Yang, H.; Zhang, F.; Zobernig, G.] Univ Wisconsin, Dept Phys, Madison, WI USA. [Kuger, F.; Redelbach, A.; Schreyer, M.; Sidiropoulou, O.; Siragusa, G.; Stroehmer, R.; Trefzger, T.; Weber, S. W.; Zibell, A.] Univ Wurzburg, Fak Phys & Astron, Wurzburg, Germany. [Bannoura, A. A. E.; Boerner, D.; Braun, H. M.; Cornelissen, T.; Ellinghaus, F.; Ernis, G.; Fischer, J.; Flick, T.; Gabizon, O.; Gilles, G.; Hamacher, K.; Harenberg, T.; Hirschbuehl, D.; Kersten, S.; Kuechler, J. T.; Maettig, P.; Neumann, M.; Pataraia, S.; Riegel, C. J.; Sandhoff, M.; Tepel, F.; Vogel, M.; Wagner, W.; Zeitnitz, C.] Berg Univ Wuppertal, Fak Mathemat & Naturwissensch, Fachgrp Phys, Wuppertal, Germany. [Baker, O. K.; Noccioli, E. Benhar; Cummings, J.; Demers, S.; Ideal, E.; Lagouri, T.; Leister, A. G.; Loginov, A.; Hernandez, D. Paredes; Thomsen, L. A.; Tipton, P.; Vasquez, J. G.; Wang, X.] Yale Univ, Dept Phys, New Haven, CT USA. [Hakobyan, H.; Vardanyan, G.] Yerevan Phys Inst, Yerevan, Armenia. [Rahal, G.] IN2P3, Ctr Calcul, Villeurbanne, France. [Acharya, B. S.] Kings Coll London, Dept Phys, London, England. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] Novosibirsk State Univ, Novosibirsk, Russia. [Banerjee, Sw.] Univ Louisville, Dept Phys & Astron, Louisville, KY 40292 USA. [Bawa, H. S.; Gao, Y. S.] Calif State Univ Fresno, Dept Phys, Fresno, CA 93740 USA. [Beck, H. P.] Univ Fribourg, Dept Phys, Fribourg, Switzerland. [Casado, M. P.] Univ Autonoma Barcelona, Dept Fis, Barcelona, Spain. [Castro, N. F.] Univ Porto, Fac Ciencias, Dept Fis & Astron, Oporto, Portugal. [Chelkov, G. A.] Tomsk State Univ, Tomsk, Russia. [Conventi, F.; Della Pietra, M.] Univ Napoli Parthenope, Naples, Italy. [Corriveau, F.; McPherson, R. A.; Robertson, S. H.; Teuscher, R. J.] Inst Particle Phys, Victoria, BC, Canada. [Ducu, O. A.] Natl Inst Phys & Nucl Engn, Bucharest, Romania. [Fedin, O. L.] St Petersburg State Polytech Univ, Dept Phys, St Petersburg, Russia. [Govender, N.] Ctr High Performance Comp, CSIR Campus, Cape Town, South Africa. [Grinstein, S.; Juste Rozas, A.; Martinez, M.] ICREA, Inst Catalana Rec & Estud Avancats, Barcelona, Spain. [Hsu, P. J.] Natl Tsing Hua Univ, Dept Phys, Hsinchu, Taiwan. [Jejelava, J.] Ilia State Univ, Inst Theoret Phys, Tbilisi, Rep of Georgia. [Khubua, J.] Georgian Tech Univ, Tbilisi, Rep of Georgia. [Kono, T.; Nagai, R.] Ochanomizu Univ, Ochadai Acad Prod, Tokyo, Japan. [Konoplich, R.] Manhattan Coll, New York, NY USA. [Leisos, A.] Hellenic Open Univ, Patras, Greece. [Lin, S. C.] Acad Sinica, Inst Phys, Acad Sinica Grid Comp, Taipei, Taiwan. [Myagkov, A. G.; Nikolaenko, V.; Zaitsev, A. M.] State Univ, Moscow Inst Phys & Technol, Dolgoprudnyi, Russia. [Pasztor, G.] Eotvos Lorand Univ, Budapest, Hungary. [Pinamonti, M.] Scuola Int Super Studi Avanzati, SISSA, Trieste, Italy. [Purohit, M.] Univ South Carolina, Dept Phys & Astron, Columbia, SC 29208 USA. [Shi, L.] Sun Yat Sen Univ, Sch Phys & Engn, Guangzhou 510275, Guangdong, Peoples R China. [Shiyakova, M.] Bulgarian Acad Sci, Inst Nucl Res & Nucl Energy, Sofia, Bulgaria. [Smirnova, L. N.; Turchikhin, S.] Moscow MV Lomonosov State Univ, Fac Phys, Moscow, Russia. [Tompkins, L.] Stanford Univ, Dept Phys, Stanford, CA 94305 USA. [Toth, J.] Wigner Res Ctr Phys, Inst Particle & Nucl Phys, Budapest, Hungary. [Vest, A.] Flensburg Univ Appl Sci, Flensburg, Germany. [Yusuff, I.] Univ Malaya, Dept Phys, Kuala Lumpur, Malaysia. RP Aaboud, M (reprint author), Univ Mohamed Premier, Fac Sci, Oujda, Morocco.; Aaboud, M (reprint author), LPTPM, Oujda, Morocco. RI Mitsou, Vasiliki/D-1967-2009; Garcia, Jose /H-6339-2015; Vanyashin, Aleksandr/H-7796-2013; Camarri, Paolo/M-7979-2015; Carvalho, Joao/M-4060-2013; Prokoshin, Fedor/E-2795-2012; Zaitsev, Alexandre/B-8989-2017; Leitner, Rupert/C-2004-2017; Carli, Ina/C-2189-2017; messina, andrea/C-2753-2013; Guo, Jun/O-5202-2015; Livan, Michele/D-7531-2012; Villa, Mauro/C-9883-2009; Peleganchuk, Sergey/J-6722-2014; Yang, Haijun/O-1055-2015; Li, Liang/O-1107-2015; Monzani, Simone/D-6328-2017; Kuday, Sinan/C-8528-2014; Soldatov, Evgeny/E-3990-2017; Doyle, Anthony/C-5889-2009; Warburton, Andreas/N-8028-2013; Gladilin, Leonid/B-5226-2011; Mashinistov, Ruslan/M-8356-2015; Gutierrez, Phillip/C-1161-2011; Tikhomirov, Vladimir/M-6194-2015; White, Ryan/E-2979-2015; Kantserov, Vadim/M-9761-2015; Chekulaev, Sergey/O-1145-2015; Zhukov, Konstantin/M-6027-2015; Snesarev, Andrey/H-5090-2013; Solodkov, Alexander/B-8623-2017 OI Mitsou, Vasiliki/0000-0002-1533-8886; Vanyashin, Aleksandr/0000-0002-0367-5666; Camarri, Paolo/0000-0002-5732-5645; Carvalho, Joao/0000-0002-3015-7821; Prokoshin, Fedor/0000-0001-6389-5399; Zaitsev, Alexandre/0000-0002-4961-8368; Leitner, Rupert/0000-0002-2994-2187; Carli, Ina/0000-0002-0411-1141; Guo, Jun/0000-0001-8125-9433; Livan, Michele/0000-0002-5877-0062; Villa, Mauro/0000-0002-9181-8048; Peleganchuk, Sergey/0000-0003-0907-7592; Li, Liang/0000-0001-6411-6107; Monzani, Simone/0000-0002-0479-2207; Kuday, Sinan/0000-0002-0116-5494; Soldatov, Evgeny/0000-0003-0694-3272; Doyle, Anthony/0000-0001-6322-6195; Warburton, Andreas/0000-0002-2298-7315; Gladilin, Leonid/0000-0001-9422-8636; Mashinistov, Ruslan/0000-0001-7925-4676; Tikhomirov, Vladimir/0000-0002-9634-0581; White, Ryan/0000-0003-3589-5900; Kantserov, Vadim/0000-0001-8255-416X; Solodkov, Alexander/0000-0002-2737-8674 FU ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW, Austria; FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq, Brazil; FAPESP, Brazil; NSERC, Canada; NRC, Canada; CFI, Canada; CERN; CONICYT, Chile; CAS, China; MOST, China; NSFC, China; COLCIENCIAS, Colombia; MSMT CR, Czech Republic; MPO CR, Czech Republic; VSC CR, Czech Republic; DNRF, Denmark; DNSRC, Denmark; IN2P3-CNRS, France; CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, Germany; HGF, Germany; MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, Israel; I-CORE, Israel; Benoziyo Center, Israel; INFN, Italy; MEXT, Japan; JSPS, Japan; CNRST, Morocco; FOM, Netherlands; NWO, Netherlands; RCN, Norway; MNiSW, Poland; NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia, Russian Federation; NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS, Slovenia; MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC, Sweden; Wallenberg Foundation, Sweden; SERI, Switzerland; SNSF, Switzerland; Cantons of Bern and Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE, United States of America; NSF, United States of America; BCKDF, Canada; Canada Council, Canada; CANARIE, Canada; CRC, Canada; Compute Canada, Canada; FQRNT, Canada; Ontario Innovation Trust, Canada; EPLANET, European Union; ERC, European Union; FP7, European Union; Horizon 2020, European Union; Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, France; ANR, France; Region Auvergne, France; Fondation Partager le Savoir, France; DFG, Germany; AvH Foundation, Germany; Herakleitos programme - EU-ESF; Thales programme - EU-ESF; Aristeia programme - EU-ESF; Greek NSRF; BSF, Israel; GIF, Israel; Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Spain; Generalitat Valenciana, Spain; Royal Society, United Kingdom; Leverhulme Trust, United Kingdom FX We thank CERN for the very successful operation of the LHC, as well as the support staff from our institutions without whom ATLAS could not be operated efficiently. We acknowledge the support of ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW and FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq and FAPESP, Brazil; NSERC, NRC and CFI, Canada; CERN; CONICYT, Chile; CAS, MOST and NSFC, China; COLCIENCIAS, Colombia; MSMT CR, MPO CR and VSC CR, Czech Republic; DNRF and DNSRC, Denmark; IN2P3-CNRS, CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, HGF, and MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, I-CORE and Benoziyo Center, Israel; INFN, Italy; MEXT and JSPS, Japan; CNRST, Morocco; FOM and NWO, Netherlands; RCN, Norway; MNiSW and NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia and NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS and MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC and Wallenberg Foundation, Sweden; SERI, SNSF and Cantons of Bern and Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE and NSF, United States of America. In addition, individual groups and members have received support from BCKDF, the Canada Council, CANARIE, CRC, Compute Canada, FQRNT, and the Ontario Innovation Trust, Canada; EPLANET, ERC, FP7, Horizon 2020 and Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, ANR, Region Auvergne and Fondation Partager le Savoir, France; DFG and AvH Foundation, Germany; Herakleitos, Thales and Aristeia programmes co-financed by EU-ESF and the Greek NSRF; BSF, GIF and Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Generalitat Valenciana, Spain; the Royal Society and Leverhulme Trust, United Kingdom. The crucial computing support from all WLCG partners is acknowledged gratefully, in particular from CERN, the ATLAS Tier-1 facilities at TRIUMF (Canada), NDGF (Denmark, Norway, Sweden), CC-IN2P3 (France), KIT/GridKA (Germany), INFN-CNAF (Italy), NL-T1 (Netherlands), PIC (Spain), ASGC (Taiwan), RAL (UK) and BNL (USA), the Tier-2 facilities worldwide and large non-WLCG resource providers. Major contributors of computing resources are listed in Ref. [45]. NR 43 TC 1 Z9 1 U1 55 U2 55 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1434-6044 EI 1434-6052 J9 EUR PHYS J C JI Eur. Phys. J. C PD DEC 5 PY 2016 VL 76 IS 12 AR 670 DI 10.1140/epjc/s10052-016-4521-y PG 24 WC Physics, Particles & Fields SC Physics GA EE8RO UT WOS:000389893600002 PM 28316501 ER PT J AU Malischewski, M Peryshkov, DV Bukovsky, EV Seppelt, K Strauss, SH AF Malischewski, Moritz Peryshkov, Dmitry V. Bukovsky, Eric V. Seppelt, Konrad Strauss, Steven H. TI Structures of M-2(SO2)(6)B12F12 (M = Ag or K) and Ag-2(H2O)(4)B12F12: Comparison of the Coordination of SO2 versus H2O and of B12F122- versus Other Weakly Coordinating Anions to Metal Ions in the Solid State SO INORGANIC CHEMISTRY LA English DT Article ID BOND-VALENCE PARAMETERS; CRYSTAL-STRUCTURE; SULFUR-DIOXIDE; PORE-SIZE; WATER; COMPLEXES; DIFFRACTION; REFINEMENT; CHEMISTRY; OXIDATION AB The structures of three solvated monovalent cation salts of the superweak anion B12F122- (Y2-), K-2(SO2)(6)Y, Ag-2(SO2)(6)Y, and Ag-2(H2O)Y are reported and discussed with respect to previously reported structures of Ag+ and K+ with other weakly coordinating anions. The structures of K-2(SO2)(6)Y and Ag-2(SO2)(6)Y are isomorphous and are based on expanded cubic close-packed arrays of Y2- anions with M(OSO)(6)(+) complexes centered in the trigonal holes of one expanded close packed layer of B-12 centroids (circle dot). The K+ and A(g)+ ions have virtually identical bicapped trigonal prism MO6F2 coordination spheres, with M-O distances of 2.735(1)-3.032(2) angstrom for the potassium salt and 2.526(5)-2.790(5) angstrom for the silver salt. Each M(OSO)(6)(+) complex is connected to three other cationic complexes through their six mu-SO2-kappa O-1,kappa O-2' ligands. The structure of Ag-2(H2O)(4)Y is unique [different from that of K-2(H2O)(4)Y]. Planes of close-packed arrays of anions are offset from neighboring planes along only one of the linear circle dot...circle dot...circle dot directions of the close-packed arrays, with [Ag(mu-H2O)(2)Ag(mu-H2O)(2))](infinity) infinite chains between the planes of anions. There are two nearly identical AgO4F2 coordination spheres, with Ag-O distances of 2.371(5)-2.524(5) angstrom and Ag-F distances of 2.734(4)-2.751(4) A. This is only the second structurally characterized compound with four H2O molecules coordinated to a Ag ion in the solid state. Comparisons with crystalline H2O and SO2 solvates of other Ag+ and K+ salts of weakly coordinating anions show that (i) N[(SO2)(2)(1,2-C6H4)](-), BF4, SbF6-, and Al(OC(CF3)(3))(4)(-) coordinate much more strongly to Ag+ than does Y2-, (ii) SnF62- coordinates somewhat more strongly to Kl" than does and (iii) (BCl122-)-Cl-12 coordinates to r about the same as, if not slightly weaker than, Y2-. C1 [Malischewski, Moritz; Seppelt, Konrad] Free Univ Berlin, Inst Chem & Biochem, D-14195 Berlin, Germany. [Peryshkov, Dmitry V.; Bukovsky, Eric V.; Strauss, Steven H.] Colorado State Univ, Dept Chem, Ft Collins, CO 80523 USA. [Peryshkov, Dmitry V.] Univ South Carolina, Dept Chem & Biochem, Columbia, SC 29208 USA. [Bukovsky, Eric V.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. RP Seppelt, K (reprint author), Free Univ Berlin, Inst Chem & Biochem, D-14195 Berlin, Germany.; Strauss, SH (reprint author), Colorado State Univ, Dept Chem, Ft Collins, CO 80523 USA. EM seppelt@chemie.fu-berlin.de; steven.strauss@colostate.edu OI Peryshkov, Dmitry/0000-0002-5653-9502 FU Argonne National Laboratory, Edwards Air Force Base, CA (AFRL/RZSP); Colorado State University Foundation; Fonds der Chemischen Industrie; Deutsche Forschungsgemeinschaft [GRK 1582] FX The authors thank Dr. John L. Fulton, Professor Jack Passmore, and Professor Dr. Carsten Jenne for helpful discussions, Professor Dr. Peter Jones for his help in accessing crystallographic information for the structures in refs 33 and 34, and Mr. Matic Lozinshek for his help accessing crystallographic information for the structures in refs 38 and 51. S.H.S. acknowledges financial support from Argonne National Laboratory, Edwards Air Force Base, CA (AFRL/RZSP), and the Colorado State University Foundation, and M.M. acknowledges financial support from the Fonds der Chemischen Industrie and the Deutsche Forschungsgemeinschaft (GRK 1582: Fluorine as a Key Element). NR 51 TC 0 Z9 0 U1 5 U2 5 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 5 PY 2016 VL 55 IS 23 BP 12254 EP 12262 DI 10.1021/acs.inorgchem.6b01980 PG 9 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EE3NZ UT WOS:000389497600021 PM 27934406 ER PT J AU Shin, B Sutherlin, KD Ohta, T Ogura, T Solomon, EI Cho, J AF Shin, Bongki Sutherlin, Kyle D. Ohta, Takehiro Ogura, Takashi Solomon, Edward I. Cho, Jaeheung TI Reactivity of a Cobalt(III)-Hydroperoxo Complex in Electrophilic Reactions SO INORGANIC CHEMISTRY LA English DT Article ID SYNTHETIC CHELATE COMPOUNDS; O-O BOND; ACTIVATED BLEOMYCIN; HIGH-SPIN; RESONANCE RAMAN; SPECTROSCOPIC CHARACTERIZATION; ELECTRONIC-STRUCTURE; DIOXYGEN ACTIVATION; MOLECULAR-OXYGEN; COBALT COMPLEX AB The reactivity of mononuclear metal-hydroperoxo adducts has fascinated researchers in many areas due to their diverse biological and catalytic processes. In this study, a mononuclear cobalt(III)-peroxo complex bearing a tetradentate macrocyclic ligand, [Co-III(Me-3-TPADP)(O-2)](+) (Me-3-TPADP = 3,6,9- trimethy1-3,6,9-triaza-1(2,6)-pyridinacydodecaphane), was prepared by reacting [Co-II(Me-3-TPADP)(CH3CN)(2)](2+) with H2O2 in the presence of triethylamine. Upon protonation, the cobalt(III)-peroxo intermediate was converted into a cobalt (III)-hydroperoxo complex, [Co-III(Me-3-TPADP) (O2H) (CH3CN)](2+). The mononuclear cobalt(III)-peroxo and -hydroperoxo intermediates were characterized by a variety of physicochemical methods. Results of electrospray ionization mass spectrometry clearly show the transformation of the intermediates: the peak at m/z 339.2 assignable to the cobalt(III)-peroxo species disappears with concomitant growth of the peak at m/z 190.7 corresponding to the cobalt(III)-hydroperoxo complex (with bound CH3CN). Isotope labeling experiments further support the existence of the cobalt(III)-peroxo and hydroperoxo complexes. In particular, the O-O bond stretching frequency of the cobalt(III)-hydroperoxo complex was determined to be 851 cm(-1) for (O2H)-O-16 samples (803 cm(-1) for (O2H)-O-18 samples), and its Co-O vibrational energy was observed at 571 cm(-1) for (O2H)-O-16 samples (551 cm(-1) for (O2H)-O-18 samples; 568 cm(-1) for (O2H)-O-16-H-2 samples) by resonance Raman spectroscopy. Reactivity studies performed with the cobalt(III)-peroxo and hydroperoxo complexes in organic functionalizations reveal that the latter is capable of conducting oxygen atom transfer with an electrophilic character, whereas the former exhibits no oxygen atom transfer reactivity under the same reaction conditions. Alternatively, the cobalt(III)-hydroperoxo complex does not perform hydrogen atom transfer reactions, while analogous low-spin Fe(III)- hydroperoxo complexes are capable of this reactivity. Density functional theory calculations indicate that this lack of reactivity is due to the high free energy cost of O-O bond homolysis that would be required to produce the hypothetical Co(IV)-oxo product. C1 [Shin, Bongki; Cho, Jaeheung] DGIST, Dept Emerging Mat Sci, Daegu 42988, South Korea. [Sutherlin, Kyle D.; Solomon, Edward I.] Stanford Univ, Dept Chem, Stanford, CA 94305 USA. [Ohta, Takehiro; Ogura, Takashi] Univ Hyogo, Picobiol Inst, Grad Sch Life Sci, RSC UH LP Ctr, Mikazuki, Hyogo 6795148, Japan. [Solomon, Edward I.] Stanford Linear Accelerator Ctr, Stanford Synchrotron Radiat Lab, Menlo Pk, CA 94025 USA. RP Cho, J (reprint author), DGIST, Dept Emerging Mat Sci, Daegu 42988, South Korea.; Solomon, EI (reprint author), Stanford Univ, Dept Chem, Stanford, CA 94305 USA.; Solomon, EI (reprint author), Stanford Linear Accelerator Ctr, Stanford Synchrotron Radiat Lab, Menlo Pk, CA 94025 USA. EM edward.solomon@stanford.edu; jaeheung@dgist.ac.kr OI Shin, Bongki/0000-0003-3670-3536 FU NRF [2014R1A1A2056051]; Ministry of Science, ICT and Future Planning (DGIST RD Program) [16-BD-0403]; Ministry of Oceans and Fisheries (Marine Biotechnology Program) of Korea [20150220]; JSPS [15H00960]; National Institutes of Health [GM 40392]; Ministry of Science, ICT and Future Planning (KCRC) [2014M1A8A1049320]; Ministry of Science, ICT and Future Planning (KCGRC) [2016M3D3A01913243] FX J.C. at DGIST acknowledges the financial support from the NRF (2014R1A1A2056051), the Ministry of Science, ICT and Future Planning (DGIST R&D Program 16-BD-0403, KCRC 2014M1A8A1049320, and KCGRC 2016M3D3A01913243), and the Ministry of Oceans and Fisheries (Marine Biotechnology Program 20150220) of Korea. T. Og. acknowledges the support of "Strategic Young Researcher Overseas Visits Program for Accelerating Brain Circulation" and Grant-in-Aid for Scientific Research (No. 15H00960) both by JSPS. E.I.S. at Stanford University acknowledges financial support by the National Institutes of Health (Grant GM 40392). NR 85 TC 0 Z9 0 U1 10 U2 10 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 5 PY 2016 VL 55 IS 23 BP 12391 EP 12399 DI 10.1021/acs.inargchem.6b02288 PG 9 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EE3NZ UT WOS:000389497600035 PM 27934432 ER PT J AU Agnew, DW Sampson, MD Moore, CE Rheingold, AL Kubiak, CP Figueroa, JS AF Agnew, Douglas W. Sampson, Matthew D. Moore, Curtis E. Rheingold, Arnold L. Kubiak, Clifford P. Figueroa, Joshua S. TI Electrochemical Properties and CO2-Reduction Ability of m-Terphenyl Isocyanide Supported Manganese Tricarbonyl Complexes SO INORGANIC CHEMISTRY LA English DT Article ID ELECTROCATALYTIC CO2 REDUCTION; ELECTRON-TRANSFER REACTIONS; BULKY BIPYRIDINE LIGANDS; METAL-CARBONYL ANIONS; TRIS-ISOCYANIDE; SELF-EXCHANGE; DIOXIDE; RHENIUM; COORDINATION; SUBSTITUTION AB To circumvent complications with redox-active ligands commonly encountered in the study of manganese electrocatalysts for CO2 reduction, we have studied the electro-chemistry of the manganese mixed carbonyl/isocyanide complexes XMn(CO)(3)(CNArDipp2)(2) (X = counteranion), to evaluate the pairing effects of the counteranion and their influence over the potential necessary for metal-based reduction. The complexes described herein have been shown to act as functional analogues to the known homoleptic carbonyl manganese complexes[Mn-(CO)(5)]" (n = 1-, 0, 1+). The m-terphenyl isocyanide ligand CNArDipp2 improves the kinetic stability of the resulting mixed carbonyl/isocyanide systems, such that conversion among all three oxidation states is easily effected by chemical reagents. Here, we have utilized an electrochemical study to fully understand the redox chemistry of this system and its ability to facilitate CO2 reduction and to provide comparison to known manganese-based CO2 electrocatalysts. Two complexes, BrMn(CO)(3)(CNArDipp2)(2) and [Mn(THF)(CO)(3)(CNArDiPP2)(2)]OTf, have been studied using infrared spectroelectrochemistry (IR-SEC) to spectroscopically characterize the redox states of these complexes during the course of electrochemical reactions. A striking difference in the necessary potential leading to the first one-electron reduction has been found for the halide and triflate species, respectively. Complete selectivity for the formation of CO and CO32- is observed in the reactivity of [Mn(CO)(3)(CNArDiPP2)(2)](-)with CO2, which is deduced via the trapping and incorporation of liberated CO into the zerovalent species Mn(CO)(3)(CNArDiPP2)(2) to form the dimers Mn-2(CO)(7)(CNArDiPP2)(3) and Mn-2(CO)(8)(CNArDiPP2)(2). C1 [Agnew, Douglas W.; Sampson, Matthew D.; Moore, Curtis E.; Rheingold, Arnold L.; Kubiak, Clifford P.; Figueroa, Joshua S.] Univ Calif San Diego, Dept Chem & Biochem, 9500 Gilman Dr,Mail Code 0358, La Jolla, CA 92093 USA. [Sampson, Matthew D.] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Argonne, IL 60439 USA. RP Figueroa, JS (reprint author), Univ Calif San Diego, Dept Chem & Biochem, 9500 Gilman Dr,Mail Code 0358, La Jolla, CA 92093 USA. EM jsfig@ucsd.edu FU U.S. Department of Energy, Office of Science, Basic Energy Sciences [DE-SC0008058]; U.S. Department of Education; Air Force Office of Scientific Research through the MURI program under AFOSR [FA9550-10-1-0572] FX J.S.F. and D.W.A. are grateful to the U.S. Department of Energy, Office of Science, Basic Energy Sciences, for support of this research (DE-SC0008058) and the U.S. Department of Education for a GAANN fellowship (to D.W.A.). J.S.F. is a Camille Dreyfus Teacher-Scholar (2012-2017). C.P.K. and M.D.S. gratefully acknowledge support from the Air Force Office of Scientific Research through the MURI program under AFOSR Award No. FA9550-10-1-0572. NR 63 TC 0 Z9 0 U1 15 U2 15 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 5 PY 2016 VL 55 IS 23 BP 12400 EP 12408 DI 10.1021/acs.inorgchem.6b02299 PG 9 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EE3NZ UT WOS:000389497600036 PM 27934438 ER PT J AU Calta, NP Im, J Fang, L Chasapis, TC Bugaris, DE Chung, DY Kwok, WK Kanatzidis, MG AF Calta, Nicholas P. Im, Jino Fang, Lei Chasapis, Thomas C. Bugaris, Daniel E. Chung, Duck Young Kwok, Wai-Kwong Kanatzidis, Mercouri G. TI Hybridization Gap in the Semiconducting Compound SrIr4In2Ge4 SO INORGANIC CHEMISTRY LA English DT Article ID TRANSITION-METAL ALUMINIDES; AUGMENTED-WAVE METHOD; INTERMETALLIC COMPOUNDS; TRANSPORT AB Large single crystals of SrIr4In2Ge4 were synthesized using the In flux method. This compound is a hybridization gap semiconductor with an experimental optical band gap of E-g = 0.25(3) eV. It crystallizes in the tetragonal EuIr4In2Ge4 structure type with space group I (4) over bar 2m and unit cell parameters a = 6.9004(5) angstrom and c = 8.7120(9) angstrom. The electronic structure is very similar to both EuIr4In2Ge4 and the parent structure Ca3Ir4Ge4, suggesting that these compounds comprise a new family of hybridization gap materials that exhibit indirect gap, semi-conducting behavior at a valence electron count of 60 per formula unit, similar to the Heusler alloys. C1 [Calta, Nicholas P.; Fang, Lei; Chasapis, Thomas C.; Kanatzidis, Mercouri G.] Northwestern Univ, Dept Chem, Evanston, IL 60208 USA. [Calta, Nicholas P.] Lawrence Livermore Natl Lab, Phys & Life Sci Directorate, Livermore, CA USA. [Im, Jino] Korea Res Inst Chem Technol, Ctr Mol Modeling & Simulat, Chem Infrastruct Div, Ulsan, South Korea. [Fang, Lei; Bugaris, Daniel E.; Chung, Duck Young; Kwok, Wai-Kwong; Kanatzidis, Mercouri G.] Argonne Natl Lab, Mat Sci Div, Lemont, IL 60439 USA. RP Kanatzidis, MG (reprint author), Northwestern Univ, Dept Chem, Evanston, IL 60208 USA.; Kanatzidis, MG (reprint author), Argonne Natl Lab, Mat Sci Div, Lemont, IL 60439 USA. EM m-kanatzidis@northwestern.edu FU MRSEC program at the Materials Research Center [NSF DMR-1121262]; International Institute for Nanotechnology (IIN); State of Illinois, through the IIN; U. S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division; U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344] FX This work made use of the EPIC facility (NUANCE Center-Northwestern Univ.), which has received support through the MRSEC program (NSF DMR-1121262) at the Materials Research Center, the International Institute for Nanotechnology (IIN), and the State of Illinois, through the IIN. The work at Argonne National Laboratory was supported by the U. S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. N. P. C. was partially supported under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract No. DE-AC52-07NA27344. NR 26 TC 0 Z9 0 U1 9 U2 9 PU AMER CHEMICAL SOC PI WASHINGTON PA 1155 16TH ST, NW, WASHINGTON, DC 20036 USA SN 0020-1669 EI 1520-510X J9 INORG CHEM JI Inorg. Chem. PD DEC 5 PY 2016 VL 55 IS 23 BP 12477 EP 12481 DI 10.1021/acs.inorgchem.6b02617 PG 5 WC Chemistry, Inorganic & Nuclear SC Chemistry GA EE3NZ UT WOS:000389497600044 PM 27934417 ER PT J AU Andres, RJ Boden, TA Higdon, DM AF Andres, Robert J. Boden, Thomas A. Higdon, David M. TI Gridded uncertainty in fossil fuel carbon dioxide emission maps, a CDIAC example SO ATMOSPHERIC CHEMISTRY AND PHYSICS LA English DT Article ID CO2 EMISSIONS; COMBUSTION AB Due to a current lack of physical measurements at appropriate spatial and temporal scales, all current global maps and distributions of fossil fuel carbon dioxide (FFCO2) emissions use one or more proxies to distribute those emissions. These proxies and distribution schemes introduce additional uncertainty into these maps. This paper examines the uncertainty associated with the magnitude of gridded FFCO2 emissions. This uncertainty is gridded at the same spatial and temporal scales as the mass magnitude maps. This gridded uncertainty includes uncertainty contributions from the spatial, temporal, proxy, and magnitude components used to create the magnitude map of FFCO2 emissions. Throughout this process, when assumptions had to be made or expert judgment employed, the general tendency in most cases was toward overestimating or increasing the magnitude of uncertainty. The results of the uncertainty analysis reveal a range of 4-190 %, with an average of 120% (2 sigma) for populated and FFCO2-emitting grid spaces over annual timescales. This paper also describes a methodological change specific to the creation of the Carbon Dioxide Information Analysis Center (CDIAC) FFCO2 emission maps: the change from a temporally fixed population proxy to a temporally varying population proxy. C1 [Andres, Robert J.; Boden, Thomas A.] Oak Ridge Natl Lab, Carbon Dioxide Informat Anal Ctr, Oak Ridge, TN 37831 USA. [Higdon, David M.] Virginia Tech Univ, Biocomplex Inst, Blacksburg, VA 24061 USA. RP Andres, RJ (reprint author), Oak Ridge Natl Lab, Carbon Dioxide Informat Anal Ctr, Oak Ridge, TN 37831 USA. EM andresrj@ornl.gov OI ANDRES, ROBERT/0000-0001-8781-4979 NR 24 TC 1 Z9 1 U1 5 U2 5 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 1680-7316 EI 1680-7324 J9 ATMOS CHEM PHYS JI Atmos. Chem. Phys. PD DEC 5 PY 2016 VL 16 IS 23 BP 14979 EP 14995 DI 10.5194/acp-16-14979-2016 PG 17 WC Meteorology & Atmospheric Sciences SC Meteorology & Atmospheric Sciences GA ED9QX UT WOS:000389208700003 ER PT J AU Cao, PF Renna, L Stefano, G Brandizzi, F AF Cao, Pengfei Renna, Luciana Stefano, Giovanni Brandizzi, Federica TI SYP73 Anchors the ER to the Actin Cytoskeleton for Maintenance of ER Integrity and Streaming in Arabidopsis SO CURRENT BIOLOGY LA English DT Article ID ENDOPLASMIC-RETICULUM; MEMBRANE-FUSION; PROTEIN-TRANSPORT; NUCLEAR-ENVELOPE; TOBACCO-LEAVES; MYOSIN XI; GOLGI; CELLS; MICROTUBULES; ORGANIZATION AB The endoplasmic reticulum (ER) is an essential organelle that spreads throughout the cytoplasm as one interconnected network of narrow tubules and dilated cisternae that enclose a single lumen. The ER network undergoes extensive remodeling, which critically depends on membrane-cytoskeleton interactions [1]. In plants, the ER is also highly mobile, and its streaming contributes significantly to the movement of other organelles [2, 3]. The remodeling and motility of the plant ER rely mainly on actin [4] and to a minor extent on microtubules [5]. Although a three-way interaction between the ER, cytosolic myosin-XI, and F-actin mediates the plant ER streaming [6], the mechanisms underlying stable interaction of the ER membrane with actin are unknown. Early electron microscopy studies suggested a direct attachment of the plant ER with actin filaments [7, 8], but it is plausible that yet-unknown proteins facilitate anchoring of the ER membrane with the cytoskeleton. We demonstrate here that SYP73, a member of the plant Syp7 subgroup of SNARE proteins [9] containing actin-binding domains, is a novel ER membrane-associated actin-binding protein. We show that overexpression of SYP73 causes a striking rearrangement of the ER over actin and that, similar to mutations of myosin-XI [4, 10, 11], loss of SYP73 reduces ER streaming and affects overall ER network morphology and plant growth. We propose a model for plant ER remodeling whereby the dynamic rearrangement and streaming of the ER network depend on the propelling action of myosin-XI over actin coupled with a SYP73-mediated bridging, which dynamically anchors the ER membrane with actin filaments. C1 [Cao, Pengfei; Renna, Luciana; Stefano, Giovanni; Brandizzi, Federica] Michigan State Univ, MSU DOE Plant Res Lab, E Lansing, MI 48824 USA. [Cao, Pengfei; Renna, Luciana; Stefano, Giovanni; Brandizzi, Federica] Michigan State Univ, Dept Plant Biol, E Lansing, MI 48824 USA. RP Brandizzi, F (reprint author), Michigan State Univ, MSU DOE Plant Res Lab, E Lansing, MI 48824 USA.; Brandizzi, F (reprint author), Michigan State Univ, Dept Plant Biol, E Lansing, MI 48824 USA. EM fb@msu.edu FU Chemical Sciences, Geosciences and Biosciences Division, Office of Basic Energy Sciences, Office of Science, US Department of Energy [DE-FG02-91ER20021]; National Science Foundation [MCB1243792]; MSU AgBioResearch FX We acknowledge support by the Chemical Sciences, Geosciences and Biosciences Division, Office of Basic Energy Sciences, Office of Science, US Department of Energy (award number DE-FG02-91ER20021), the National Science Foundation (MCB1243792), and MSU AgBioResearch. We are grateful to Mr. Robert Loepp (MSU) for construction of the SYP73-GFP fusion. NR 38 TC 0 Z9 0 U1 16 U2 16 PU CELL PRESS PI CAMBRIDGE PA 600 TECHNOLOGY SQUARE, 5TH FLOOR, CAMBRIDGE, MA 02139 USA SN 0960-9822 EI 1879-0445 J9 CURR BIOL JI Curr. Biol. PD DEC 5 PY 2016 VL 26 IS 23 BP 3245 EP 3254 DI 10.1016/j.cub.2016.10.024 PG 10 WC Biochemistry & Molecular Biology; Cell Biology SC Biochemistry & Molecular Biology; Cell Biology GA EE4QS UT WOS:000389590500033 PM 27866894 ER PT J AU He, MF Lau, KC Ren, XD Xiao, N McCulloch, WD Curtiss, LA Wu, YY AF He, Mingfu Lau, Kah Chun Ren, Xiaodi Xiao, Neng McCulloch, William D. Curtiss, Larry A. Wu, Yiying TI Concentrated Electrolyte for the Sodium-Oxygen Battery: Solvation Structure and Improved Cycle Life SO ANGEWANDTE CHEMIE-INTERNATIONAL EDITION LA English DT Article DE electrochemistry; energy storage; molecular dynamics; Raman spectroscopy; sodium-oxygen batteries ID DIMETHYL-SULFOXIDE; LI-O-2 BATTERIES; LITHIUM-ION; SUPERCONCENTRATED ELECTROLYTES; NA-O-2 BATTERIES; SALT ELECTROLYTE; STABILITY; ELECTROCHEMISTRY; PERFORMANCE; SUPEROXIDE AB Alkali metal-oxygen batteries are of great interests for energy storage because of their unparalleled theoretical energy densities. Particularly attractive is the emerging Na-O-2 battery because of the formation of superoxide as the discharge product. Dimethyl sulfoxide (DMSO) is a promising solvent for this battery but its instability towards Na makes it impractical in the Na-O-2 battery. Herein we report the enhanced stability of Na in DMSO solutions containing concentrated sodium trifluoromethanesulfonimide (NaTFSI) salts (>3molkg(-1)). Raman spectra of NaTFSI/DMSO electrolytes and abinitio molecular dynamics simulation reveal the Na+ solvation number in DMSO and the formation of Na(DMSO)(3)(TFSI)-like solvation structure. The majority of DMSO molecules solvating Na+ in concentrated solutions reduces the available free DMSO molecules that can react with Na and renders the TFSI anion decomposition, which protects Na from reacting with the electrolyte. Using these concentrated electrolytes, Na-O-2 batteries can be cycled forming sodium superoxide (NaO2) as the sole discharge product with improved long cycle life, highlighting the beneficial role of concentrated electrolytes for Na-based batteries. C1 [He, Mingfu; Ren, Xiaodi; Xiao, Neng; McCulloch, William D.; Wu, Yiying] Ohio State Univ, Dept Chem & Biochem, 100 West 18th Ave, Columbus, OH 43210 USA. [Lau, Kah Chun] Calif State Univ, Dept Phys & Astron, 18111 Nordhoff St, Northridge, CA 91330 USA. [Curtiss, Larry A.] Argonne Natl Lab, Div Mat Sci, 9700 S Cass Ave, Lemont, IL 60439 USA. RP Wu, YY (reprint author), Ohio State Univ, Dept Chem & Biochem, 100 West 18th Ave, Columbus, OH 43210 USA.; Lau, KC (reprint author), Calif State Univ, Dept Phys & Astron, 18111 Nordhoff St, Northridge, CA 91330 USA. EM kahchun.lau@csun.edu; wu@chemistry.ohio-state.edu FU National Science Foundation [IIP-1542995]; LCRC Fusion and Blues Cluster at Argonne National Laboratory; U.S. Department of Energy from the Vehicle Technologies Office, Department of Energy, Office of Energy Efficiency and Renewable Energy [DE-AC02-06CH11357] FX This work was financially supported by the National Science Foundation (grant number IIP-1542995). K.C.L. acknowledges the grants of computer time through the LCRC Fusion and Blues Cluster at Argonne National Laboratory. K.C.L. and L.A. Curtiss also acknowledge the support by the U.S. Department of Energy under contract number DE-AC02-06CH11357 from the Vehicle Technologies Office, Department of Energy, Office of Energy Efficiency and Renewable Energy. NR 29 TC 2 Z9 2 U1 42 U2 42 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1433-7851 EI 1521-3773 J9 ANGEW CHEM INT EDIT JI Angew. Chem.-Int. Edit. PD DEC 5 PY 2016 VL 55 IS 49 BP 15310 EP 15314 DI 10.1002/anie.201608607 PG 5 WC Chemistry, Multidisciplinary SC Chemistry GA ED9WL UT WOS:000389224000021 PM 27809386 ER PT J AU Piercey, DG Chavez, DE Scott, BL Imler, GH Parrish, DA AF Piercey, Davin G. Chavez, David E. Scott, Brian L. Imler, Greg H. Parrish, Damon A. TI An Energetic Triazolo-1,2,4-Triazine and its N-Oxide SO ANGEWANDTE CHEMIE-INTERNATIONAL EDITION LA English DT Article DE 1,2,4-triazines; 1,2,4-triazoles; bicyclic compounds; energetic materials; nitroacetonitriles ID INSENSITIVE HIGH-EXPLOSIVES; ELEMENTAL FLUORINE; HETEROCYCLE; CHEMISTRY; DESIGN; NITRO; WATER AB The reaction of 3-amino-5-nitro-1,2,4-triazole with nitrous acid produces the corresponding diazonium salt. When the diazonium salt is treated with nitroacetonitrile, a subsequent condensation and cyclization reaction occurres to produced 4-amino-3,7-dinitrotriazolo-[5,1-c][1,2,4] triazine (DPX-26). X-ray crystallographic analysis shows that the DPX-26 has a density of 1.86gcm(-3), while it is calculated to have a heat of formation of 398.3kJmol(-1). DPX-26 is predicted to approach the explosive performance of RDX but displays significantly better safety properties. Oxidation of DPX-26 using hypofluorous acid produces 4-amino-3,7-dinitrotriazolo-[5,1-c][1,2,4] triazine 4-oxide (DPX-27), which is also predicted to be a high-performance material with enhanced safety properties. C1 [Piercey, Davin G.] Nalas Engn Inc, Centerbrook, CT 06409 USA. [Chavez, David E.] Los Alamos Natl Lab, M Div, Los Alamos, NM 87545 USA. [Scott, Brian L.] Los Alamos Natl Lab, C Div, Los Alamos, NM 87545 USA. [Imler, Greg H.; Parrish, Damon A.] Naval Res Lab, Washington, DC 20375 USA. RP Chavez, DE (reprint author), Los Alamos Natl Lab, M Div, Los Alamos, NM 87545 USA. EM dechavez@lanl.gov RI Scott, Brian/D-8995-2017 OI Scott, Brian/0000-0003-0468-5396 FU Joint Munitions Technology Development Program; Laboratory Directed Research and Development Program; U.S. Department of Energy [DE-AC52-06NA25396]; Office of Naval Research [N00014-15-WX-0-0149] FX We would like to thank Thomas W. Myers for providing support in finalizing the crystal structure for DPX-27-2H2O, Stephanie Hagelberg (elemental analysis) for characterization, Hongzhao Tian and Jose G. Archuleta, (sensitivity testing), and Mary Sandstrom (thermal analysis). We would also like to thank the Joint Munitions Technology Development Program and The Laboratory Directed Research and Development Program for funding this work. Los Alamos National Laboratory is operated by Los Alamos National Security (LANS, LLC) under contract No. DE-AC52-06NA25396 for the U.S. Department of Energy. The authors also thank the Office of Naval Research (Award No. N00014-15-WX-0-0149) NR 41 TC 2 Z9 2 U1 16 U2 16 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1433-7851 EI 1521-3773 J9 ANGEW CHEM INT EDIT JI Angew. Chem.-Int. Edit. PD DEC 5 PY 2016 VL 55 IS 49 BP 15315 EP 15318 DI 10.1002/anie.201608723 PG 4 WC Chemistry, Multidisciplinary SC Chemistry GA ED9WL UT WOS:000389224000022 PM 27862728 ER PT J AU Creus, J Matheu, R Penafiel, I Moonshiram, D Blondeau, P Benet-Buchholz, J Garcia-Anton, J Sala, X Godard, C Llobet, A AF Creus, Jordi Matheu, Roc Penafiel, Itziar Moonshiram, Dooshaye Blondeau, Pascal Benet-Buchholz, Jordi Garcia-Anton, Jordi Sala, Xavier Godard, Cyril Llobet, Antoni TI A Million Turnover Molecular Anode for Catalytic Water Oxidation SO ANGEWANDTE CHEMIE-INTERNATIONAL EDITION LA English DT Article DE electrocatalysis; redox properties; transition metal complexes; water oxidation catalysis; water splitting ID CARBON ELECTRODES; NANOTUBES; COMPLEXES AB Molecular ruthenium-based water oxidation catalyst precursors of general formula [Ru(tda)(L-i)(2)] (tda(2-) is [2,2:6,2-terpyridine]-6,6-dicarboxylato; L-1=4-(pyren-1-yl)-N-(pyridin-4-ylmethyl)butanamide, 1b; L-2=4-(pyren-1-yl)pyridine), 1c), have been prepared and thoroughly characterized. Both complexes contain a pyrene group allowing ready and efficiently anchoring via interactions on multi-walled carbon nanotubes (MWCNT). These hybrid solid state materials are exceptionally stable molecular water-oxidation anodes capable of carrying out more than a million turnover numbers (TNs) at pH7 with an E-app=1.45V vs. NHE without any sign of degradation. XAS spectroscopy analysis before, during, and after catalysis together with electrochemical techniques allow their unprecedented oxidative ruggedness to be monitored and verified. C1 [Creus, Jordi; Garcia-Anton, Jordi; Sala, Xavier; Llobet, Antoni] Univ Autnoma Barcelona, Dept Quim, Carrer Dels Til Lers S-N, Cerdanyola Del Valles 08193, Spain. [Creus, Jordi; Matheu, Roc; Penafiel, Itziar; Godard, Cyril] Univ Rovira & Virgili, Dept Quim Fis & Inorgan, Carrer Marcel Li Domingo S-N, Tarragona 43007, Spain. [Matheu, Roc; Benet-Buchholz, Jordi; Llobet, Antoni] BIST, Inst Chem Res Catalonia ICIQ, Avinguda Paisos Catalans 16, Tarragona 43007, Spain. [Moonshiram, Dooshaye] Argonne Natl Lab, Chem Sci & Engn Div, 9700 S Cass Ave, Lemont, IL USA. [Blondeau, Pascal] Univ Rovira & Virgili, Dept Quim Organ & Anal, Carrer Marcel Li Domingo S-N, Tarragona 43007, Spain. RP Sala, X; Llobet, A (reprint author), Univ Autnoma Barcelona, Dept Quim, Carrer Dels Til Lers S-N, Cerdanyola Del Valles 08193, Spain.; Godard, C (reprint author), Univ Rovira & Virgili, Dept Quim Fis & Inorgan, Carrer Marcel Li Domingo S-N, Tarragona 43007, Spain.; Llobet, A (reprint author), BIST, Inst Chem Res Catalonia ICIQ, Avinguda Paisos Catalans 16, Tarragona 43007, Spain.; Blondeau, P (reprint author), Univ Rovira & Virgili, Dept Quim Organ & Anal, Carrer Marcel Li Domingo S-N, Tarragona 43007, Spain. EM pascal.blondeau@urv.cat; xavier.sala@uab.cat; cyril.godard@urv.cat; allobet@iciq.cat RI Godard, Cyril/C-8469-2013; OI Godard, Cyril/0000-0001-5762-4904; Llobet, Antoni/0000-0002-6176-5272 FU UAB; Euroregio Pirineus Mediterrania; La Caixa; US DOE [DE-AC02-06-CH11357] FX A.L., X.S., and J.G.-A. thank MINECO (CTQ-2016-80058-R, SEV-2013-0319; CTQ-2014-52974-REDC and CTQ2015-64261-R). J.C. and R.M. respectively thank UAB, "Euroregio Pirineus Mediterrania" and "La Caixa" for PhD grants. D.M. acknowledges support from the US DOE, Contract No. DE-AC02-06-CH11357. This research used resources of Sector 20 beamline at the Advanced Photon Source which is operated by the US DOE and the Canadian Light Source J.G-A. thanks Serra Hunter Program. NR 18 TC 1 Z9 1 U1 27 U2 27 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 1433-7851 EI 1521-3773 J9 ANGEW CHEM INT EDIT JI Angew. Chem.-Int. Edit. PD DEC 5 PY 2016 VL 55 IS 49 BP 15382 EP 15386 DI 10.1002/anie.201609167 PG 5 WC Chemistry, Multidisciplinary SC Chemistry GA ED9WL UT WOS:000389224000037 PM 27897422 ER PT J AU Timokhina, I Miller, MK Wang, JT Beladi, H Cizek, P Hodgson, PD AF Timokhina, Ilana Miller, Michael K. Wang, Jiangting Beladi, Hossein Cizek, Pavel Hodgson, Peter D. TI On the Ti-Mo-Fe-C atomic clustering during interphase precipitation in the Ti-Mo steel studied by advanced microscopic techniques SO MATERIALS & DESIGN LA English DT Article DE Clusters; Ti-Mo interphase precipitation; Site-specific transmission electron microscopy; Atom probe tomography ID NANOMETER-SIZED CARBIDES; LOW-ALLOY STEELS; PROBE TOMOGRAPHY; HSLA STEELS; TRANSFORMATION; STRENGTH; NB; BOUNDARIES; AUSTENITE; FERRITE AB Site-specific transmission electron microscopy (TEM) and atom probe tomography (APT) have been used to study the Ti-Mo-Fe-C atomic clustering during interphase precipitation at the early stages of austenite to ferrite transformation in a Fe-0.03C-1.5Mn-0.2Si-0.29Cr-0.22Mo-0.05Ti-0.025Al (in wt.%) steel. We observed: (i) the formation of only clusters at the beginning of austenite-to-ferrite transformation and co-existence of numerous clusters along with interphase nano-scale precipitates during development of the transformation, (ii) the nano-precipitates were formed via transient metastable precipitates, and (iii) a cluster-hardening mechanism was proposed based on hardness test and APT and TEM characterization. It was suggested that the rapid hardening reactions, due to the formation of solute clusters, can accompany the early stages of solid solution decomposition, which precede the formation of interphase precipitates. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Timokhina, Ilana; Wang, Jiangting; Beladi, Hossein; Cizek, Pavel; Hodgson, Peter D.] Deakin Univ, Inst Frontier Mat, Geelong, Vic 3217, Australia. [Miller, Michael K.] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, Oak Ridge, TN USA. RP Timokhina, I (reprint author), Deakin Univ, GTP Res, Inst Frontier Mat, Geelong Technol Precinct, Geelong Waurn Ponds Campus, Geelong, Vic 3217, Australia. EM ilana.timokhina@deakin.edu.au; xkmxk8@comcast.net; jiangting.wang@deakin.edu.au; hossein.beladi@deakin.edu.au; pavel.cizek@deakin.edu.au; peter.hodgson@deakin.edu.au FU ARC Laureate Fellowship scheme; ORNL's Center for Nanophase Materials Sciences (CNMS); Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy FX The authors would like to acknowledge the technical and scientific support of the Center for Electron Microscopy at Monash University. One of the authors (IT) acknowledges the support of Outside Study Program from Deakin University. One of the authors (P.D.H.) also acknowledges the support of the ARC Laureate Fellowship scheme. Atom probe tomography (MKM) was supported through a user project supported by ORNL's Center for Nanophase Materials Sciences (CNMS), which is sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, U.S. Department of Energy. NR 29 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 5 PY 2016 VL 111 BP 222 EP 229 DI 10.1016/j.matdes.2016.08.086 PG 8 WC Materials Science, Multidisciplinary SC Materials Science GA EA8EY UT WOS:000386869300027 ER PT J AU Esteves, G Fancher, CM Wallace, M Johnson-Wilke, R Wilke, RHT Trolier-McKinstry, S Polcawichc, RG Jones, JL AF Esteves, Giovanni Fancher, Chris M. Wallace, Margeaux Johnson-Wilke, Raegan Wilke, Rudeger H. T. Trolier-McKinstry, Susan Polcawichc, Ronald G. Jones, Jacob L. TI In situ X-ray diffraction of lead zirconate titanate piezoMEMS cantilever during actuation SO MATERIALS & DESIGN LA English DT Article DE X-ray diffraction; PiezoMEMS; PZT; Thin film; Ferroelectrics ID DOMAIN-WALL MOTION; THIN-FILMS; PIEZOELECTRIC PROPERTIES; CERAMICS; STRAIN; MEMS; PIEZOCERAMICS; ORIENTATION AB Synchrotron X-ray diffraction (XRD) was used to probe the electric-field-induced response of a 500 nm lead zirconate titanate (52/48,Zr/Ti) (PZT) based piezoelectric microelectromechanical system (piezoMEMS) device. 90 degrees ferroelectric/ferroelastic domain reorientation was observed in a cantilever comprised of a 500 nm thick PZT film on a 3 mu m thick elastic layer composite of SiO2 and Si3N4. Diffraction data from sectors both parallel-and perpendicular-to-field showed the presence of ferroelastic texture, which is typically seen in in situ electric field diffraction studies of bulk tetragonal perovskite ferroelectrics. The fraction of domains reoriented into the field direction was quantified through the intensity changes of the 002 and 200 diffraction profiles. The maximum induced volume fraction calculated from the results was 20%, which is comparable to values seen in previous bulk and thin film ferroelectric diffraction studies. The novelty of the present work is that a fully released ferroelectric thin film device of micron scale dimensions (down to 60,000 mu m(3)) was interrogated in situ with an applied electric field using synchrotron XRD. Furthermore, the experiment demonstrates that 90 degrees ferroelectric/ferroelastic domain reorientation can be characterized in samples of such small dimensions. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Esteves, Giovanni; Fancher, Chris M.; Jones, Jacob L.] North Carolina State Univ, Dept Mat Sci & Engn, Raleigh, NC 27695 USA. [Wallace, Margeaux; Johnson-Wilke, Raegan; Wilke, Rudeger H. T.; Trolier-McKinstry, Susan] Penn State Univ, Dept Mat Sci & Engn, University Pk, PA 16802 USA. [Polcawichc, Ronald G.] US Army, Res Lab, Sensors & Electron Devices Directorate, Adelphi, MD 20783 USA. [Johnson-Wilke, Raegan; Wilke, Rudeger H. T.] Sandia Natl Labs, Elect Opt & Nano Mat, POB 5800, Albuquerque, NM 87185 USA. RP Jones, JL (reprint author), 911 Partners Way,EB1 Room 3002, Raleigh, NC 27695 USA. EM gesteve@ncsu.edu; cmfanche@ncsu.edu; Margeaux.wallace@gmail.com; rlj1248@gmail.com; rhwilke@sandia.gov; set1@psu.edu; ronald.g.polcawich.civ@mail.mil; jljone21@ncsu.edu RI Fancher, Chris/F-1293-2017 OI Fancher, Chris/0000-0002-3952-5168 FU U.S. National Science Foundation [DMR-1410907, DMR-1409399]; State of North Carolina; National Science Foundation; DOE Office of Science by Argonne National Laboratory [DE-AC02-06CH11357] FX The authors gratefully acknowledge support of this research from the U.S. National Science Foundation (DMR-1410907 and DMR-1409399). The authors acknowledge the use of the Analytical Instrumentation Facility (AIF) at North Carolina State University, which is supported by the State of North Carolina and the National Science Foundation. The authors would like to thank Mr. Jeffrey S. Pulskamp for his design of the microflight actuators and Ms. Mary G. Koebke for fabricating the PCB used for electrical testing. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357. NR 43 TC 0 Z9 0 U1 6 U2 6 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 5 PY 2016 VL 111 BP 429 EP 434 DI 10.1016/j.matdes.2016.09.011 PG 6 WC Materials Science, Multidisciplinary SC Materials Science GA EA8EY UT WOS:000386869300051 ER PT J AU Weaver, JS Kalidindi, SR AF Weaver, Jordan S. Kalidindi, Surya R. TI Mechanical characterization of Ti-6Al-4V titanium alloy at multiple length scales using spherical indentation stress-strain measurements SO MATERIALS & DESIGN LA English DT Article DE Hertzian indentation; Ti-64; Multi-scale; Nanoindentation; Microindentation ID CONTINUOUS STIFFNESS MEASUREMENT; FINITE-ELEMENT MODELS; EFFECTIVE ZERO-POINT; SINGLE-CRYSTALS; DEFORMATION-BEHAVIOR; ELASTIC-CONSTANTS; NANO-INDENTATION; PRISMATIC SLIP; TI-ALLOY; ALPHA-TI AB Recent advances in spherical indentation stress-strain protocols and analyses have demonstrated the capability for measuring reliably the local mechanical responses in polycrystalline metal samples at different length scales, ranging from sub-micron (regions within individual grains) to several hundreds of microns (regions covering several grains). These recent advances have now made it possible to study systematically the mechanical behavior of a single material system at different length scales, with tremendous potential to obtain new insights into the role of individual phases, interfaces, and other microscale constituents on the macroscale mechanical response of the material. In this paper, we report spherical indentation stress-strain measurements with different indenter sizes (microns to millimeters) on Ti-6Al-4V (Ti-64) which capture the mechanical response of single phase alpha-Ti-64, single colony (alpha-beta), few colonies, and many colonies of Ti-64. The results show that the average mechanical response (indentation modulus and yield strength) from multiple indentations remains relatively unchanged from single phase alpha to many colonies of Ti-64, while the variance in the response decreases with indenter size. The work-hardening response in indentation tests follows a similar behavior up to indentation zones of many colonies, which shows significantly higher work hardening rates. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Weaver, Jordan S.] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM USA. [Weaver, Jordan S.; Kalidindi, Surya R.] Georgia Inst Technol, George W Woodruff Sch Mech Engn, Atlanta, GA 30332 USA. RP Kalidindi, SR (reprint author), Georgia Inst Technol, George W Woodruff Sch Mech Engn, Atlanta, GA 30332 USA. EM surya.kalidindi@me.gatech.edu FU National Science Foundation (NSF) [CMMI-1333083] FX The authors gratefully acknowledge funding by the National Science Foundation (NSF CMMI-1333083). Any opinions, findings, and conclusions or recommendations expressed here are those of the authors and do not necessarily reflect the views of the NSF. We also wish to thank Dr. Don Shih of Boeing for his support and insight in addition to providing material for this study. We are grateful for the assistance of Mr. Dipen Patel in calculating the orientation dependent regression fits using spherical harmonics. Lastly, the authors wish to acknowledge the many helpful discussions with Mr. Matthew W. Priddy and Dr. David L. McDowell and their astute comments. NR 69 TC 1 Z9 1 U1 10 U2 10 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 5 PY 2016 VL 111 BP 463 EP 472 DI 10.1016/j.matdes.2016.09.016 PG 10 WC Materials Science, Multidisciplinary SC Materials Science GA EA8EY UT WOS:000386869300055 ER PT J AU Wang, L Wang, L Nie, ZH Ren, Y Xue, YF Zhu, RH Zhang, HF Fu, HM AF Wang, Liang Wang, Lu Nie, Zhihua Ren, Yang Xue, Yunfei Zhu, Ronghua Zhang, Haifeng Fu, Huameng TI Evolution of residual stress, free volume, and hardness in the laser shock peened Ti-based metallic glass SO MATERIALS & DESIGN LA English DT Article DE Bulk metallic glasses; Laser shock peening; High energy X-ray diffraction; Residual stress; Free volume; Hardness ID SYNCHROTRON-RADIATION; PLASTIC-DEFORMATION; NANOINDENTATION; COMPRESSION; FLOW AB Laser shock peening (LSP) with different cycles was performed on the Ti-based bulk metallic glasses (BMGs). The sub-surface residual stress of the LSPed specimens was measured by high-energy X-ray diffraction (HEXRD) and the near-surface residual stress was measured by scanning electron microscope/focused ion beam (SEM/FIB) instrument. The sub-surface residual stress in the LSP impact direction (about-170MPa) is much lower than that perpendicular to the impact direction (about -350 MPa), exhibiting anisotropy. The depth of the compressive stress zone increases from 400 mu m to 500 mu m with increasing LSP cycles. The highest near-surface residual stress is about -750 MPa. LSP caused the free volume to increase and the maximum increase appeared after the first LSP process. Compared with the hardness (567 +/- 7 HV) of the as-cast BMG, the hardness (590 +/- 9 HV) on the shocked surface shows a hardening effect due to the hardening mechanism of compressive residual stress; and the hardness (420 +/- 9 HV) on the longitudinal section shows a softening effect due to the softening mechanism of free volume. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Wang, Liang; Wang, Lu; Nie, Zhihua; Xue, Yunfei] Beijing Inst Technol, Sch Mat Sci & Engn, Beijing 100081, Peoples R China. [Ren, Yang] Argonne Natl Lab, Xray Sci Div, 9700 S Cass Ave, Argonne, IL 60439 USA. [Zhu, Ronghua] Tsinghua Univ, Sch Aerosp, AML, Beijing 100084, Peoples R China. [Zhang, Haifeng; Fu, Huameng] Chinese Acad Sci, Shenyang Natl Lab Mat Sci, Inst Met Res, Shenyang 110016, Peoples R China. RP Xue, YF (reprint author), Beijing Inst Technol, Sch Mat Sci & Engn, Beijing 100081, Peoples R China. EM xueyunfei@bit.edu.cn FU National Natural Science Foundation of China [51471035]; Beijing Higher Education Young Elite Teacher Project; Program of "One Hundred Talented People" of the Chinese Academy of Sciences; U.S. Department of Energy, Office of Science, Office of Basic Energy Science [DE-AC02-06CH11357] FX The authors gratefully acknowledge the financial support of the National Natural Science Foundation of China (No. 51471035), Beijing Higher Education Young Elite Teacher Project, and the Program of "One Hundred Talented People" of the Chinese Academy of Sciences. Use of the Advanced Photon Source was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Science, under Contract No. DE-AC02-06CH11357. NR 39 TC 0 Z9 0 U1 22 U2 22 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 5 PY 2016 VL 111 BP 473 EP 481 DI 10.1016/j.matdes.2016.09.017 PG 9 WC Materials Science, Multidisciplinary SC Materials Science GA EA8EY UT WOS:000386869300056 ER PT J AU Miao, YB Mo, K Zhou, ZJ Liu, X Lan, KC Zhang, GM Park, JS Almer, J Stubbins, JF AF Miao, Yinbin Mo, Kun Zhou, Zhangjian Liu, Xiang Lan, Kuan-Che Zhang, Guangming Park, Jun-Sang Almer, Jonathan Stubbins, James F. TI Load-partitioning in an oxide dispersion-strengthened 310 steel at elevated temperatures SO MATERIALS & DESIGN LA English DT Article DE Oxide dispersion-strengthened (ODS) alloy; Austenitic steel; Synchrotron scattering; High-resolution transmission; electron microscopy (HRTEM); In situ tensile investigation ID F/M ODS STEEL; TENSILE PROPERTIES; FERRITIC STEELS; STAINLESS-STEEL; ION IRRADIATION; SYNCHROTRON; NANOPARTICLES; DISLOCATION; EVOLUTION; STRAIN AB Here the high temperature tensile performance of an oxide dispersion-strengthened (ODS) 310 steel is reported upon. The microstructure of the steel was examined through both transmission electron microscopy (TEM) and synchrotron scattering. In situ synchrotron X-ray tensile investigation was performed at a variety of temperatures, from room temperature up to 800 degrees C. Pyrochlore structure yttrium titanate and sodium chloride structure titanium nitride phases were identified in the steel along with an austenite matrix and marginal residual alpha'-martensite. The inclusion phases strengthen the steel by taking extra load through particle-dislocation interaction during plastic deformation or dislocation creep procedures. As temperature rises, lattice strain measurement implies that the load partitioning effect of conventional precipitate phases starts to diminish, whereas those ultra-fine oxygen-enriched nanoparticles continue to maintain a considerable amount of extra lattice strain. Introduction of oxygen-enriched nanoparticles in austenitic steel is shown to improve the high temperature performance, making austenitic ODS steels promising for advanced nuclear applications. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Miao, Yinbin; Mo, Kun; Park, Jun-Sang; Almer, Jonathan] Argonne Natl Lab, Lemont, IL 60439 USA. [Miao, Yinbin; Liu, Xiang; Lan, Kuan-Che; Zhang, Guangming; Stubbins, James F.] Univ Illinois, Urbana, IL 61801 USA. [Zhou, Zhangjian; Zhang, Guangming] Univ Sci & Technol Beijing, Beijing 100082, Peoples R China. [Stubbins, James F.] Kyushu Univ, I2CNER, Fukuoka 8190395, Japan. RP Miao, YB (reprint author), Argonne Natl Lab, Lemont, IL 60439 USA. EM ymiao@anl.gov RI Liu, Xiang/D-2005-2017; OI Liu, Xiang/0000-0002-2634-1888; Miao, Yinbin/0000-0002-3128-4275 FU 973 DOE [INL120293]; U.S. Department of Energy (DOE) [DEFG02-07ER46453, DE-FG02-07ER46471]; International Institute for Carbon Neutral Energy Research - World Premier International Research Center Initiative (WPI), Ministry of Education, Culture, Sports, Science and Technology (MEXT), Japan [WPI-I2CNER]; UChicago Argonne, LLC [DE-AC02-06CH11357]; U.S. Department of Energy [DE-AC02-06CH11357] FX This work was supported by 973 DOE INL120293. The TEM experiments were carried out in part at the Frederick Seitz Materials Research Laboratory Central Facilities, University of Illinois, which is partially supported by the U.S. Department of Energy (DOE) under Grants DEFG02-07ER46453 and DE-FG02-07ER46471. The author gratefully acknowledge the support of the International Institute for Carbon Neutral Energy Research (WPI-I2CNER), sponsored by the World Premier International Research Center Initiative (WPI), Ministry of Education, Culture, Sports, Science and Technology (MEXT), Japan. The efforts involving Argonne National Laboratory were sponsored under Contract no. DE-AC02-06CH11357 between UChicago Argonne, LLC and the U.S. Department of Energy. NR 39 TC 1 Z9 1 U1 5 U2 5 PU ELSEVIER SCI LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND SN 0264-1275 EI 1873-4197 J9 MATER DESIGN JI Mater. Des. PD DEC 5 PY 2016 VL 111 BP 622 EP 630 DI 10.1016/j.matdes.2016.09.015 PG 9 WC Materials Science, Multidisciplinary SC Materials Science GA EA8EY UT WOS:000386869300072 ER PT J AU Petrache, CM Chen, QB Guo, S Ayangeakaa, AD Garg, U Matta, JT Nayak, BK Patel, D Meng, J Carpenter, MP Chiara, CJ Janssens, RVF Kondev, FG Lauritsen, T Seweryniak, D Zhu, S Ghugre, SS Palit, R AF Petrache, C. M. Chen, Q. B. Guo, S. Ayangeakaa, A. D. Garg, U. Matta, J. T. Nayak, B. K. Patel, D. Meng, J. Carpenter, M. P. Chiara, C. J. Janssens, R. V. F. Kondev, F. G. Lauritsen, T. Seweryniak, D. Zhu, S. Ghugre, S. S. Palit, R. TI Triaxial-band structures, chirality, and magnetic rotation in La-133 SO PHYSICAL REVIEW C LA English DT Article ID COINCIDENCE DATA SETS; COLLECTIVITY; SPIN AB The structure of La-133 has been investigated using the Cd-116(Ne-22,4pn) reaction and the Gammasphere array. Three new bands of quadrupole transitions and one band of dipole transitions are identified and the previously reported level scheme is revised and extended to higher spins. The observed structures are discussed using the cranked Nilsson-Strutinsky formalism, covariant density functional theory, and the particle-rotor model. Triaxial configurations are assigned to all observed bands. For the high-spin bands it is found that rotations around different axes can occur, depending on the configuration. The orientation of the angular momenta of the core and of the active particles is investigated, suggesting chiral rotation for two nearly degenerate dipole bands and magnetic rotation for one dipole band. It is shown that the h(11/2) neutron holes present in the configuration of the nearly degenerate dipole bands have significant angular momentum components not only along the long axis but also along the short axis, contributing to the balance of the angular momentum components along the short and long axes and thus giving rise to a chiral geometry. C1 [Petrache, C. M.; Guo, S.] CNRS IN2P3, Ctr Sci Nucl & Sci Mat, Bat 104-108, F-91405 Orsay, France. [Petrache, C. M.; Guo, S.] Univ Paris Saclay, Bat 104-108, F-91405 Orsay, France. [Chen, Q. B.; Meng, J.] Peking Univ, Sch Phys, State Key Lab Nucl Phys & Technol, Beijing 100871, Peoples R China. [Ayangeakaa, A. D.; Garg, U.; Matta, J. T.; Nayak, B. K.; Patel, D.] Univ Notre Dame, Dept Phys, Notre Dame, IN 46556 USA. [Carpenter, M. P.; Chiara, C. J.; Janssens, R. V. F.; Lauritsen, T.; Seweryniak, D.; Zhu, S.] Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. [Chiara, C. J.] Univ Maryland, Dept Chem & Biochem, College Pk, MD 20742 USA. [Kondev, F. G.] Argonne Natl Lab, Nucl Engn Div, Argonne, IL 60439 USA. [Ghugre, S. S.] UGC DAE Consortium Sci Res, Kolkata 700098, India. [Palit, R.] Tata Inst Fundamental Res, Bombay 400005, Maharashtra, India. [Palit, R.] Univ Notre Dame, Joint Inst Nucl Astrophys, Notre Dame, IN 46556 USA. [Ayangeakaa, A. D.] Argonne Natl Lab, Div Phys, Argonne, IL 60439 USA. [Matta, J. T.] Oak Ridge Natl Lab, Div Phys, Oak Ridge, TN 37830 USA. [Nayak, B. K.] Bhabha Atom Res Ctr, Div Nucl Phys, Bombay 400085, Maharashtra, India. [Patel, D.] MD Anderson Canc Ctr, Houston, TX 77030 USA. [Chiara, C. J.] US Army Res Lab, Adelphi, MD 20783 USA. RP Petrache, CM (reprint author), CNRS IN2P3, Ctr Sci Nucl & Sci Mat, Bat 104-108, F-91405 Orsay, France. RI Chen, Qibo/C-2054-2013; Meng, Jie/B-8548-2009; Palit, Rudrajyoti/F-5185-2012 OI Chen, Qibo/0000-0001-5159-4468; Meng, Jie/0000-0002-0977-5318; FU U.S. National Science Foundation [PHY07-58100, PHY-1068192, PHY-1419765]; U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-FG02-94ER40834, DE-AC02-06CH11357]; Chinese Major State 973 Program [2013CB834400]; National Natural Science Foundation of China [11175002, 11335002, 11375015, 11461141002]; Research Fund for the Doctoral Program of Higher Education [20110001110087]; China Postdoctoral Science Foundation [2015M580007, 2016T90007] FX This work has been supported in part by the U.S. National Science Foundation (Grants No. PHY07-58100, No. PHY-1068192, and No. PHY-1419765), the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under Grant No. DE-FG02-94ER40834 (U.M.) and Contract No. DE-AC02-06CH11357 (A.N.L.), the Chinese Major State 973 Program No. 2013CB834400, the National Natural Science Foundation of China (Grants No. 11175002, No. 11335002, No. 11375015, and No. 11461141002), the Research Fund for the Doctoral Program of Higher Education (Grant No. 20110001110087), and the China Postdoctoral Science Foundation under Grants No. 2015M580007 and No. 2016T90007. This research used resources of ANL's ATLAS facility, which is a DOE Office of Science User Facility. NR 33 TC 0 Z9 0 U1 3 U2 3 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 5 PY 2016 VL 94 IS 6 DI 10.1103/PhysRevC.94.064309 PG 14 WC Physics, Nuclear SC Physics GA EE3PH UT WOS:000389504200005 ER PT J AU Banerjee, D Elsaidi, SK Aguila, B Li, BY Kim, D Schweiger, MJ Kruger, AA Doonan, CJ Ma, SQ Thallapally, PK AF Banerjee, Debasis Elsaidi, Sameh K. Aguila, Briana Li, Baiyan Kim, Dongsang Schweiger, Michael J. Kruger, Albert A. Doonan, Christian J. Ma, Shengqian Thallapally, Praveen K. TI Removal of Pertechnetate-Related Oxyanions from Solution Using Functionalized Hierarchical Porous Frameworks SO CHEMISTRY-A EUROPEAN JOURNAL LA English DT Article DE covalent organic frameworks; ion exchange; metal-organic frameworks; nuclear waste; pertechtenate ID METAL-ORGANIC FRAMEWORKS; ION-EXCHANGE; NUCLEAR-WASTES; ANION-EXCHANGE; HIGH-CAPACITY; SEPARATION; TECHNETIUM; RESINS; REMEDIATION; SELECTIVITY AB Efficient and cost-effective removal of radioactive pertechnetate anions from nuclear waste is a key challenge to mitigate long-term nuclear waste storage issues. Traditional materials such as resins and layered double hydroxides (LDHs) were evaluated for their pertechnetate or perrhenate (the non-radioactive surrogate) removal capacity, but there is room for improvement in terms of capacity, selectivity and kinetics. A series of functionalized hierarchical porous frameworks were evaluated for their perrhenate removal capacity in the presence of other competing anions. C1 [Banerjee, Debasis; Elsaidi, Sameh K.; Thallapally, Praveen K.] Pacific Northwest Natl Lab, Phys & Computat Sci Directorate, Richland, WA 99352 USA. [Elsaidi, Sameh K.] Univ Alexandria, Dept Chem, Fac Sci, POB 426, Alexandria 21321, Egypt. [Aguila, Briana; Li, Baiyan; Ma, Shengqian] Univ S Florida, Dept Chem, Tampa, FL 33620 USA. [Kim, Dongsang; Schweiger, Michael J.] Pacific Northwest Natl Lab, Energy & Environm Directorate, Richland, WA 99354 USA. [Kruger, Albert A.] US DOE, Off River Protect, Richland, WA 99352 USA. [Doonan, Christian J.] Univ Adelaide, Dept Chem, Adelaide, SA 5005, Australia. RP Thallapally, PK (reprint author), Pacific Northwest Natl Lab, Phys & Computat Sci Directorate, Richland, WA 99352 USA.; Ma, SQ (reprint author), Univ S Florida, Dept Chem, Tampa, FL 33620 USA. EM shengqian.ma@usf.edu; praveen.thallapally@pnnl.gov RI Ma, Shengqian/B-4022-2012; OI Ma, Shengqian/0000-0002-1897-7069; Aguila, Briana/0000-0001-5997-3737 FU DOE Office of Environmental Management (E.M.) International Program; DOE [DE-AC05-76L01830] FX This work was supported by the DOE Office of Environmental Management (E.M.) International Program as a part of the portfolio managed by R. Rimando of EM-HQ. PNNL is a multiprogram national laboratory operated for the DOE by Battelle Memorial Institute under Contract DE-AC05-76L01830. NR 46 TC 2 Z9 2 U1 28 U2 28 PU WILEY-V C H VERLAG GMBH PI WEINHEIM PA POSTFACH 101161, 69451 WEINHEIM, GERMANY SN 0947-6539 EI 1521-3765 J9 CHEM-EUR J JI Chem.-Eur. J. PD DEC 5 PY 2016 VL 22 IS 49 BP 17581 EP 17584 DI 10.1002/chem.201603908 PG 4 WC Chemistry, Multidisciplinary SC Chemistry GA EC9NQ UT WOS:000388471700014 PM 27685610 ER PT J AU Valero-Vidal, C Herraiz-Cardona, I Perez-Herranz, V Igual-Munoz, A AF Valero-Vidal, Carlos Herraiz-Cardona, Isaac Perez-Herranz, Valentin Igual-Munoz, Anna TI Stability of 3D-porous Ni/Cu cathodes under real alkaline electrolyzer operating conditions and its effect on catalytic activity SO APPLIED CATALYSIS B-ENVIRONMENTAL LA English DT Article DE Hydrogen evolution reaction (HER); Service life tests; Alkaline water electrolyzers; Ni/Cu cathodes ID HYDROGEN EVOLUTION REACTION; SODIUM-HYDROXIDE SOLUTION; POROUS NICKEL ELECTRODES; SERVICE LIFE TEST; WATER ELECTROLYSIS; OXYGEN EVOLUTION; AC IMPEDANCE; ELECTROCHEMICAL CHARACTERIZATION; CHLORALKALI ELECTROLYSIS; FARADAIC REACTIONS AB Despite the development and synthesis of new electrode materials for hydrogen generation in alkaline water electrolyzers has been a research topic widely exploited in the last years, stability tests on the obtained cathodes have been restricted to long-term potentiostatic/galvanostatic experiments which do not fulfil the real operating conditions that take place in those devices. In this work, two different Service Life Tests have been designed and implemented, aiming at including particular conditions (i.e. inverse polarity and short-circuit) in the durability and catalytic activity of cathode characterization. For this purpose, Ni/Cu bilayered porous electrodes were prepared using different Ni electrodeposition times (15, 30 and 45 min) following a double template electrochemical method. It has been confirmed that the electrode with the lowest Ni content can be considered as a promising electrocatalyst for hydrogen production under industrial conditions because of its optimal activity and stability after the two sets of testing conditions. In particular, electrochemical studies demonstrated that an inversion in polarity can positively affect the electrode performance, as a consequence of the synergetic interaction between CuO/Cu(OH)(2) and beta-Ni(OH)(2) species formed at potentials below the oxygen evolution domain. (C) 2016 Elsevier B.V. All rights reserved. C1 [Valero-Vidal, Carlos; Herraiz-Cardona, Isaac; Perez-Herranz, Valentin; Igual-Munoz, Anna] Univ Politecn Valencia, Dept Ingn Quim & Nucl, IEC, Cami Vera S-N, E-46022 Valencia, Spain. [Valero-Vidal, Carlos] Lawrence Berkeley Natl Lab, ALS, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Valero-Vidal, Carlos] Lawrence Berkeley Natl Lab, JCESR, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Herraiz-Cardona, Isaac] Univ Jaume 1, Inst Adv Mat INAM, Castellon de La Plana 12006, Spain. RP Valero-Vidal, C (reprint author), Univ Politecn Valencia, Dept Ingn Quim & Nucl, IEC, Cami Vera S-N, E-46022 Valencia, Spain. EM cvalerovidal@lbl.gov; iherraiz@uji.es FU Generalitat Valenciana [PROMETEO/2010/023]; Spanish Government (Ministerio de Ciencia e Innovation) [AP2007-01243, AP2007-03737] FX The authors gratefully acknowledge financial support given by the Generalitat Valenciana (PROMETEO/2010/023) and Spanish Government (Ministerio de Ciencia e Innovation) for the postgraduate grants AP2007-01243 (Carlos Valero-Vidal) and AP2007-03737 (Isaac Herraiz-Cardona). NR 77 TC 0 Z9 0 U1 85 U2 109 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0926-3373 EI 1873-3883 J9 APPL CATAL B-ENVIRON JI Appl. Catal. B-Environ. PD DEC 5 PY 2016 VL 198 BP 142 EP 153 DI 10.1016/j.apcatb.2016.05.030 PG 12 WC Chemistry, Physical; Engineering, Environmental; Engineering, Chemical SC Chemistry; Engineering GA DU1EC UT WOS:000381950000016 ER PT J AU Wang, AG He, P Yung, M Zeng, HB Qian, H Song, H AF Wang, Aiguo He, Peng Yung, Matthew Zeng, Hongbo Qian, Hui Song, Hua TI Catalytic co-aromatization of ethanol and methane SO APPLIED CATALYSIS B-ENVIRONMENTAL LA English DT Article DE Methane; Ethanol; Catalyst; Aromatization; ZSM-5 ID NONOXIDATIVE ACTIVATION; MO/HZSM-5 CATALYSTS; HYDROGEN-PRODUCTION; ZEOLITE CATALYSTS; LOW-TEMPERATURE; ACID CATALYSTS; CONVERSION; ZSM-5; DEHYDROGENATION; HYDROCARBONS AB This study demonstrates the technical feasibility of simultaneously converting ethanol and methane into liquid hydrocarbons at mild reaction conditions (400 degrees C and 1 atm) over silver and/or zinc modified zeolite catalysts. After GC-MS analysis, it is worth noting that aromatics are the major compounds contained in the liquid product collected from the run when 1%Ag/ZSM-5, particularly after H-2 pretreatment, is charged. Compared to the performance exhibited from the run with pure HZSM-5 support engaged, Ag addition into the HZSM-5 framework favors aromatics formation, which might be closely associated with better Ag dispersion and more abundance of strong surface acidic sites where aromatization might take place while Zn loading exerts a detrimental effect on the production of aromatics but promotes the ether generation possibly through dehydration reaction. Referred to that from its N-2 counterpart, the increased aromatics formation of the collected liquid product when methane is present indicates that methane existence might facilitate ethanol aromatization. Moreover, combined with the increased carbon number in the formed aromatics from CH4 run when H-2 run is referred and zero liquid formation from CH4-alone test as well as more prominent endothermic feature of methane run and more importantly the notably increased C-13 signals in C-13 NMR spectra of the liquid product collected during ethanol conversion under (CH4)-C-13 environment, all the observations suggest that methane might be activated nonoxidadvely and converted into higher hydrocarbons, preferentially into aromatics if suitable catalyst is charged under the assistance of co-existing oxygenated hydrocarbon. The reported synergetic effect could potentially lead to the more economic utilization of abundant natural gas and cellulosic ethanol. (C) 2016 Elsevier B.V. All rights reserved. C1 [Wang, Aiguo; He, Peng; Song, Hua] Univ Calgary, Dept Chem & Petr Engn, 2500 Univ Dr NW, Calgary, AB T2N 1N4, Canada. [Yung, Matthew] Natl Bioenergy Ctr, Natl Renewable Energy Lab, 15013 Denver West Pkwy, Golden, CO 80401 USA. [Zeng, Hongbo] Univ Alberta, Dept Chem & Mat Engn, 9211-116 St NW, Edmonton, AB T6G 1H9, Canada. [Qian, Hui] CNR, Natl Inst Nanotechnol, Edmonton, AB T6G 2M9, Canada. RP Song, H (reprint author), Univ Calgary, Dept Chem & Petr Engn, 2500 Univ Dr NW, Calgary, AB T2N 1N4, Canada. EM sonh@ucalgary.ca OI Song, Hua/0000-0002-2791-1723 FU Natural Sciences and Engineering Research Council of Canada (NSERC) [RGPIN/04385-2014] FX We gratefully acknowledge the financial supports from Natural Sciences and Engineering Research Council of Canada (NSERC, RGPIN/04385-2014). NR 40 TC 0 Z9 0 U1 54 U2 64 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 0926-3373 EI 1873-3883 J9 APPL CATAL B-ENVIRON JI Appl. Catal. B-Environ. PD DEC 5 PY 2016 VL 198 BP 480 EP 492 DI 10.1016/j.apcatb.2016.06.013 PG 13 WC Chemistry, Physical; Engineering, Environmental; Engineering, Chemical SC Chemistry; Engineering GA DU1EC UT WOS:000381950000048 ER PT J AU Booth, EA Sterling, SM Dovala, D Nogales, E Thorner, J AF Booth, Elizabeth A. Sterling, Sarah M. Dovala, Dustin Nogales, Eva Thorner, Jeremy TI Effects of Bni5 Binding on Septin Filament Organization SO JOURNAL OF MOLECULAR BIOLOGY LA English DT Article DE yeast (Saccharomyces cerevisiae); FRET analysis; electron microscopy; analytical ultracentrifugation; field-flow fractionation ID METAL AFFINITY-CHROMATOGRAPHY; CELL-DIVISION CYCLE; SACCHAROMYCES-CEREVISIAE; BUDDING YEAST; ELECTRON-MICROSCOPY; CRYSTAL-STRUCTURE; GENETIC-CONTROL; RING FORMATION; BUD NECK; IN-VITRO AB Septins are a protein family found in all eukaryotes (except higher plants) that have roles in membrane remodeling and formation of diffusion barriers and as a scaffold to recruit other proteins. In budding yeast, proper execution of cytokinesis and cell division requires the formation of a collar of circumferential filaments at the bud neck. These filaments are assembled from apolar septin hetero-octamers. Currently, little is known about the mechanisms that control the arrangement and dynamics of septin structures. In this study, we utilized both Forster resonance energy transfer and electron microscopy to analyze the biophysical properties of the septin-binding protein Bni5 and how its association with septin filaments affects their organization. We found that the interaction of Bni5 with the terminal subunit (Cdc11) at the junctions between adjacent hetero-octamers in paired filaments is highly cooperative. Both the C-terminal end of Bni5 and the C-terminal extension of Cdc11 make important contributions to their interaction. Moreover, this binding may stabilize the dimerization of Bni5, which, in turn, forms cross-filament braces that significantly narrow, and impose much more uniform spacing on, the gap between paired filaments. (C) 2016 The Authors. Published by Elsevier Ltd. C1 [Booth, Elizabeth A.; Sterling, Sarah M.; Nogales, Eva; Thorner, Jeremy] Univ Calif Berkeley, Div Biochem Biophys & Struct Biol, Dept Mol & Cell Biol, Berkeley, CA 94720 USA. [Dovala, Dustin] Univ Calif San Francisco, Dept Microbiol & Immunol, Program Microbial Pathogenesis & Host Def, Sch Med, San Francisco, CA 94143 USA. [Nogales, Eva] Lawrence Berkeley Natl Lab, Div Life Sci, Berkeley, CA 94720 USA. [Nogales, Eva] Howard Hughes Med Inst, Chevy Chase, MD 20815 USA. [Booth, Elizabeth A.] Grifols Diagnost Solut Inc, Dept Res & Dev, 4560 Horton St, Emeryville, CA 94608 USA. [Dovala, Dustin] Novartis Inst BioMed Res, 5300 Chiron Way, Emeryville, CA 94608 USA. RP Thorner, J (reprint author), Univ Calif Berkeley, Dept Mol & Cell Biol, 526 Barker Hall, Berkeley, CA 94720 USA. EM jthorner@berkeley.edu FU National Institutes of Health [GM21841, GM101314] FX This work was supported by National Institutes of Health R01 Grants GM21841 (to J.T.) and GM101314 (to J.T. and E.N.). E.N. is an Investigator of the Howard Hughes Medical Institute (HHMI). We thank members of the Thorner and Nogales Labs for helpful comments and suggestions during the course of these studies. We especially thank John Hall at Grifols Diagnostics Solutions, Inc. for sharing his expertise with FFF-MALS and for technical assistance with our FFF-MALS experiments. NR 82 TC 0 Z9 0 U1 3 U2 3 PU ACADEMIC PRESS LTD- ELSEVIER SCIENCE LTD PI LONDON PA 24-28 OVAL RD, LONDON NW1 7DX, ENGLAND SN 0022-2836 EI 1089-8638 J9 J MOL BIOL JI J. Mol. Biol. PD DEC 4 PY 2016 VL 428 IS 24 BP 4962 EP 4980 DI 10.1016/j.jmb.2016.10.024 PN B PG 19 WC Biochemistry & Molecular Biology SC Biochemistry & Molecular Biology GA EF9AV UT WOS:000390624000008 PM 27806918 ER PT J AU Aaboud, M Aad, G Abbott, B Abdallah, J Abdinov, O Abeloos, B Aben, R AbouZeid, OS Abraham, NL Abramowicz, H Abreu, H Abreu, R Abulaiti, Y Acharya, BS Adamczyk, L Adams, DL Adelman, J Adomeit, S Adye, T Affolder, AA Agatonovic-Jovin, T Agricola, J Aguilar-Saavedra, JA Ahlen, SP Ahmadov, F Aielli, G Akerstedt, H Akesson, TPA Akimov, AV Alberghi, GL Albert, J Albrand, S Verzini, MJA Aleksa, M Aleksandrov, IN Alexa, C Alexander, G Alexopoulos, T Alhroob, M Aliev, M Alimonti, G Alison, J Alkire, SP Allbrooke, BMM Allen, BW Allport, PP Aloisio, A Alonso, A Alonso, F Alpigiani, C Alstaty, M Gonzalez, BA Piqueras, DA Alviggi, MG Amadio, BT Amako, K Coutinho, YA Amelung, C Amidei, D Dos Santos, SPA Amorim, A Amoroso, S Amundsen, G Anastopoulos, C Ancu, LS Andari, N Andeen, T Anders, CF Anders, G Anders, JK Anderson, KJ Andreazza, A Andrei, V Angelidakis, S Angelozzi, I Anger, P Angerami, A Anghinolfi, F Anisenkov, AV Anjos, N Annovi, A Antonelli, M Antonov, A Anulli, F Aoki, M Bella, LA Arabidze, G Arai, Y Araque, JP Arce, ATH Arduh, FA Arguin, JF Argyropoulos, S Arik, M Armbruster, AJ Armitage, LJ Arnaez, O Arnold, H Arratia, M Arslan, O Artamonov, A Artoni, G Artz, S Asai, S Asbah, N Ashkenazi, A Asman, B Asquith, L Assamagan, K Astalos, R Atkinson, M Atlay, NB Augsten, K Avolio, G Axen, B Ayoub, MK Azuelos, G Baak, MA Baas, AE Baca, MJ Bachacou, H Bachas, K Backes, M Backhaus, M Bagiacchi, P Bagnaia, P Bai, Y Baines, JT Baker, OK Baldin, EM Balek, P Balestri, T Balli, F Balunas, WK Banas, E Banerjee, S Bannoura, AAE Barak, L Barberio, EL Barberis, D Barbero, M Barillari, T Barklow, T Barlow, N Barnes, SL Barnett, BM Barnett, RM Barnovska, Z Baroncelli, A Barone, G Barr, AJ Navarro, LB Barreiro, F da Costa, JBG Bartoldus, R Barton, AE Bartos, P Basalaev, A 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Wilson, J. A. Wingerter-Seez, I. Winklmeier, F. Winston, O. J. Winter, B. T. Wittgen, M. Wittkowski, J. Wollstadt, S. J. Wolter, M. W. Wolters, H. Wosiek, B. K. Wotschack, J. Woudstra, M. J. Wozniak, K. W. Wu, M. Wu, M. Wu, S. L. Wu, X. Wu, Y. Wyatt, T. R. Wynne, B. M. Xella, S. Xu, D. Xu, L. Yabsley, B. Yacoob, S. Yakabe, R. Yamaguchi, D. Yamaguchi, Y. Yamamoto, A. Yamamoto, S. Yamanaka, T. Yamauchi, K. Yamazaki, Y. Yan, Z. Yange, H. Yang, H. Yang, Y. Yang, Z. Yao, W-M. Yap, Y. C. Yasu, Y. Yatsenko, E. Wong, K. H. Yau Ye, J. Ye, S. Yeletskikh, I. Yen, A. L. Yildirim, E. Yorita, K. Yoshida, R. Yoshihara, K. Young, C. Young, C. J. S. Youssef, S. Yu, D. R. Yu, J. Yu, J. M. Yu, J. Yuan, L. Yuen, S. P. Y. Yusuff, I. Zabinski, B. Zaidan, R. Zaitsev, A. M. Zakharchuk, N. Zalieckas, J. Zaman, A. Zambito, S. Zanello, L. Zanzi, D. Zeitnitz, C. Zeman, M. Zemla, A. Zeng, J. C. Zeng, Q. Zengel, K. Zenin, O. Zenis, T. Zerwas, D. Zhang, D. Zhang, F. Zhang, G. Zhang, H. Zhang, J. Zhang, L. Zhang, R. Zhang, R. Zhang, X. Zhang, Z. Zhao, X. Zhao, Y. Zhao, Z. Zhemchugov, A. Zhong, J. Zhou, B. Zhou, C. Zhou, L. Zhou, L. Zhou, M. Zhou, N. Zhu, C. G. Zhu, H. Zhu, J. Zhu, Y. Zhuang, X. Zhukov, K. Zibell, A. Zieminska, D. Zimine, N. I. Zimmermann, C. Zimmermann, S. Zinonos, Z. Zinser, M. Ziolkowski, M. Zivkovic, L. Zobernig, G. Zoccoli, A. zur Nedden, M. Zurzolo, G. Zwalinski, L. CA ATLAS Collaboration TI Measurement of the photon identification efficiencies with the ATLAS detector using LHC Run-1 data SO EUROPEAN PHYSICAL JOURNAL C LA English DT Article ID HADRON-COLLISIONS AB The algorithms used by the ATLAS Collaboration to reconstruct and identify prompt photons are described. Measurements of the photon identification efficiencies are reported, using 4.9 fb(-1) of pp collision data collected at the LHC at root s = 7 TeV and 20.3 fb-1 at root s = 8 TeV. The efficiencies are measured separately for converted and unconverted photons, in four different pseudorapidity regions, for transverse momenta between 10 GeV and 1.5 TeV. The results from the combination of three data-driven techniques are compared to the predictions from a simulation of the detector response, after correcting the electromagnetic shower momenta in the simulation for the average differences observed with respect to data. Data-to-simulation efficiency ratios used as correction factors in physics measurements are determined to account for the small residual efficiency differences. These factors are measured with uncertainties between 0.5% and 10% in 7 TeV data and between 0.5% and 5.6% in 8 TeV data, depending on the photon transverse momentum and pseudorapidity. C1 [Jackson, P.; Lee, L.; Petridis, A.; White, M. J.] Univ Adelaide, Dept Phys, Adelaide, SA, Australia. 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T.; Yan, Z.; Youssef, S.] Boston Univ, Dept Phys, 590 Commonwealth Ave, Boston, MA 02215 USA. [Amelung, C.; Amundsen, G.; Barone, G.; Bensinger, J. R.; Bianchini, L.; Blocker, C.; Coffey, L.; Dhaliwal, S.; Loew, K. M.; Sciolla, G.; Venturini, A.; Zengel, K.] Brandeis Univ, Dept Phys, Waltham, MA 02254 USA. [Amaral Coutinho, Y.; Caloba, L. P.; Maidantchik, C.; Marroquim, F.; Nepomucenoa, A. A.; Seixas, J. M.] Univ Fed Rio de Janeiro, COPPE EE IF, Rio De Janeiro, Brazil. [Cerqueira, A. S.; Manhaes de Andrade Filho, L.; Peralva, B. S.] Fed Univ Juiz Fora UFJF, Elect Circuits Dept, Juiz De Fora, Brazil. [do Vale, M. A. B.] Fed Univ Sao Joao Rei UFSJ, Sao Joao Del Rei, Brazil. [Donadelli, M.; La Rosa Navarro, J. L.; Leite, M. A. L.] Univ Sao Paulo, Inst Fis, Sao Paulo, Brazil. [Adams, D. L.; Aloisio, A.; Assamagan, K.; Begel, M.; Buttinger, W.; Chen, H.; Chernyatin, V.; Debbe, R.; Elmsheuser, J.; Ernst, M.; Gibbard, B.; Gordon, H. A.; Iakovidis, G.; Klimentov, A.; Kouskoura, V.; Kravchenko, A.; Lanni, F.; Lee, C. A.; Liu, H.; Lynn, D.; Ma, H.; Maeno, T.; Mountricha, E.; Nevski, P.; Nilsson, P.; Damazio, D. Oliveira; Paige, F.; Panitkin, S.; Perepelitsa, D. V.; Pleier, M. -A.; Polychronakos, V.; Protopopescu, S.; Purohit, M.; Radeka, V.; Rajagopalan, S.; Redlinger, G.; Snyder, S.; Steinberg, P.; Takai, H.; Tricoli, A.; Undrus, A.; Wenaus, T.; Xu, L.; Ye, S.] Brookhaven Natl Lab, Dept Phys, Upton, NY 11973 USA. Transilvania Univ Brasov, Brasov, Romania. [Alexa, C.; Caprini, I.; Caprini, M.; Chitan, A.; Ciubancan, M.; Constantinescu, S.; Dita, P.; Dita, S.; Dobre, M.; Ducu, O. A.; Jinaru, A.; Martoiu, V. S.; Maurer, J.; Olariub, A.; Pantea, D.; Rotaru, M.; Stoiceab, G.; Tudorache, A.; Tudorache, V.] Natl Inst Phys & Nucl Engn, Bucharest, Romania. [do Vale, M. A. B.] Natl Inst Res & Dev Isotop & Mol Technol, Dept Phys, Cluj Napoca, Romania. Univ Politehn Bucuresti, Bucharest, Romania. [Gravila, P. M.] West Univ Timisoara, Timisoara, Romania. [Bossio Sola, J. D.; Marceca, G.; Otero y Garzon, G.; Piegaia, R.; Reisin, H.; Sacerdoti, S.] Univ Buenos Aires, Dept Fis, Buenos Aires, DF, Argentina. [Arratia, M.; Barlow, N.; Batley, J. R.; Brochu, F. M.; Brunt, B. H.; Carter, J. R.; Chapman, J. D.; Cottin, G.; Gillam, T. P. S.; Hill, J. C.; Kaneti, S.; Lester, C. G.; Mueller, T.; Parker, M. A.; Potter, C. J.; Robinson, D.; Rosten, J. H. N.; Thomson, M.; Ward, C. P.; Yusuff, I.] Univ Cambridge, Cavendish Lab, Cambridge, England. [Bellerive, A.; Cree, G.; Di Valentino, D.; Gillberg, D.; Koffas, T.; Lacey, J.; Leight, W. A.; Nomidis, I.; Oakham, F. G.; Pasztor, G.; Ruiz-Martinez, A.; Ueno, R.; Vincter, M. G.] Carleton Univ, Dept Phys, Ottawa, ON, Canada. [Aleksa, M.; Gonzalez, B. Alvarez; Amoroso, S.; Anders, G.; Anghinolfi, F.; Arnaez, O.; Avolio, G.; Baak, M. A.; Backes, M.; Backhaus, M.; Barak, L.; Beermann, T. A.; Beltramello, O.; Bianco, M.; Bogaerts, J. A.; Boveia, A.; Boyd, J.; Burckhart, H.; Camarda, S.; Campana, S.; Garrido, M. D. M. Capeans; Carli, T.; Carrillo-Montoya, G. D.; Catinaccio, A.; Cattai, A.; Cerv, M.; Chromek-Burckhart, D.; Colombo, T.; Conti, G.; Dell'Acqua, A.; Deviveiros, P. O.; Di Girolamo, A.; Di Girolamo, B.; Di Nardo, R.; Dittus, F.; Dobos, D.; Dudarev, A.; Duhrssen, M.; Eifert, T.; Ellis, N.; Elsing, M.; Faltova, J.; Farthouat, P.; Fassnacht, P.; Feng, E. J.; Francis, D.; Fressard-Batraneanu, S. M.; Froidevaux, D.; Gadatsch, S.; Goossens, L.; Gorini, B.; Gray, H. M.; Gumpert, C.; Hawkings, R. J.; Helsens, C.; Correia, A. M. Henriques; Hervas, L.; Hoecker, A.; Huhtinen, M.; Iengo, P.; Jakobsen, S.; Jenni, P.; Klioutchnikova, T.; Krasznahorkay, A.; Lapoire, C.; Lassnig, M.; Miotto, G. Lehmann; Lenzi, B.; Lichard, P.; Malyukov, S.; Mandelli, B.; Manousos, A.; Mapelli, L.; Marzin, A.; Berlingen, J. Montejo; Mornacchi, G.; Nairz, A. M.; Nakahama, Y.; Nessi, M.; Nordberg, M.; Oide, H.; Palestini, S.; Pauly, T.; Pernegger, H.; Petersen, B. A.; Pommes, K.; Poppleton, A.; Poulard, G.; Poveda, J.; Astigarraga, M. E. Pozo; Rammensee, M.; Raymond, M.; Rembser, C.; Ritsch, E.; Roe, S.; Ruthmann, N.; Salzburger, A.; Schaefer, D.; Schlenker, S.; Schmieden, K.; Sforza, F.; Sanchez, C. A. Solans; Spigo, G.; Starz, S.; Stelzer, H. J.; Teischinger, F. A.; Ten Kate, H.; Unal, G.; van Woerden, M. C.; Vandelli, W.; Voss, R.; Vuillermet, R.; Wells, P. S.; Wengler, T.; Wenig, S.; Werner, P.; Wilkens, H. G.; Wotschack, J.; Young, C. J. S.; Zwalinski, L.; ATLAS Collaboration] CERN, CH-1211 Geneva 23, Switzerland. [Alison, J.; Anderson, K. J.; Bryant, P.; Toro, R. Camacho; Cheng, Y.; Dandoy, J. R.; Facini, G.; Gardner, R. W.; Kapliy, A.; Kim, Y. K.; Krizka, K.; Li, H. L.; Merritt, F. S.; Miller, D. W.; Okumura, Y.; Oreglia, M. J.; Pilcher, J. E.; Saxon, J.; Shochet, M. J.; Stark, G. H.; Swiatlowski, M.; Vukotic, I.; Wu, M.] Univ Chicago, Enrico Fermi Inst, 5640 S Ellis Ave, Chicago, IL 60637 USA. [Blunier, S.; Diaz, M. A.; Ochoa-Ricouxa, J. P.] Pontificia Univ Catolic Chile, Dept Fis, Santiago, Chile. [Brooks, W. K.; Carquin, E.; Kuleshov, S.; Pezoa, R.; Prokoshin, F.; Salazar Loyola, J. E.; Tapia Araya, S.; White, R.] Univ Tecn Federico Santa Maria, Dept Fis, Valparaiso, Chile. [Bai, Y.; da Costa, J. Barreiro Guimaraes; Cheng, H. J.; Fang, Y.; Jin, S.; Li, Q.; Liang, Z.; Merino, J. Llorente; Lou, X.; Mansour, J. D.; Ouyang, Q.; Peng, C.; Ren, H.; Shan, L. Y.; Sun, X.; Xu, D.; Zhu, H.; Zhuang, X.] Chinese Acad Sci, Inst High Energy Phys, Beijing, Peoples R China. [Gao, J.; Geng, C.; Guo, Y.; Han, L.; Hu, Q.; Jiang, Y.; Li, B.; Liu, J. B.; Liu, M.; Liu, Y. L.; Liu, Y.; Peng, H.; Song, H. Y.; Wangb, W.; Zaidan, R.; Zhang, G.; Zhang, R.; Zhu, Y.] Univ Sci & Technol China, Dept Modern Phys, Hefei, Anhui, Peoples R China. [Chen, S.; Wang, C.; Zhang, H.] Nanjing Univ, Dept Phys, Nanjing, Jiangsu, Peoples R China. [Du, Y.; Feng, C.; Ma, L. L.; Ma, Y.; Wang, C.; Zhang, X.; Zhao, Y.; Zhao, Z.; Zhu, C. G.] Shandong Univ, Sch Phys, Jinan, Shandong, Peoples R China. [Bret, M. Cano; Guo, J.; Li, L.; Yange, H.] Shanghai Jiao Tong Univ, Shanghai Key Lab Particle Phys & Cosmol, Dept Phys & Astron, Shanghai, Peoples R China. [Chen, X.; Zhou, N.] Tsinghua Univ, Dept Phys, Beijing 100084, Peoples R China. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] Clermont Univ, Lab Phys Corpusculaire, Clermont Ferrand, France. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] Univ Clermont Ferrand, Clermont Ferrand, France. [Boumediene, D.; Busato, E.; Calvet, D.; Calvet, S.; Chomont, A. R.; Donini, J.; Gris, Ph.; Madar, R.; Saez, S. M. Romano; Santoni, C.; Simon, D.; Vazeille, F.] CNRS, IN2P3, Clermont Ferrand, France. [Alkire, S. P.; Angerami, A.; Brooijmans, G.; Carbone, R. M.; Clark, M. R.; Cole, B.; Hu, D.; Hughes, E. W.; Iordanidou, K.; Klein, M. H.; Mohapatra, S.; Ochoa, I.; Parsons, J. A.; Smith, M. N. K.; Smith, R. W.; Thompson, E. N.; Tuts, P. M.; Wang, T.; Zhou, L.] Columbia Univ, Nevis Lab, Irvington, NY USA. [Alonso, A.; Besjes, G. J.; Dam, M.; Galster, G.; Hansen, J. B.; Hansen, J. D.; Hansen, P. H.; Loevschall-Jensen, A. E.; Monk, J.; Mortensen, S. S.; Pedersen, L. E.; Petersen, T. C.; Pingel, A.; Wiglesworth, C.; Xella, S.] Univ Copenhagen, Niels Bohr Inst, Copenhagen, Denmark. [Cairo, V. M.; Capua, M.; Carminati, L.; Crosetti, G.; Del Gaudio, M.; La Rotonda, L.; Mastroberardino, A.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Tassi, E.] INFN, Lab Nazl Frascati, Grp Collegato Cosenza, Frascati, Italy. [Cairo, V. M.; Capua, M.; Crosetti, G.; Mastroberardino, A.; Policicchio, A.; Salvatore, D.; Scarfone, V.; Schioppa, M.; Susinno, G.; Tassi, E.] Univ Calabria, Dipartimento Fis, Arcavacata Di Rende, Italy. [Gach, G. P.; Kisielewskaa, D.; Mindur, B.; Zemla, A.] AGH Univ Sci & Technol, Fac Phys & Appl Comp Sci, Krakow, Poland. [Palka, M.; Richter-Was, E.] Jagiellonian Univ, Marian Smoluchowski Inst Phys, Krakow, Poland. [Banas, E.; de Renstrom, P. A. Bruckman; Burka, K.; Chwastowski, J. J.; Derendarz, D.; Godlewski, J.; Gornicki, E.; Hajduk, Z.; Iwanski, W.; Kaczmarska, A.; Knapik, J.; Korcyl, K.; Kowalewska, A. B.; Malecki, Pa.; Olszewski, A.; Olszowska, J.; Stanecka, E.; Staszewski, R.; Trzebinski, M.; Trzupek, A.; Wolter, M. W.; Wosiek, B. K.; Wozniak, K. W.; Zabinski, B.] Polish Acad Sci, Inst Nucl Phys, Krakow, Poland. [Cao, T.; Firan, A.; Hetherly, J. W.; Kama, S.; Kehoe, R.; Sekula, S. J.; Stroynowski, R.; Turvey, A. J.; Varol, T.; Wang, H.; Ye, J.; Zhao, X.; Zhou, L.] Southern Methodist Univ, Dept Phys, Dallas, TX 75275 USA. [Izen, J. M.; Leyton, M.; Meirose, B.; Namasivayam, H.; Reeves, K.] Univ Texas Dallas, Dept Phys, Richardson, TX 75083 USA. [Asbah, N.; Behr, J. K.; Bertsche, C.; Bessner, M.; Bloch, I.; Britzger, D.; Deterre, C.; Dutta, B.; Dyndal, M.; Eckardt, C.; Filipuzzi, M.; Flaschel, N.; Bravo, A. Gascon; Glazov, A.; Gregor, I. M.; Haleem, M.; Hamnett, P. G.; Hiller, K. H.; Howarth, J.; Huang, Y.; Belenguer, M. Jimenez; Katzy, J.; Keller, J. S.; Kondrashova, N.; Kuhl, T.; Lobodzinska, E.; Lohwasser, K.; Madsen, A.; Medinnis, M.; Moenig, K.; Garcia, R. F. Naranjo; Naumann, T.; O'Rourke, A. A.; Peschke, R.; Peters, K.; Pirumov, H.; Poley, A.; Robinson, J. E. M.; Schaefer, R.; Schmitt, S.; South, D.; Stanescu-Bellu, M.; Stanitzki, M. M.; Styles, N. A.; Tackmann, K.; Trofymov, A.; Wang, J.; Zakharchuk, N.] DESY, Hamburg, Zeuthen, Germany. [Burmeister, I.; Dette, K.; Erdmann, J.; Esch, H.; Goessling, C.; Homann, M.; Jentzsch, J.; Klingenberg, R.; Kroeninger, K.] Tech Univ Dortmund, Lehrstuhl Expt Phys 4, Dortmund, Germany. [Anger, P.; Duschinger, D.; Friedrich, F.; Grohs, J. P.; Gutschow, C.; Hauswald, L.; Kobel, M.; Mader, W. F.; Novgorodova, O.; Siegert, F.; Socher, F.; Straessner, A.; Vest, A.; Wahrmund, S.] Tech Univ Dresden, Inst Kern & Teilchenphys, Dresden, Germany. [Arce, A. T. H.; Benjamin, D. P.; Bjergaard, D. M.; Bocci, A.; Cerio, B. C.; Goshaw, A. T.; Kajomovitz, E.; Kotwal, A.; Kruse, M. C.; Li, L.; Li, S.; Liu, M.; Oh, S. H.; Zhou, C.] Duke Univ, Dept Phys, Durham, NC 27706 USA. [Bristow, T. M.; Clark, P. J.; Dias, F. A.; Edwards, N. C.; Gao, Y.; Walls, F. M. Garay; Glaysher, P. C. F.; Harrington, R. D.; Leonidopoulos, C.; Martin, V. J.; Mills, C.; Pino, S. A. Olivares; Proissl, M.; Washbrook, A.; Wynne, B. M.] Univ Edinburgh, Sch Phys & Astron, SUPA, Edinburgh, Midlothian, Scotland. [Antonelli, M.; Beretta, M.; Bilokon, H.; Chiarella, V.; Curatolo, M.; Esposito, B.; Gatti, C.; Laurelli, P.; Maccarrone, G.; Mancini, G.; Sansoni, A.; Testa, M.; Vilucchi, E.] INFN, Lab Nazl Frascati, Frascati, Italy. [Arnold, H.; Betancourt, C.; Boehler, M.; Bruneliere, R.; Buehrer, F.; Burgard, C. D.; Buescher, D.; Cardillo, F.; Coniavitis, E.; Consorti, V.; Dang, N. P.; Dao, V.; Di Simone, A.; Glatzer, J.; Gonella, G.; Herten, G.; Jakobs, K.; Javurek, T.; Jenni, P.; Kiss, F.; Koneke, K.; Kopp, A. K.; Kuehn, S.; Landgraf, U.; Luedtke, C.; Nagel, M.; Pagacova, M.; Parzefall, U.; Ronzani, M.; Rosbach, K.; Ruehr, F.; Rurikova, Z.; Sammel, D.; Schillo, C.; Schnoor, U.; Schumacher, M.; Sommer, P.; Sundermann, J. E.; Ta, D.; Temming, K. K.; Tsiskaridze, V.; Weiser, C.; Werner, M.; Zhang, L.; Zimmermann, S.] Albert Ludwigs Univ, Fak Mathemat & Phys, Freiburg, Germany. [Ancu, L. S.; De Mendizabal, J. Bilbao; Calace, N.; Chatterjee, A.; Clark, A.; Coccaro, A.; Delitzsch, C. M.; della Volpe, D.; Ferrere, D.; Gadomski, S.; Golling, T.; Gonzalez-Sevilla, S.; Gramling, J.; Guescini, F.; Iacobucci, G.; Katre, A.; Khoo, T. J.; Lionti, A. E.; March, L.; Mermod, P.; Miucci, A.; Nackenhorst, O.; Nessi, M.; Paolozzi, L.; Ristic, B.; Schramm, S.; Sfyrla, A.; Vallecorsa, S.; Wu, X.] Univ Geneva, Sect Phys, Geneva, Switzerland. [Barberis, D.; Darbo, G.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Gemme, C.; Guido, E.; Miglioranzi, S.; Morettini, P.; Osculati, B.; Parodi, F.; Passaggio, S.; Rossi, L. P.; Sannino, M.; Schiavi, C.] INFN, Sez Genova, Genoa, Italy. [Barberis, D.; Favareto, A.; Parodi, A. Ferretto; Gagliardi, G.; Gaudiello, A.; Guido, E.; Miglioranzi, S.; Osculati, B.; Parodi, F.; Sannino, M.; Schiavi, C.] Univ Genoa, Dipartimento Fis, Genoa, Italy. [Jejelava, J.; Tskhadadze, E. G.] Iv Javakhishvili Tbilisi State Univ, E Andronikashvili Inst Phys, Tbilisi, Rep of Georgia. [Djobava, T.; Durglishvili, A.; Khubua, J.; Mosidze, M.] Tbilisi State Univ, Inst High Energy Phys, Tbilisi, Rep of Georgia. [Dueren, M.; Heinz, C.; Kreutzfeldt, K.; Stenzel, H.] Justus Liebig Univ Giessen, Phys Inst 2, Giessen, Germany. [Bates, R. L.; Boutle, S. K.; Madden, W. D. Breaden; Britton, D.; Buckley, A. G.; Bussey, P.; Buttar, C. M.; Buzatu, A.; Cinca, D.; Crawley, S. J.; D'Auria, S.; Doyle, A. T.; Ferrando, J.; Gul, U.; Knue, A.; Mullen, P.; O'Shea, V.; Owen, M.; Pollard, C. S.; Qin, G.; Quilty, D.; Ravenscroft, T.; Robson, A.; St Denis, R. D.; Stewart, G. A.; Thompson, A. S.] Univ Glasgow, Sch Phys & Astron, SUPA, Glasgow, Lanark, Scotland. [Agricola, J.; Bindi, M.; Blumenschein, U.; Brandt, G.; De Maria, A.; Drechsler, E.; Graber, L.; Grosse-Knetter, J.; Janus, M.; Kareem, M. J.; Kawamura, G.; Lai, S.; Lemmer, B.; Magradze, E.; Mantoani, M.; Mchedlidze, G.; Llacer, M. Moreno; Musheghyan, H.; Quadt, A.; Rieger, J.; Rosien, N. -A.; Rzehorz, G. F.; Shabalina, E.; Stolte, P.; Veatch, J.; Weingarten, J.; Zinonos, Z.] Georg August Univ, Phys Inst 2, Gottingen, Germany. [Albrand, S.; Berlendis, S.; Camincher, C.; Collot, J.; Crepe-Renaudin, S.; Delsart, P. A.; Gabaldon, C.; Genest, M. H.; Gradin, P. O. J.; Hostachy, J-Y.; Ledroit-Guillon, F.; Lleres, A.; Lucotte, A.; Malek, F.; Petit, E.; Stark, J.; Trocme, B.; Wu, M.] Univ Grenoble Alpes, Lab Phys Subatom & Cosmol, CNRS, IN2P3, Grenoble, France. [McFarlane, K. W.] Hampton Univ, Dept Phys, Hampton, VA 23668 USA. [Chan, S. K.; Clark, B. L.; Franklin, M.; Giromini, P.; Huth, J.; Ippolito, V.; Lazovich, T.; Mateos, D. Lopez; Morii, M.; Rogan, C. S.; Skottowe, H. P.; Sun, S.; Tolley, E.; Tong, B.; Tuna, A. N.; Yen, A. L.; Zambito, S.] Harvard Univ, Lab Particle Phys & Cosmol, Cambridge, MA 02138 USA. [Andrei, V.; Baas, A. E.; Brandt, O.; Djuvsland, J. I.; Dunford, M.; Geisler, M. P.; Hanke, P.; Jongmanns, J.; Kluge, E. -E.; Lang, V. S.; Meier, K.; Theenhausen, H. Meyer Zu; Villara, D. I. Narrias; Sahinsoy, M.; Scharf, V.; Schultz-Coulon, H. -C.; Stamen, R.; Starovoitov, P.; Sucheka, S.; Wessels, M.] Heidelberg Univ, Kirchhoff Inst Phys, Heidelberg, Germany. [Anders, C. F.; de Lima, D. E. Ferreira; Giulini, M.; Kolb, M.; Lisovyi, M.; Radescu, V.; Schaetzelb, S.] Heidelberg Univ, Phys Inst, Heidelberg, Germany. [Kretz, M.; Kugel, A.] Heidelberg Univ, ZITI Inst Tech Informat, Mannheim, Germany. [Nagasaka, Y.] Hiroshima Inst Technol, Fac Appl Informat Sci, Hiroshima, Japan. [Bortolotto, V.; Chan, Y. L.; Castillo, L. R. Flores; Lu, H.; Salvucci, A.; Tsui, K. M.] Chinese Univ Hong Kong, Dept Phys, Shatin, Hong Kong, Peoples R China. [Bortolotto, V.; Orlando, N.] Univ Hong Kong, Dept Phys, Hong Kong, Hong Kong, Peoples R China. [Bortolotto, V.; Prokofiev, K.] Hong Kong Univ Sci & Technol, Dept Phys, Kowloon, Hong Kong, Peoples R China. [Choi, K.; Dattagupta, A.; Evans, H.; Gagnon, P.; Kopeliansky, R.; Lammers, S.; Martinez, N. Lorenzo; Luehring, F.; Ogren, H.; Penwell, J.; Weinert, B.; Zieminska, D.] Indiana Univ, Dept Phys, Bloomington, IN 47405 USA. [Jansky, R.; Kneringer, E.; Lukas, W.; Milic, A.; Usanova, A.; Vigne, R.] Leopold Franzens Univ, Inst Astro & Teilchenphys, Innsbruck, Austria. [Abdallah, J.; Argyropoulos, S.; Benitez, J.; Mallik, U.] Univ Iowa, Iowa City, IA USA. [Chen, C.; Cochran, J.; De Lorenzi, F.; Jiang, H.; Krumnack, N.; Pluth, D.; Prell, S.; Werner, M. D.; Yu, J.] Iowa State Univ, Dept Phys & Astron, Ames, IA USA. [Ahmadov, F.; Aleksandrov, I. N.; Bednyakov, V. A.; Boyko, I. R.; Budagov, I. A.; Chelkov, G. A.; Cheplakov, A.; Chizhov, M. V.; Dedovich, D. V.; Demichev, M.; Gongadze, A.; Gostkin, M. I.; Huseynov, N.; Javadov, N.; Karpov, S. N.; Karpova, Z. M.; Khramov, E.; Kruchonak, U.; Kukhtin, V.; Ladygin, E.; Lyubushkin, V.; Minashvili, I. A.; Mineev, M.; Peshekhonov, V. D.; Plotnikova, E.; Potrap, I. N.; Pozdnyakov, V.; Rusakovich, N. A.; Sadykov, R.; Sapronov, A.; Shiyakova, M.; Soloshenko, A.; Vinogradov, V. B.; Yeletskikh, I.; Zhemchugov, A.; Zimine, N. I.] JINR Dubna, Joint Inst Nucl Res, Dubna, Russia. [Amako, K.; Aoki, M.; Arai, Y.; Hanagaki, K.; Ikegami, Y.; Ikeno, M.; Iwasaki, H.; Kanzaki, J.; Kondo, T.; Kono, T.; Makida, Y.; Nagai, R.; Nagano, K.; Nakamura, K.; Nozaki, M.; Odaka, S.; Okuyama, T.; Sasaki, O.; Suzuki, S.; Takubo, Y.; Tanaka, S.; Terada, S.; Tokushuku, K.; Tsuno, S.; Unno, Y.; Yamamoto, A.; Yasu, Y.] KEK, High Energy Accelerator Res Org, Tsukuba, Ibaraki, Japan. [Chen, Y.; Hasegawa, M.; Kido, S.; Kishimoto, T.; Kurashige, H.; Maeda, J.; Ochi, A.; Shimizu, S.; Yakabe, R.; Yamazaki, Y.; Yuan, L.] Kobe Univ, Grad Sch Sci, Kobe, Hyogo, Japan. [Ishino, M.; Kunigo, T.; Monden, R.; Sumida, T.; Tashiro, T.] Kyoto Univ, Fac Sci, Kyoto, Japan. [Takashima, R.] Kyoto Univ, Kyoto, Japan. [Kawagoe, K.; Oda, S.; Otono, H.; Tojo, J.] Kyushu Univ, Dept Phys, Fukuoka, Japan. [Alconada Verzini, M. J.; Alonso, F.; Arduh, F. A.; Dova, M. T.; Monticelli, F.; Wahlberg, H.] Natl Univ La Plata, Inst Fis La Plata, La Plata, Argentina. [Alconada Verzini, M. J.; Alonso, F.; Arduh, F. A.; Dova, M. T.; Monticelli, F.; Wahlberg, H.] Consejo Nacl Invest Cient & Tecn, La Plata, Argentina. [Barton, A. E.; Beattie, M. D.; Bertram, I. A.; Borissov, G.; Bouhova-Thacker, E. V.; Cheatham, S.; Dearnaley, W. J.; Fox, H.; Grimm, K.; Henderson, R. C. W.; Hughes, G.; Jones, R. W. L.; Kartvelishvili, V.; Long, R. E.; Love, P. A.; Muenstermann, D.; Parker, A. J.; Skinner, M. B.; Smizanska, M.; Walder, J.; Wharton, A. M.] Univ Lancaster, Dept Phys, Lancaster, England. [Aliev, M.; Bachas, K.; Chiodini, G.; Gorini, E.; Primavera, M.; Reale, M.; Spagnolo, S.; Ventura, A.] INFN, Sez Lecce, Lecce, Italy. [Aliev, M.; Bachas, K.; Gorini, E.; Longo, L.; Reale, M.; Spagnolo, S.; Ventura, A.] Univ Salento, Dipartimento Matemat & Fis, Lecce, Italy. [Affolder, A. A.; Anders, J. K.; Burdin, S.; D'Onofrio, M.; Dervan, P.; Gwilliam, C. B.; Hayward, H. S.; Jackson, M.; Jones, T. J.; King, B. T.; Klein, M.; Klein, U.; Kretzschmar, J.; Laycock, P.; Lehan, A.; Maxfield, S. J.; Mehta, A.; Readioff, N. P.; Vossebeld, J. H.] Univ Liverpool, Oliver Lodge Lab, Liverpool, Merseyside, England. [Cindro, V.; Deliyergiyev, M.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Jozef Stefan Inst, Dept Phys, Ljubljana, Slovenia. [Cindro, V.; Deliyergiyev, M.; Filipcic, A.; Gorisek, A.; Kanjir, L.; Kersevan, B. P.; Kramberger, G.; Macek, B.; Mandic, I.; Mikuz, M.; Muskinja, M.; Sfiligoj, T.; Sokhrannyi, G.] Univ Ljubljana, Ljubljana, Slovenia. [Armitage, L. J.; Bevan, A. J.; Bona, M.; Cerrito, L.; Hays, J. M.; Hickling, R.; Landon, M. P. J.; Lewis, D.; Lloyd, S. L.; Morris, J. D.; Nooney, T.; Piccaro, E.; Rizvi, E.; Sandbach, R. L.] Queen Mary Univ London, Sch Phys & Astron, London, England. [Berry, T.; Blanco, J. E.; Boisvert, V.; Brooks, T.; Connelly, I. A.; Cowan, G.; Duguid, L.; Giannelli, M. Faucci; George, S.; Gibson, S. M.; Kempster, J. J.; Vazquez, J. G. Panduro; Pastore, Fr.; Savage, G.; Sowden, B. C.; Spano, F.; Teixeira-Dias, P.; Thomas-Wilsker, J.] Royal Holloway Univ London, Dept Phys, Surrey, England. [Bell, A. S.; Butterworth, J. M.; Campanelli, M.; Christodoulou, V.; Cooper, B. D.; Davison, P.; Falla, R. J.; Freeborn, D.; Gregersen, K.; Ortiz, N. G. Gutierrez; Hesketh, G. G.; Jansen, E.; Jiggins, S.; Konstantinidis, N.; Korn, A.; Kucuk, H.; Leney, K. J. C.; Martyniuk, A. C.; McClymont, L. I.; Mcfayden, J. A.; Nurse, E.; Richter, S.; Scanlon, T.; Sherwood, P.; Simmons, B.; Wardrope, D. R.; Waugh, B. M.] UCL, Dept Phys & Astron, London, England. [Greenwood, Z. D.; Grossi, G. C.; Jana, D. K.; Sawyer, L.; Subramaniam, R.] Louisiana Tech Univ, Ruston, LA 71270 USA. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] UPMC, Lab Phys Nucl & Hautes Energies, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] Univ Paris Diderot, Paris, France. [Beau, T.; Bomben, M.; Calderini, G.; Crescioli, F.; De Cecco, S.; Demilly, A.; Derue, F.; Francavilla, P.; Krasny, M. W.; Lacour, D.; Laforge, B.; Laplace, S.; Le Dortz, O.; Lefebvre, G.; Solis, A. Lopez; Luzi, P. M.; Malaescu, B.; Marchiori, G.; Nikolic-Audit, I.; Ocariz, J.; Pandini, C. E.; Pires, S.; Ridel, M.; Roos, L.; Trincaz-Duvoid, S.; Varouchas, D.; Yap, Y. C.] CNRS, IN2P3, Paris, France. [Akesson, T. P. A.; Bocchetta, S. S.; Bryngemark, L.; Doglioni, C.; Floderus, A.; Hedberg, V.; Jarlskog, G.; Lytken, E.; Mjornmark, J. U.; Smirnova, O.; Viazlo, O.] Lund Univ, Fysiska Inst, Lund, Sweden. [Barreiro, F.; De la Torre, H.; Del Peso, J.; Glasman, C.; Terron, J.] Univ Autonoma Madrid, Dept Fis Teor C 15, Madrid, Spain. [Artz, S.; Becker, M.; Bertella, C.; Blum, W.; Buescher, V.; Caputo, R.; Caudron, J.; Cuth, J.; Endner, O. C.; Ertel, E.; Fiedler, F.; Torregrosa, E. Fullana; Geisen, M.; Groh, S.; Heck, T.; Huelsing, T. A.; Jakobi, K. B.; Kaluza, A.; Karnevskiy, M.; Kleinknecht, K.; Koepke, L.; Lin, T. H.; Masetti, L.; Mattmann, J.; Meyer, C.; Moritz, S.; Pleskot, V.; Rave, S.; Sander, H. G.; Schaeffer, J.; Schaefer, U.; Schmitt, C.; Schmitz, S.; Schott, M.; Schuh, N.; Simioni, E.; Simon, M.; Tapprogge, S.; Urrejola, P.; Webb, S.; Wollstadt, S. J.; Yildirim, E.; Zimmermann, C.; Zinser, M.] Johannes Gutenberg Univ Mainz, Inst Phys, Mainz, Germany. [Barnes, S. L.; Bielski, R.; Cox, B. E.; Da Via, C.; Dann, N. S.; Forcolin, G. T.; Forti, A.; Ponce, J. M. Iturbe; Li, X.; Loebinger, F. K.; Marsden, S. P.; Masik, J.; Sanchez, F. J. Munoz; Neep, T. J.; Oh, A.; Ospanov, R.; Pater, J. R.; Peters, R. F. Y.; Pilkington, A. D.; Pin, A. W. J.; Price, D.; Qin, Y.; Queitsch-Maitland, M.; Schweiger, H.; Shaw, S. M.; Tomlinson, L.; Watts, S.; Wilk, F.; Woudstra, M. J.; Wyatt, T. R.] Univ Manchester, Sch Phys & Astron, Manchester, Lancs, England. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Diglio, S.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Gao, J.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.; Zhang, R.] Aix Marseille Univ, CPPM, Marseille, France. [Aad, G.; Alstaty, M.; Barbero, M.; Calandri, A.; Calvet, T. P.; Coadou, Y.; Diaconu, C.; Diglio, S.; Djama, F.; Ellajosyula, V.; Feligioni, L.; Gao, J.; Hadef, A.; Hallewell, G. D.; Hubaut, F.; Kahn, S. J.; Knoops, E. B. F. G.; Le Guirriec, E.; Liu, J.; Liu, K.; Madaffari, D.; Monnier, E.; Muanza, S.; Nagy, E.; Pralavorio, P.; Rodina, Y.; Rozanov, A.; Talby, M.; Theveneaux-Pelzer, T.; Torres, R. E. Ticse; Tisserant, S.; Toth, J.; Touchard, F.; Vacavant, L.; Wang, C.; Zhang, R.] CNRS, IN2P3, Marseille, France. [Bellomo, M.; Bernard, N. R.; Brau, B.; Dallapiccola, C.; Daya-Ishmukhametova, R. K.; Moyse, E. J. W.; Pais, P.; Pettersson, N. E.; Picazio, A.; Willocq, S.] Univ Massachusetts, Dept Phys, Amherst, MA 01003 USA. [Belanger-Champagne, C.; Chuinard, A. J.; Corriveau, F.; Keyes, R. A.; Mantifel, R.; Prince, S.; Robertson, S. H.; Robichaud-Veronneau, A.; Stockton, M. C.; Stoebe, M.; Vachon, B.; Schroeder, T. Vazquez; Wang, K.; Warburton, A.] McGill Univ, Dept Phys, Montreal, PQ, Canada. [Barberio, E. L.; Brennan, A. J.; Dawe, E.; Jennens, D.; Kubota, T.; Le, B.; McDonald, E. F.; Milesi, M.; Nuti, F.; Rados, P.; Scutti, F.; Spiller, L. A.; Tan, K. G.; Taylor, G. N.; Taylor, P. T. E.; Ungaro, F. C.; Urquijo, P.; Volpi, M.; Zanzi, D.] Univ Melbourne, Sch Phys, Melbourne, Vic, Australia. [Amidei, D.; Chelstowska, M. A.; Cheng, H. C.; Dai, T.; Diehl, E. B.; Edgar, R. C.; Feng, H.; Ferretti, C.; Fleischmann, P.; Geng, C.; Goldfarb, S.; Guan, L.; Guo, Y.; Levin, D.; Li, B.; Liu, H.; Lu, N.; Marley, D. E.; Mc Kee, S. P.; McCarn, A.; Neal, H. A.; Qian, J.; Schwarz, T. A.; Searcy, J.; Sekhon, K.; Wu, Y.; Yu, J. M.; Zhang, D.; Zhou, B.; Zhu, J.] Univ Michigan, Dept Phys, Ann Arbor, MI 48109 USA. [Arabidze, G.; Brock, R.; Chegwidden, A.; Fisher, W. C.; Halladjian, G.; Hauser, R.; Hayden, D.; Huston, J.; Martin, B.; Mondragon, M. C.; Plucinski, P.; Pope, B. G.; Schoenrock, B. D.; Schwienhorst, R.; Willis, C.] Michigan State Univ, Dept Phys & Astron, E Lansing, MI 48824 USA. [Alimonti, G.; Andreazza, A.; Camplani, A.; Cavalli, D.; Citterio, M.; Costa, G.; Fanti, M.; Giugni, D.; Lari, T.; Lazzaroni, M.; Mandelli, L.; Manzoni, S.; Mazza, S. M.; Meroni, C.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Resconi, S.; Shojaii, S.; Stabile, A.; Tartarelli, G. F.; Troncona, C.; Turra, R.; Perez, M. Villaplana] INFN, Sez Milano, Milan, Italy. [Andreazza, A.; Camplani, A.; Carminati, L.; Fanti, M.; Lazzaroni, M.; Manzoni, S.; Mazza, S. M.; Monzani, S.; Perini, L.; Ragusa, F.; Ratti, M. G.; Shojaii, S.; Turra, R.; Perez, M. Villaplana] Univ Milan, Dipartimento Fis, Milan, Italy. [Harkusha, S.; Kulchitsky, Y.; Kurochkin, Y. A.; Tsiareshka, P. V.] Natl Acad Sci Belarus, BI Stepanov Inst Phys, Minsk, Byelarus. [Hrynevich, A.] Natl Sci & Educ Ctr Particle & High Energy Phys, Minsk, Byelarus. [Arguin, J-F.; Azuelos, G.; Dallaire, F.; Ducu, O. A.; Gagnon, L. G.; Gauthier, L.; Leroy, C.; Mochizuki, K.; Manh, T. Nguyen; Rezvani, R.; Saadi, D. Shoaleh] Univ Montreal, Grp Particle Phys, Montreal, PQ, Canada. [Akimov, A. V.; Gavrilenko, I. L.; Komar, A. A.; Mashinistov, R.; Mouraviev, S. V.; Nechaeva, P. Yu.; Shmeleva, A.; Snesarev, A. A.; Sulin, V. V.; Tikhomirov, V. O.; Zhukov, K.] PN Lebedev Phys Inst Russian, Acad Sci, Moscow, Russia. [Artamonov, A.; Gorbounov, P. A.; Khovanskiy, V.; Shatalov, P. B.; Tsukerman, I. I.] Inst Theoret & Expt Phys ITEP, Moscow, Russia. [Antonov, A.; Belotskiy, K.; Belyaev, N. L.; Bulekov, O.; Dolgoshein, B. A.; Kantserov, V. A.; Krasnopevtsev, D.; Romaniouk, A.; Shulga, E.; Smirnov, S. Yu.; Smirnov, Y.; Soldatov, E. Yu.; Tikhomirov, V. 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G.; Menke, S.; Mueller, F.; Nisius, R.; Nowak, S.; Oberlack, H.; Richter, R.; Salihagic, D.; Sandstroem, R.; Schacht, P.; Schmidt-Sommerfeld, K. R.; Schwegler, Ph.; Spettel, F.; Stonjek, S.; Terzo, S.; von der Schmitt, H.; Wildauer, A.] Werner Heisenberg Inst, Max Planck Inst Phys, Munich, Germany. [Fusayasu, T.; Shimojima, M.] Nagasaki Inst Appl Sci, Nagasaki, Japan. [Horii, Y.; Kawade, K.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Grad Sch Sci, Nagoya, Aichi, Japan. [Horii, Y.; Kawade, K.; Onogi, K.; Tomoto, M.; Wakabayashi, J.; Yamauchi, K.] Nagoya Univ, Kobayashi Maskawa Inst, Nagoya, Aichi, Japan. [Aloisio, A.; Alviggi, M. G.; Canale, V.; Carlino, G.; Cirotto, F.; Conventi, F.; de Asmundis, R.; Della Pietra, M.; Doria, A.; Izzo, V.; Merola, L.; Perrella, S.; Rossi, E.; Sanchez, A.; Sekhniaidze, G.; Zurzolo, G.] INFN, Sez Napoli, Naples, Italy. [Aloisio, A.; Alviggi, M. G.; Canale, V.; Cirotto, F.; Merola, L.; Perrella, S.; Rossi, E.; Sanchez, A.; Zurzolo, G.] Univ Napoli, Dipartimento Fis, Naples, Italy. [Gorelov, I.; Mc Fadden, N. C.; Seidel, S. C.; Taylor, A. C.; Toms, K.] Univ New Mexico, Dept Phys & Astron, Albuquerque, NM 87131 USA. [Caron, S.; Colasurdo, L.; Croft, V.; De Groot, N.; Filthaut, F.; Galea, C.; Igonkina, O.; Konig, A. C.; Nektarijevic, S.; Strubig, A.] Radboud Univ Nijmegen Nikhef, Inst Math Astrophys & Particle Phys, Nijmegen, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Deluca, C.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valentinetti, S.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der Geer, R.; van der Graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.] Nikhef Natl Inst Subat Phys, Amsterdam, Netherlands. [Aben, R.; Angelozzi, I.; Bedognetti, M.; Beemster, L. J.; Bentvelsen, S.; Berge, D.; Bobbink, G. J.; Bos, K.; Brenner, L.; Bruni, L. S.; Butti, P.; Castelijn, R.; Castelli, A.; Colijn, A. P.; de Jong, P.; Deigaard, I.; Deluca, C.; Duda, D.; Ferrari, P.; Hartjes, F.; Hessey, N. P.; Igonkina, O.; Kluit, P.; Koffeman, E.; Mahlstedt, J.; Meyer, J.; Oussoren, K. P.; Sabato, G.; Salek, D.; Slawinska, M.; Valentinetti, S.; Van den Wollenberg, W.; Van der Deijl, P. C.; van der Geer, R.; van der Graaf, H.; van Vulpen, I.; Vankov, P.; Verkerke, W.; Vermeulen, J. C.; Vreeswijk, M.; Weits, H.; Williams, S.] Univ Amsterdam, Amsterdam, Netherlands. [Adelman, J.; Andari, N.; Burghgrave, B.; Chakraborty, D.; Saha, P.] Northern Illinois Univ, Dept Phys, De Kalb, IL USA. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Bogdanchikov, A. G.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] RAS, SB, Budker Inst Nucl Phys, Novosibirsk, Russia. [Becot, C.; Bernius, C.; Cranmer, K.; Haas, A.; Heinrich, L.; Kaplan, B.; Karthik, K.; Konoplich, R.; Mincer, A. I.; Nemethy, P.; Neves, R. M.] NYU, Dept Phys, 4 Washington Pl, New York, NY 10003 USA. [Beacham, J. B.; Che, S.; Gan, K. K.; Ishmukhametov, R.; Kagan, H.; Kass, R. D.; Shrestha, S.; Tannenwald, B. B.] Ohio State Univ, Columbus, OH 43210 USA. [Nakano, I.] Okayama Univ, Fac Sci, Okayama, Japan. [Abbott, B.; Alhroob, M.; Bertsche, D.; De Benedetti, A.; Gutierrez, P.; Hasib, A.; Norberg, S.; Pearson, B.; Rifki, O.; Severini, H.; Skubic, P.; Strauss, M.] Univ Oklahoma, Homer L Dodge Dept Phys & Astron, Norman, OK 73019 USA. [Cantero, J.; Haley, J.; Jamin, D. O.; Khanov, A.; Rizatdinova, F.; Sidorov, D.] Oklahoma State Univ, Dept Phys, Stillwater, OK 74078 USA. [Chytka, L.; Hamal, P.; Hrabovsky, M.; Kvita, J.; Nozka, L.] Palacky Univ, RCPTM, Olomouc, Czech Republic. [Abreu, R.; Allen, B. W.; Brost, E.; Hopkins, W. H.; Majewski, S.; Potter, C. T.; Radloff, P.; Sinev, N. B.; Strom, D. M.; Torrence, E.; Wanotayaroj, C.; Whalen, K.; Winklmeier, F.] Univ Oregon, Ctr High Energy Phys, Eugene, OR 97403 USA. [Abeloos, B.; Ayoub, M. K.; Bassalat, A.; Binet, S.; Bourdarios, C.; De Regie, J. B. De Vivie; Delgove, D.; Duflot, L.; Escalier, M.; Fayard, L.; Fournier, D.; Gkougkousis, E. L.; Goudet, C. R.; Grivaz, J. -F.; Hariri, F.; Henrot-Versille, S.; Hrivnac, J.; Iconomidou-Fayard, L.; Kado, M.; Lounis, A.; Maiani, C.; Makovec, N.; Morange, N.; Nellist, C.; Petroff, P.; Poggioli, L.; Puzo, P.; Rousseau, D.; Rybkin, G.; Schaffer, A. C.; Serin, L.; Simion, S.; Tanaka, R.; Zerwas, D.; Zhang, Z.] Univ Paris Saclay, Univ Paris Sud, LAL, CNRS IN2P3, Orsay, France. [Endo, M.; Hanagaki, K.; Nomachi, M.; Sugaya, Y.; Teoh, J. J.; Yamaguchi, Y.] Osaka Univ, Grad Sch Sci, Osaka, Japan. [Bugge, M. K.; Cameron, D.; Catmore, J. R.; Feigl, S.; Franconi, L.; Garonne, V.; Gjelsten, B. K.; Gramstad, E.; Morisbak, V.; Nilsen, J. K.; Ould-Saada, F.; Pajchel, K.; Pedersen, M.; Raddum, S.; Read, A. L.; Rohne, O.; Sandaker, H.; Serfon, C.; Stapnes, S.; Strandlie, A.] Univ Oslo, Dept Phys, Oslo, Norway. [Artoni, G.; Barr, A. J.; Becker, K.; Beresford, L.; Bortoletto, D.; Cooper-Sarkar, A. M.; Ortuzar, M. Crispin; Fawcett, W. J.; Frost, J. A.; Gallas, E. J.; Giuli, F.; Gupta, S.; Gwenlan, C.; Hays, C. P.; Henderson, J.; Huffman, T. B.; Issever, C.; Kalderon, C. W.; Nagai, K.; Nickerson, R. B.; Norjoharuddeen, N.; Petrov, M.; Pickering, M. A.; Tseng, J. C-L.; Viehhauser, G. H. A.; Vigani, L.; Weidberg, A. R.; Zhong, J.] Univ Oxford, Dept Phys, Oxford, England. [Dondero, P.; Ferrari, R.; Fraternali, M.; Gaudio, G.; Introzzi, G.; Lanza, A.; Livan, M.; Negria, A.; Polesello, G.; Rebuzzi, D. M.; Rimoldi, A.; Vercesi, V.] INFN, Sez Pavia, Pavia, Italy. [Dondero, P.; Fraternali, M.; Introzzi, G.; Livan, M.; Negria, A.; Rebuzzi, D. M.; Rimoldi, A.] Univ Pavia, Dipartimento Fis, Pavia, Italy. [Balunas, W. K.; Brendlinger, K.; Di Clemente, W. K.; Fletcher, R. R. M.; Haney, B.; Heim, S.; Hines, E.; Jackson, B.; Kroll, J.; Lipeles, E.; Machado Miguens, J.; Meyer, C.; Mistry, K. P.; Reichert, J.; Thomson, E.; Vanguri, R.; Williams, H. H.; Yoshihara, K.] Univ Penn, Dept Phys, Philadelphia, PA 19104 USA. [Basalaev, A.; Ezhilov, A.; Fedin, O. L.; Gratchev, V.; Levchenko, M.; Maleev, V. P.; Naryshkin, I.; Ryabov, Y. F.; Schegelsky, V. A.; Seliverstov, D. M.; Solovyev, V.] BP Konstantinov Petersburg Nucl Phys Inst, Kurchatov Inst, Natl Res Ctr, St Petersburg, Russia. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] INFN, Sez Pisa, Pisa, Italy. [Annovi, A.; Bertolucci, F.; Biesuz, N. V.; Cavasinni, V.; Chiarelli, G.; Del Prete, T.; Dell'Orso, M.; Donati, S.; Giannetti, P.; Leone, S.; Roda, C.; Scuri, F.; Sotiropoulou, C. L.; Spalla, M.; Volpi, G.] Univ Pisa, Dipartimento Fis E Fermi, Pisa, Italy. [Bianchi, R. M.; Boudreau, J.; Escobar, C.; Farina, C.; Hong, T. M.; Mueller, J.; Sapp, K.; Su, J.] Univ Pittsburgh, Dept Phys & Astron, Pittsburgh, PA 15260 USA. [Aguilar-Saavedra, J. A.; Amor Dos Santos, S. P.; Amorim, A.; Araque, J. P.; Cantrill, R.; Carvalho, J.; Castro, N. F.; Conde Muino, P.; Da Cunha Sargedas De Sousa, M. J.; Fiolhais, M. C. N.; Galhardo, B.; Gomes, A.; Goncalo, R.; Jorge, P. M.; Lopes, L.; Maio, A.; Maneira, J.; Oleiro Seabraa, L. F.; Onofrea, A.; Pedro, R.; Santos, H.; Saraiva, J. G.; Silva, J.; Tavares Delgado, A.; Veloso, F.; Wolters, H.] LIP, Lab Instrumentacao & Fis Expt Particulas, Lisbon, Portugal. [Amorim, A.; Carvalho, J.; Conde Muino, P.; Da Cunha Sargedas De Sousa, M. J.; Gomes, A.; Jorge, P. M.; Machado Miguens, J.; Maio, A.; Maneira, J.; Palma, A.; Pedro, R.; Silva, J.; Tavares Delgado, A.] Univ Lisbon, Fac Ciencias, Lisbon, Portugal. [Amor Dos Santos, S. P.; Fiolhais, M. C. N.; Galhardo, B.; Veloso, F.; Wolters, H.] Univ Coimbra, Dept Phys, Coimbra, Portugal. [Gomes, A.; Maio, A.; Saraiva, J. G.] Univ Lisbon, Ctr Fis Nucl, Lisbon, Portugal. [Onofrea, A.] Univ Minho, Dept Fis, Braga, Portugal. [Aguilar-Saavedra, J. A.] Univ Granada, Dept Fis Teor & Cosmos, Granada, Spain. [Aguilar-Saavedra, J. A.] Univ Granada, CAFPE, Granada, Spain. Univ Nova Lisboa, Dep Fis, Caparica, Portugal. Univ Nova Lisboa, CEFITEC Fac Ciencias & Tecnol, Caparica, Portugal. [Chudoba, J.; Havranek, M.; Hejbal, J.; Jakoubek, T.; Kepka, O.; Kupco, A.; Kus, V.; Lokajicek, M.; Lysak, R.; Marcisovsky, M.; Mikestikova, M.; Nemecek, S.; Penc, O.; Sicho, P.; Staroba, P.; Svatos, M.; Tasevsky, M.; Vrba, V.] Acad Sci Czech Republic, Inst Phys, Prague, Czech Republic. [Augsten, K.; Caforio, D.; Gallus, P.; Guenther, J.; Hubacek, Z.; Myska, M.; Pospisil, S.; Seifert, F.; Simak, V.; Slavicek, T.; Smolek, K.; Solar, M.; Sopczak, A.; Sopko, V.; Suk, M.; Turecek, D.; Vacek, V.; Vlasak, M.; Vokac, P.; Vykydal, Z.; Zeman, M.] Czech Tech Univ, Prague, Czech Republic. [Balek, P.; Berta, P.; Carli, I.; Davidek, T.; Dolejsi, J.; Dolezal, Z.; Kodys, P.; Kosek, T.; Leitner, R.; Reznicek, P.; Scheirich, D.; Slovak, R.; Spousta, M.; Sykora, T.; Tas, P.; Todorova-Nova, S.; Valkar, S.; Vorobel, V.] Charles Univ Prague, Fac Math & Phys, Prague, Czech Republic. [Borisov, A.; Cheremushkina, E.; Denisov, S. P.; Fakhrutdinov, R. M.; Fenyuk, A. B.; Golubkov, D.; Kamenshchikov, A.; Karyukhin, A. N.; Kozhin, A. S.; Minaenko, A. A.; Myagkov, A. G.; Nikolaenko, V.; Ryzhov, A.; Solodkov, A. A.; Solovyanov, O. V.; Starchenko, E. A.; Vaniachine, A.; Zaitsev, A. M.; Zenin, O.] NRC, State Res Ctr Inst High Energy Phys, KI, Protvino, Russia. [Adye, T.; Baines, J. T.; Barnett, B. M.; Burke, S.; Dewhurst, A.; Dopke, J.; Emeliyanov, D.; Gallop, B. J.; Gee, C. N. P.; Haywood, S. J.; Kirk, J.; Martin-Haugh, S.; McMahon, S. J.; Middleton, R. P.; Murray, W. J.; Phillips, P. W.; Sankey, D. P. C.; Sawyer, C.; Tyndel, M.; Wickens, F. J.; Wielers, M.] Rutherford Appleton Lab, Particle Phys Dept, Didcot, Oxon, England. [Anulli, F.; Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; De Pedis, D.; De Salvo, A.; Di Donato, C.; Falciano, S.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Luminari, L.; Messina, A.; Nisatia, A.; Pasqualucci, E.; Petrolo, E.; Pontecorvo, L.; Rescigno, M.; Rosati, S.; Tehrani, F. Safai; Vanadia, M.; Vari, R.; Veneziano, S.; Verducci, M.; Zanello, L.] INFN, Sez Roma, Rome, Italy. [Bagiacchi, P.; Bagnaia, P.; Bauce, M.; Bini, C.; Ciapetti, G.; Corradi, M.; Di Donato, C.; Gentile, S.; Giagu, S.; Gustavino, G.; Kuna, M.; Lacava, F.; Luci, C.; Messina, A.; Vanadia, M.; Verducci, M.; Zanello, L.] Sapienza Univ Roma, Dipartimento Fis, Rome, Italy. [Aielli, G.; Camarri, P.; Cardarelli, R.; Di Ciaccio, A.; Iuppa, R.; Liberti, B.; Salamon, A.; Santonico, R.] INFN, Sez Roma Tor Vergata, Rome, Italy. [Aielli, G.; Camarri, P.; Di Ciaccio, A.; Iuppa, R.; Salamon, A.; Santonico, R.] Univ Roma Tor Vergata, Dipartimento Fis, Rome, Italy. [Baroncelli, A.; Biglietti, M.; Ceradini, F.; Di Micco, B.; Farilla, A.; Graziani, E.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Stanescu, C.; Taccini, C.] INFN, Sez Roma Tre, Rome, Italy. [Ceradini, F.; Di Micco, B.; Orestano, D.; Petrucci, F.; Puddu, D.; Salamanna, G.; Sessa, M.; Taccini, C.] Univ Roma Tre, Dipartimento Matemat & Fis, Rome, Italy. [Benchekroun, D.; Chafaq, A.; Hoummada, A.] Univ Hassan 2, Reseau Univ Phys Hautes Energies, Fac Sci Ain Chock, Casablanca, Morocco. [Ghazlane, H.] Ctr Natl Energie Sci Techn Nucl, Rabat, Morocco. [El Kacimi, M.; Goujdami, D.] Univ Cadi Ayyad, LPHEA Marrakech, Fac Sci Semlalia, Marrakech, Morocco. [Derkaoui, J. E.; Ouchrif, M.; Tayalatid, Y.] Univ Mohamed Premier, Fac Sci, Oujda, Morocco. [Derkaoui, J. E.; Ouchrif, M.; Tayalatid, Y.] LPTPM, Oujda, Morocco. [Cherkaoui El Moursli, R.; Fassi, F.; Haddad, N.; Idrissi, Z.] Univ Mohammed 5, Fac Sci, Rabat, Morocco. [Bachacou, H.; Balli, F.; Bauer, F.; Besson, N.; Blanchard, J. -B.; Boonekamp, M.; Chevalier, L.; Hoffmann, M. Dano; Deliot, F.; Denysiuk, D.; Etienvre, A. I.; Formica, A.; Giraud, P. F.; Da Costa, J. Goncalves Pinto Firmino; Guyot, C.; Hanna, R.; Hassani, S.; Jeanneau, F.; Kivernyk, O.; Kozanecki, W.; Kukla, R.; Lancon, E.; Laporte, J. F.; Le Quilleuc, E. P.; Lesage, A. A. J.; Mansoulie, B.; Meyer, J-P.; Nicolaidou, R.; Ouraou, A.; Rodriguez, L. Pacheco; Perego, M. M.; Peyaud, A.; Royon, C. R.; Saimpert, M.; Schoeffel, L.; Schune, Ph.; Schwemling, Ph.; Schwindling, J.] CEA Saclay Commissariat Energie Atom & Energies A, DSM IRFU Inst Reche Lois Fondament Univer, Gif Sur Yvette, France. [AbouZeid, O. S.; Battaglia, M.; Debenedetti, C.; Grillo, A. A.; Hance, M.; Kuhl, A.; Law, A. T.; Litke, A. M.; Lockman, W. S.; Nielsen, J.; Reece, R.; Rose, P.; Sadrozinski, H. F-W.; Schier, S.; Schumm, B. A.; Seiden, A.] Univ Calif Santa Cruz, Santa Cruz Inst Particle Phys, Santa Cruz, CA 95064 USA. [Alpigiani, C.; Blackburn, D.; Goussiou, A. G.; Hsu, S-C.; Johnson, W. J.; Lubatti, H. J.; Marx, M.; Meehan, S.; Rompotis, N.; Rosten, R.; Rothberg, J.; Russell, H. L.; De Bruin, P. H. Sales; Pastor, E. Torro; Watts, G.; Whallon, N. L.] Univ Washington, Dept Phys, Seattle, WA 98195 USA. [Anastopoulos, C.; Donszelmann, T. Cuhadar; Dawson, I.; Fletcher, G. T.; Hamity, G. N.; Hodgkinson, M. C.; Hodgson, P.; Johansson, P.; Klinger, J. A.; Korolkova, E. V.; Kyriazopoulos, D.; Paredes, B. Lopez; Macdonald, C. M.; Miyagawa, P. S.; Parker, K. A.; Tovey, D. R.; Vickey, T.; Boeriu, O. E. Vickey] Univ Sheffield, Dept Phys & Astron, Sheffield, S Yorkshire, England. [Hasegawa, Y.; Takeshita, T.] Shinshu Univ, Dept Phys, Nagano, Japan. [Atlay, N. B.; Buchholz, P.; Campoverde, A.; Czirr, H.; Fleck, I.; Gaur, B.; Ghasemi, S.; Ibragimov, I.; Li, Y.; Rosenthal, O.; Walkowiak, W.; Ziolkowski, M.] Univ Siegen, Fachbereich Phys, Siegen, Germany. [Buat, Q.; Horton, A. J.; Mori, D.; O'Neil, D. C.; Pachal, K.; Stelzer, B.; Temple, D.; Torres, H.; Van Nieuwkoop, J.; Vetterli, M. C.] Simon Fraser Univ, Dept Phys, Burnaby, BC, Canada. [Armbruster, A. J.; Barklow, T.; Bartoldus, R.; Bawa, H. S.; Black, J. E.; Gao, Y. S.; Garelli, N.; Grenier, P.; Ilic, N.; Kagan, M.; Kocian, M.; Koi, T.; Malone, C.; Moss, J.; Mount, R.; Nachman, B. P.; Nef, P. D.; Piacquadio, G.; Rubbo, F.; Salnikov, A.; Schwartzman, A.; Su, D.; Tompkins, L.; Wittgen, M.; Young, C.; Zeng, Q.] SLAC Natl Accelerator Lab, Stanford, CA USA. [Astalos, R.; Bartos, P.; Blazek, T.; Dado, T.; Melo, M.; Plazak, L.; Smiesko, J.; Sykora, I.; Tokar, S.; Zenis, T.] Comenius Univ, Fac Math Phys & Informat, Bratislava, Slovakia. [Bruncko, D.; Kladiva, E.; Strizenec, P.; Urban, J.] Slovak Acad Sci, Inst Expt Phys, Dept Subnucl Phys, Kosice, Slovakia. [Castaneda-Miranda, E.; Hamilton, A.; Yacoob, S.] Univ Cape Town, Dept Phys, Cape Town, South Africa. [Connell, S. H.; Govender, N.] Univ Johannesburg, Dept Phys, Johannesburg, South Africa. [Hsu, C.; Kar, D.; Garcia, B. R. Mellado; Ruan, X.] Univ Witwatersrand, Sch Phys, Johannesburg, South Africa. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Bohm, C.; Clement, C.; Cribbs, W. A.; Hellman, S.; Jon-And, K.; Klimek, P.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Silverstein, S. B.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Valencic, N.; Wallangen, V.] Stockholm Univ, Dept Phys, Stockholm, Sweden. [Abulaiti, Y.; Akerstedt, H.; Asman, B.; Bendtz, K.; Bertoli, G.; Bylund, O. Bessidskaia; Clement, C.; Cribbs, W. A.; Hellman, S.; Jon-And, K.; Klimek, P.; Lundberg, O.; Milstead, D. A.; Moa, T.; Molander, S.; Pani, P.; Poettgen, R.; Rossetti, V.; Shaikh, N. W.; Shcherbakova, A.; Sjolin, J.; Strandberg, S.; Ughetto, M.; Valencic, N.; Wallangen, V.] Oskar Klein Ctr, Stockholm, Sweden. [Lund-Jensen, B.; Sidebo, P. E.; Strandberg, J.] Royal Inst Technol, Dept Phys, Stockholm, Sweden. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; McCarthy, R. L.; Montalbano, A.; Morvaj, L.; Piacquadio, G.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA. [Abraham, N. L.; Allbrooke, B. M. M.; Asquith, L.; Cerri, A.; Barajas, C. A. Chavez; De Sanctis, U.; De Santo, A.; Grout, Z. J.; Lerner, G.; Miano, F.; Salvatore, F.; Castillo, I. Santoyo; Shehu, C. Y.; Suruliz, K.; Sutton, M. R.; Vivarelli, I.; Winston, O. J.] Univ Sussex, Dept Phys & Astron, Brighton, E Sussex, England. [Black, C. W.; Cuthbert, C.; Finelli, K. D.; Jeng, G. -Y.; Limosani, A.; Morley, A. K.; Saavedra, A. F.; Scarcella, M.; Varvell, K. E.; Wang, J.; Yabsley, B.] Univ Sydney, Sch Phys, Sydney, NSW, Australia. [Hou, S.; Hsu, P. J.; Lee, S. C.; Lin, S. C.; Liu, B.; Liu, D.; Lo Sterzo, F.; Mazini, R.; Shi, L.; Soh, D. A.; Song, H. Y.; Teng, P. K.; Wang, S. M.; Yang, Y.; Zhang, G.] Acad Sinica, Inst Phys, Taipei, Taiwan. [Abreu, H.; Gozani, E.; Rozen, Y.; Tarem, S.; van Eldik, N.] Technion Israel Inst Technol, Dept Phys, Haifa, Israel. [Abramowicz, H.; Alexander, G.; Ashkenazi, A.; Bella, G.; Benary, O.; Benhammou, Y.; Davies, M.; Duarte-Campderros, J.; Etzion, E.; Gershon, A.; Gueta, O.; Oren, Y.; Soffer, A.; Taiblum, N.] Tel Aviv Univ, Raymond & Beverly Sackler Sch Phys & Astron, Tel Aviv, Israel. [Gkaitatzis, S.; Gkialas, I.; Iliadis, D.; Kimura, N.; Kordas, K.; Kourkoumeli-Charalampidi, A.; Leisos, A.; Papageorgiou, K.; Petridou, C.; Sampsonidis, D.] Aristotle Univ Thessaloniki, Dept Phys, Thessaloniki, Greece. [Asai, S.; Chen, S.; Dohmae, T.; Enari, Y.; Hanawa, K.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kazama, S.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Saito, T.; Sakamoto, H.; Sasaki, Y.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Int Ctr Elementary Particle Phys, Tokyo, Japan. [Asai, S.; Chen, S.; Dohmae, T.; Enari, Y.; Hanawa, K.; Kanaya, N.; Kataoka, Y.; Kato, C.; Kawamoto, T.; Kazama, S.; Kobayashi, A.; Kobayashi, T.; Komori, Y.; Kozakai, C.; Mashimo, T.; Masubuchi, T.; Minami, Y.; Mori, T.; Morinaga, M.; Nakamura, T.; Ninomiya, Y.; Nobe, T.; Saito, T.; Sakamoto, H.; Sasaki, Y.; Tanaka, J.; Terashi, K.; Ueda, I.; Yamamoto, S.; Yamanaka, T.] Univ Tokyo, Dept Phys, Tokyo, Japan. [Bratzler, U.; Fukunaga, C.] Tokyo Metropolitan Univ, Grad Sch Sci & Technol, Tokyo, Japan. [Hirose, M.; Ishitsuka, M.; Jinnouchi, O.; Kobayashi, D.; Kuze, M.; Motohashi, K.; Todome, K.; Yamaguchi, D.] Tokyo Inst Technol, Dept Phys, Tokyo, Japan. [Batista, S. J.; Chau, C. C.; Cormier, K. J. R.; DeMarco, D. A.; Di Sipio, R.; Diamond, M.; Keoshkerian, H.; Krieger, P.; Liblong, A.; Mc Goldrick, G.; Orr, R. S.; Pascuzzi, V. R.; Polifka, R.; Rudolph, M. S.; Savard, P.; Sinervo, P.; Taenzer, J.; Teuscher, R. J.; Trischuk, W.; Veloce, L. M.; Venturi, N.] Univ Toronto, Dept Phys, Toronto, ON, Canada. [Azuelos, G.; Canepa, A.; Chekulaev, S. V.; Gingrich, D. M.; Hod, N.; Jovicevic, J.; Oakham, F. G.; Codina, E. Perez; Savard, P.; Schneider, B.; Stelzer-Chilton, O.; Tafirout, R.; Trigger, I. M.; Vetterli, M. C.] TRIUMF, Vancouver, BC, Canada. [Ramos, J. Manjarres; Palacino, G.; Taylor, W.] York Univ, Dept Phys & Astron, Toronto, ON, Canada. [Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Fac Pure & Appl Sci, Tsukuba, Ibaraki, Japan. [Hara, K.; Ito, F.; Kasahara, K.; Kim, S. H.; Kiuchi, K.; Nagata, K.; Okawa, H.; Sato, K.; Ukegawa, F.] Univ Tsukuba, Ctr Integrated Res Fundamental Sci & Engn, Tsukuba, Ibaraki, Japan. [Beauchemin, P. H.; Meoni, E.; Sliwa, K.; Son, H.; Wetter, J.] Tufts Univ, Dept Phys & Astron, Medford, MA 02155 USA. [Casper, D. W.; Corso-Radu, A.; Frate, M.; Guest, D.; Lankford, A. J.; Mete, A. S.; Nelson, A.; Scannicchio, D. A.; Schernau, M.; Shimmin, C. O.; Taffard, A.; Unel, G.; Whiteson, D.] Univ Calif Irvine, Dept Phys & Astron, Irvine, CA USA. [Acharya, B. S.; Boldyrev, A. S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Quayle, W. B.; Serkin, L.; Shaw, K.; Soualah, R.; Truong, L.] INFN, Sez Trieste, Grp Collegato Udine, Udine, Italy. [Acharya, B. S.; Quayle, W. B.; Serkin, L.; Shaw, K.] Abdus Salaam Int Ctr Theoret Phys, Trieste, Italy. [Boldyrev, A. S.; Cobal, M.; Giordani, M. P.; Pinamonti, M.; Soualah, R.; Truong, L.] Univ Udine, Dipartimento Chim Fis & Ambiente, Udine, Italy. [Kuutmann, E. Bergeaas; Brenner, R.; Ekelof, T.; Ellert, M.; Ferrari, A.; Maddocks, H. J.; Ohman, H.; Pelikan, D.; Rangel-Smith, C.] Uppsala Univ, Dept Phys & Astron, Uppsala, Sweden. [Atkinson, M.; Armadans, R. Caminal; Cavaliere, V.; Chang, P.; Errede, S.; Hooberman, B. H.; Lie, K.; Liss, T. M.; Liu, L.; Long, J. D.; Neubauer, M. S.; Rybar, M.; Shang, R.; Sickles, A. M.; Vichou, I.; Zeng, J. C.] Univ Illinois, Dept Phys, 1110 W Green St, Urbana, IL 61801 USA. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Inst Fis Corpuscular IFIC, Valencia, Spain. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Dept Fis Atom Mol & Nucl, Valencia, Spain. [Aloisio, A.; Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Dept Ingn Elect, Valencia, Spain. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] Univ Valencia, Inst Microelect Barcelona IMB CNM, Valencia, Spain. [Alvarez Piqueras, D.; Barranco Navarro, L.; Cabrera Urban, S.; Castillo Gimenez, V.; Cerda Alberich, L.; Costa, M. J.; Fernandez Martinez, P.; Ferrer, A.; Fiorini, L.; Fuster, J.; Garcia, C.; Garcia Navarro, J. E.; Gonzalez de la Hoz, S.; Hernandez Jimenez, Y.; Higon-Rodriguez, E.; Jimenez Pena, J.; King, M.; Lacasta, C.; Lacuesta, V. R.; Mamuzic, J.; Marti-Garcia, S.; Melini, D.; Mitsou, V. A.; Pedraza Lopez, S.; Rodriguez Rodriguez, D.; Romero Adam, E.; Ros, E.; Salt, J.; Sanchez, J.; Sanchez Martinez, V.; Soldevila, U.; Valero, A.; Valls Ferrer, J. A.; Vos, M.] CSIC, Valencia, Spain. [Danninger, M.; Fedorko, W.; Gay, C.; Gecse, Z.; Gignac, M.; Henkelmann, S.; King, S. B.; Lister, A.] Univ British Columbia, Dept Phys, Vancouver, BC, Canada. [Albert, J.; David, C.; Elliot, A. A.; Fincke-Keeler, M.; Hamano, K.; Hill, E.; Keeler, R.; Kowalewski, R.; Kuwertz, E. S.; Kwan, T.; LeBlanc, M.; Lefebvre, M.; McPherson, R. A.; Pearce, J.; Seuster, R.; Sobie, R.; Trovatelli, M.; Venturi, M.] Univ Victoria, Dept Phys & Astron, Victoria, BC, Canada. [Beckingham, M.; Ennis, J. S.; Farrington, S. M.; Harrison, P. F.; Jeske, C.; Jones, G.; Martin, T. A.; Murray, W. J.; Pianori, E.; Spangenberg, M.] Univ Warwick, Dept Phys, Coventry, W Midlands, England. [Iizawa, T.; Mitani, T.; Sakurai, Y.; Yorita, K.] Waseda Univ, Tokyo, Japan. [Bressler, S.; Citron, Z. H.; Duchovni, E.; Dumancic, M.; Gross, E.; Kohler, M. K.; Lellouch, D.; Levinson, L. J.; Mikenberg, G.; Milov, A.; Pitt, M.; Ravinovich, I.; Roth, I.; Schaarschmidt, J.; Smakhtin, V.; Turgeman, D.] Weizmann Inst Sci, Dept Particle Phys, Rehovot, Israel. [Banerjee, Sw.; Guan, W.; Hard, A. S.; Heng, Y.; Ji, H.; Ju, X.; Kaplan, L. S.; Kashif, L.; Kruse, A.; Ming, Y.; Wang, F.; Wiedenmann, W.; Wu, S. L.; Yang, H.; Zhang, F.; Zobernig, G.] Univ Wisconsin, Dept Phys, 1150 Univ Ave, Madison, WI 53706 USA. [Kuger, F.; Redelbach, A.; Schreyer, M.; Sidiropoulou, O.; Siragusa, G.; Stroehmer, R.; Trefzger, T.; Weber, S. W.; Zibell, A.] Julius Maximilians Univ, Fak Phys & Astron, Wurzburg, Germany. [Bannoura, A. A. E.; Boerner, D.; Braun, H. M.; Ellinghaus, F.; Ernis, G.; Gilles, G.; Hirschbuehl, D.; Riegel, C. J.; Tepel, F.; Zeitnitz, C.] Berg Univ Wuppertal, Fak Mathemat & Naturwissenschaften, Fachgrp Phys, Wuppertal, Germany. [Baker, O. K.; Noccioli, E. Benhar; Cummings, J.; Demers, S.; Ideal, E.; Lagouri, T.; Leister, A. G.; Loginov, A.; Hernandez, D. Paredes; Thomsen, L. A.; Tipton, P.; Vasquez, J. G.; Wang, X.] Yale Univ, Dept Phys, New Haven, CT USA. [Brau, J. E.; Hakobyan, H.; Vardanyan, G.] Yerevan Phys Inst, Yerevan, Armenia. [Rahal, G.] IN2P3, Ctr Calcul Inst Natl Phys Nucl & Phys Particules, Villeurbanne, France. [Acharya, B. S.] Kings Coll London, Dept Phys, London, England. [Anisenkov, A. V.; Baldin, E. M.; Bobrovnikov, V. S.; Buzykaev, A. R.; Kazanin, V. F.; Kharlamov, A. G.; Korol, A. A.; Maslennikov, A. L.; Maximov, D. A.; Peleganchuk, S. V.; Rezanova, O. L.; Soukharev, A. M.; Talyshev, A. A.; Tikhonov, Yu. A.] Novosibirsk State Univ, Novosibirsk, Russia. [Banerjee, Sw.] Univ Louisville, Dept Phys & Astron, Louisville, KY 40292 USA. [Bawa, H. S.; Gao, Y. S.] Calif State Univ Fresno, Dept Phys, Fresno, CA 93740 USA. [Beck, H. P.] Univ Fribourg, Dept Phys, Fribourg, Switzerland. [Casado, M. P.] Univ Autonoma Barcelona, Dept Fis, Barcelona, Spain. [Castro, N. F.] Univ Porto, Fac Ciencias, Dept Fis & Astron, Rua Campo Alegre 823, P-4100 Oporto, Portugal. [Chelkov, G. A.] Tomsk State Univ, Tomsk, Russia. [Conventi, F.; Della Pietra, M.] Univ Napoli Parthenope, Naples, Italy. [Robertson, S. H.; Sobie, R.; Teuscher, R. J.] IPP, Victoria, BC, Canada. [Fedin, O. L.] St Petersburg State Polytech Univ, Dept Phys, St Petersburg, Russia. [Govender, N.] Ctr High Performance Comp, CSIR Campus, Cape Town, South Africa. [Grinstein, S.; Juste Rozas, A.; Martinez, M.] ICREA, Barcelona, Spain. [Hsu, P. J.] Natl Tsing Hua Univ, Dept Phys, Hsinchu 30013, Taiwan. [Jejelava, J.] Ilia State Univ, Inst Theoret Phys, Tbilisi, Rep of Georgia. [Khubua, J.] GTU, Tbilisi, Rep of Georgia. [Kono, T.; Nagai, R.] Ochanomizu Univ, Ochadai Acad Prod, Tokyo, Japan. [Konoplich, R.] Manhattan Coll, New York, NY USA. [Leisos, A.] Hellen Open Univ, Patras, Greece. [Lin, S. C.] Acad Sinica, Acad Sinica Grid Comp, Inst Phys, Taipei, Taiwan. [Liu, B.] Shandong Univ, Sch Phys Sci, Jinan, Shandong, Peoples R China. [Myagkov, A. G.; Nikolaenko, V.; Zaitsev, A. M.] State Univ, Moscow Inst Phys & Technol, Dolgoprudnyi, Russia. [Pasztor, G.] Eotvos Lorand Univ, Budapest, Hungary. [Balestri, T.; Bee, C. P.; Chen, K.; Hobbs, J.; Huo, P.; Jia, J.; Li, H.; Lindquist, B. E.; McCarthy, R. L.; Montalbano, A.; Morvaj, L.; Piacquadio, G.; Radhakrishnan, S. K.; Rijssenbeek, M.; Schamberger, R. D.; Tsybychev, D.; Zaman, A.; Zhou, M.] SUNY Stony Brook, Dept Chem, Stony Brook, NY 11794 USA. [Pinamonti, M.] Int Sch Adv Studies SISSA, Trieste, Italy. [Purohit, M.] Univ South Carolina, Dept Phys & Astron, Columbia, SC 29208 USA. [Shi, L.] Sun Yat Sen Univ, Sch Phys & Engn, Guangzhou, Guangdong, Peoples R China. [Shiyakova, M.] Bulgarian Acad Sci, INRNE, Sofia, Bulgaria. [Smirnova, L. N.; Turchikhin, S.] Moscow MV Lomonosov State Univ, Fac Phys, Moscow, Russia. [Tompkins, L.] Stanford Univ, Dept Phys, Stanford, CA 94305 USA. [Toth, J.] Wigner Res Ctr Phys, Inst Particle & Nucl Phys, Budapest, Hungary. [Vest, A.] Flensburg Univ Appl Sci, Flensburg, Germany. [Yusuff, I.] Univ Malaya, Dept Phys, Kuala Lumpur, Malaysia. RP Aaboud, M (reprint author), Univ Mohamed Premier, Fac Sci, Oujda, Morocco.; Aaboud, M (reprint author), LPTPM, Oujda, Morocco. RI Zaitsev, Alexandre/B-8989-2017; Leitner, Rupert/C-2004-2017; Carli, Ina/C-2189-2017; messina, andrea/C-2753-2013; Guo, Jun/O-5202-2015; Livan, Michele/D-7531-2012; Villa, Mauro/C-9883-2009; Peleganchuk, Sergey/J-6722-2014; Yang, Haijun/O-1055-2015; Li, Liang/O-1107-2015; Monzani, Simone/D-6328-2017; Kuday, Sinan/C-8528-2014; Soldatov, Evgeny/E-3990-2017; Snesarev, Andrey/H-5090-2013; Solodkov, Alexander/B-8623-2017; Doyle, Anthony/C-5889-2009; Warburton, Andreas/N-8028-2013; Gladilin, Leonid/B-5226-2011; Mashinistov, Ruslan/M-8356-2015; Gutierrez, Phillip/C-1161-2011; Tikhomirov, Vladimir/M-6194-2015; White, Ryan/E-2979-2015; Kantserov, Vadim/M-9761-2015; Chekulaev, Sergey/O-1145-2015; Zhukov, Konstantin/M-6027-2015; Mitsou, Vasiliki/D-1967-2009; Garcia, Jose /H-6339-2015; Vanyashin, Aleksandr/H-7796-2013; Camarri, Paolo/M-7979-2015; Carvalho, Joao/M-4060-2013; Prokoshin, Fedor/E-2795-2012; OI Veneziano, Stefano/0000-0002-2598-2659; Smirnov, Sergei/0000-0002-6778-073X; Vazquez Schroeder, Tamara/0000-0002-9780-099X; Chen, Chunhui /0000-0003-1589-9955; Belanger-Champagne, Camille/0000-0003-2368-2617; Belyaev, Nikita/0000-0002-1131-7121; Muenstermann, Daniel/0000-0001-6223-2497; Bertram, Iain/0000-0003-4073-4941; Zaitsev, Alexandre/0000-0002-4961-8368; Leitner, Rupert/0000-0002-2994-2187; Carli, Ina/0000-0002-0411-1141; Guo, Jun/0000-0001-8125-9433; Livan, Michele/0000-0002-5877-0062; Villa, Mauro/0000-0002-9181-8048; Peleganchuk, Sergey/0000-0003-0907-7592; Li, Liang/0000-0001-6411-6107; Monzani, Simone/0000-0002-0479-2207; Kuday, Sinan/0000-0002-0116-5494; Soldatov, Evgeny/0000-0003-0694-3272; Solodkov, Alexander/0000-0002-2737-8674; Doyle, Anthony/0000-0001-6322-6195; Warburton, Andreas/0000-0002-2298-7315; Gladilin, Leonid/0000-0001-9422-8636; Mashinistov, Ruslan/0000-0001-7925-4676; Tikhomirov, Vladimir/0000-0002-9634-0581; White, Ryan/0000-0003-3589-5900; Kantserov, Vadim/0000-0001-8255-416X; Mitsou, Vasiliki/0000-0002-1533-8886; Vanyashin, Aleksandr/0000-0002-0367-5666; Camarri, Paolo/0000-0002-5732-5645; Carvalho, Joao/0000-0002-3015-7821; Prokoshin, Fedor/0000-0001-6389-5399; Terzo, Stefano/0000-0003-3388-3906; Farrington, Sinead/0000-0001-5350-9271; Robson, Aidan/0000-0002-1659-8284 FU ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW, Austria; FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq, Brazil; FAPESP, Brazil; NSERC, Canada; NRC, Canada; CFI, Canada; CERN; CONICYT, Chile; CAS, China; MOST, China; NSFC, China; COLCIENCIAS, Colombia; MSMT CR, Czech Republic; MPO CR, Czech Republic; VSC CR, Czech Republic; DNRF, Denmark; DNSRC, Denmark; IN2P3-CNRS, France; CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, Germany; HGF, Germany; MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, Israel; I-CORE, Israel; Benoziyo Center, Israel; INFN, Italy; MEXT, Japan; JSPS, Japan; CNRST, Morocco; FOM, Netherlands; NWO, Netherlands; RCN, Norway; MNiSW, Poland; NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia, Russian Federation; NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS, Slovenia; MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC, Sweden; Wallenberg Foundation, Sweden; SERI, Switzerland; SNSF, Switzerland; Cantons of Bern and Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE, United States of America; NSF, United States of America; BCKDF; Canada Council, Canada; CANARIE, Canada; CRC, Canada; Compute Canada, Canada; FQRNT, Canada; Ontario InnovationTrust, Canada; EPLANET, European Union; ERC, European Union; FP7, European Union; Horizon 2020, European Union; Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, France; ANR, France; Region Auvergne, France; Fondation Partager le Savoir, France; DFG, Germany; AvH Foundation, Germany; Herakleitos programme - EU-ESF; Thales programme - EU-ESF; Aristeia programme - EU-ESF; Greek NSRF; BSF, Israel; GIF, Israel; Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Spain; Generalitat Valenciana, Spain; Royal Society, United Kingdom; Leverhulme Trust, United Kingdom FX We thank CERN for the very successful operation of the LHC, as well as the support staff from our institutions without whom ATLAS could not be operated efficiently. We acknowledge the support of ANPCyT, Argentina; YerPhI, Armenia; ARC, Australia; BMWFW and FWF, Austria; ANAS, Azerbaijan; SSTC, Belarus; CNPq and FAPESP, Brazil; NSERC, NRC and CFI, Canada; CERN; CONICYT, Chile; CAS, MOST and NSFC, China; COLCIENCIAS, Colombia; MSMT CR, MPO CR and VSC CR, Czech Republic; DNRF and DNSRC, Denmark; IN2P3-CNRS, CEA-DSM/IRFU, France; GNSF, Georgia; BMBF, HGF, and MPG, Germany; GSRT, Greece; RGC, Hong Kong SAR, China; ISF, I-CORE and Benoziyo Center, Israel; INFN, Italy; MEXT and JSPS, Japan; CNRST, Morocco; FOM and NWO, Netherlands; RCN, Norway; MNiSW and NCN, Poland; FCT, Portugal; MNE/IFA, Romania; MES of Russia and NRC KI, Russian Federation; JINR; MESTD, Serbia; MSSR, Slovakia; ARRS and MIZS, Slovenia; DST/NRF, South Africa; MINECO, Spain; SRC and Wallenberg Foundation, Sweden; SERI, SNSF and Cantons of Bern and Geneva, Switzerland; MOST, Taiwan; TAEK, Turkey; STFC, United Kingdom; DOE and NSF, United States of America. In addition, individual groups and members have received support from BCKDF, the Canada Council, CANARIE, CRC, Compute Canada, FQRNT, and the Ontario InnovationTrust, Canada; EPLANET, ERC, FP7, Horizon 2020 and Marie Sklodowska-Curie Actions, European Union; Investissements d'Avenir Labex and Idex, ANR, Region Auvergne and Fondation Partager le Savoir, France; DFG and AvH Foundation, Germany; Herakleitos, Thales and Aristeia programmes co-financed by EU-ESF and the Greek NSRF; BSF, GIF and Minerva, Israel; BRF, Norway; Generalitat de Catalunya, Generalitat Valenciana, Spain; the Royal Society and Leverhulme Trust, United Kingdom. The crucial computing support from all WLCG partners is acknowledged gratefully, in particular from CERN, the ATLAS Tier-1 facilities at TRIUMF (Canada), NDGF (Denmark, Norway, Sweden), CC-IN2P3 (France), KIT/GridKA (Germany), INFN-CNAF (Italy), NL-T1 (Netherlands), PIC (Spain), ASGC (Taiwan), RAL (UK) and BNL (USA), the Tier-2 facilities worldwide and large non-WLCG resource providers. Major contributors of computing resources are listed in Ref. [49]. NR 49 TC 0 Z9 0 U1 38 U2 38 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1434-6044 EI 1434-6052 J9 EUR PHYS J C JI Eur. Phys. J. C PD DEC 3 PY 2016 VL 76 IS 12 AR 666 DI 10.1140/epjc/s10052-016-4507-9 PG 42 WC Physics, Particles & Fields SC Physics GA EE8QK UT WOS:000389890600001 PM 28316500 ER PT J AU Bellamy, MB Hiller, MM Dewji, SA Veinot, KG Leggett, RW Eckerman, KF Easterly, CE Hertel, NE AF Bellamy, M. B. Hiller, M. M. Dewji, S. A. Veinot, K. G. Leggett, R. W. Eckerman, K. F. Easterly, C. E. Hertel, N. E. TI COMPARISON OF MONOENERGETIC PHOTON ORGAN DOSE RATE COEFFICIENTS FOR STYLIZED AND VOXEL PHANTOMS SUBMERGED IN AIR SO RADIATION PROTECTION DOSIMETRY LA English DT Article ID EXTERNAL EXPOSURE; CLOUD; MODEL AB As part of a broader effort to calculate effective dose rate coefficients for external exposure to photons and electrons emitted by radionuclides distributed in air, soil or water, age-specific stylized phantoms have been employed to determine dose coefficients relating dose rate to organs and tissues in the body. In this article, dose rate coefficients computed using the International Commission on Radiological Protection reference adult male voxel phantom are compared with values computed using the Oak Ridge National Laboratory adult male stylized phantom in an air submersion exposure geometry. Monte Carlo calculations for both phantoms were performed for monoenergetic source photons in the range of 30 keV to 5 MeV. These calculations largely result in differences under 10 % for photon energies above 50 keV, and it can be expected that both models show comparable results for the environmental sources of radionuclides. C1 [Bellamy, M. B.; Hiller, M. M.; Dewji, S. A.; Leggett, R. W.; Hertel, N. E.] Oak Ridge Natl Lab, Ctr Radiat Protect Knowledge, POB 2008 MS 6335, Oak Ridge, TN 37831 USA. [Veinot, K. G.; Eckerman, K. F.; Easterly, C. E.] Easterly Sci, 6412 Westminster Rd, Knoxville, TN 37919 USA. [Hertel, N. E.] Georgia Inst Technol, 770 State St, Atlanta, GA 30332 USA. RP Dewji, SA (reprint author), Oak Ridge Natl Lab, Ctr Radiat Protect Knowledge, POB 2008 MS 6335, Oak Ridge, TN 37831 USA. EM dewjisa@ornl.gov FU U.S. Environmental Protection Agency Office of Radiation and Indoor Air [DOE 1886-T249-06/1886-T233-06]; U.S. Department of Energy [DEAC05-00OR22725] FX This work was supported by the U.S. Environmental Protection Agency Office of Radiation and Indoor Air under Interagency Agreement number DOE 1886-T249-06/1886-T233-06 and was prepared by Oak Ridge National Laboratory, managed by UT-Battelle, LLC, for the U.S. Department of Energy under contract DEAC05-00OR22725. NR 15 TC 1 Z9 1 U1 0 U2 0 PU OXFORD UNIV PRESS PI OXFORD PA GREAT CLARENDON ST, OXFORD OX2 6DP, ENGLAND SN 0144-8420 EI 1742-3406 J9 RADIAT PROT DOSIM JI Radiat. Prot. Dosim. PD DEC 2 PY 2016 VL 172 IS 4 BP 367 EP 374 DI 10.1093/rpd/ncv548 PG 8 WC Environmental Sciences; Public, Environmental & Occupational Health; Nuclear Science & Technology; Radiology, Nuclear Medicine & Medical Imaging SC Environmental Sciences & Ecology; Public, Environmental & Occupational Health; Nuclear Science & Technology; Radiology, Nuclear Medicine & Medical Imaging GA EJ4IH UT WOS:000393179700006 PM 26838066 ER PT J AU Ferreira, IS Tello, C Bergano, M Villela, T Barbosa, D Smoot, GF AF Ferreira, Ivan S. Tello, Camilo Bergano, Miguel Villela, Thyrso Barbosa, Domingos Smoot, George F. TI A C-band broadband ortho-mode transducer for radioastronomy polarimetry SO SPRINGERPLUS LA English DT Article DE Radioastronomy; Polarimeters; Ortho-mode transducers ID GEM PROJECT; GHZ AB Background: We describe the design, the construction and performance of a narrow band ortho-mode transducer, currently used in the 5 GHz polarimetric receiver of the Galactic Emission Mapping project. Results: The ortho-mode transducer was designed to achieve a high degree of transmission within the 400 MHz of the GEM band around the 5 GHz (4.8-5.2 GHz). It is composed of a circular-to-square waveguide transition, a septum polarizer, a thin waveguide coupler and a smooth square-to-rectangular waveguide transition with custom waveguide bends to the output ports. Conclusion: Our simulations and measurements show a very low level of cross-polarization of about -60 dB and a good impedance match for all three ports (S11; S22; S33 < -30 dB) with only 0: 25 dB of insertion loss offset across the 400 MHz (4.8-5.2 GHz) of the reception bandwidth. C1 [Ferreira, Ivan S.] Univ Brasilia, Inst Fis, Lab Cosmol & Astrofis, Campus Univ Darcy Ribeiro,Asa Norte, BR-70919970 Brasilia, DF, Brazil. [Tello, Camilo; Villela, Thyrso] INPE, Div Astrofis DAS, Ave Astronautas 1-758, BR-12227010 Sao Jose Dos Campos, SP, Brazil. [Bergano, Miguel] Wiseware Engn Solut, Zona Ind Mota, Rua 12,Lote 51, P-3830527 Gafanha Da Encarnacao, Portugal. [Barbosa, Domingos] ENGAGE SKA, Inst Telecomunicacoes, Campus Univ Santiago, P-3810193 Aveiro, Portugal. [Smoot, George F.] Lawrence Berkeley Natl Lab, 1 Cyclotron Rd,MS 50-5005, Berkeley, CA 94720 USA. [Smoot, George F.] Univ Paris Diderot APC, Batiment Condorcet,10 Rue Alice Domon & Leonie, F-75205 Paris 13, France. RP Bergano, M (reprint author), Wiseware Engn Solut, Zona Ind Mota, Rua 12,Lote 51, P-3830527 Gafanha Da Encarnacao, Portugal. EM jbergano@av.it.pt FU CNPq [305219/2004-9, 303637/2007-2, 484378/2007-4, 308113/2010-1, 506269/2010-8, 502831/2008-1, 559197/2008-0, 308876/2014-8]; FAPESP [00/06770-2]; Fundacao para a Ciencia e a Tecnologia (FCT) the Portuguese National Funding Agency [SFRH/BD/76615/2011]; FCT/MEC through national funds; FEDER [UID/EEA/50008/2013]; ENGAGE SKA national Research Infrastructure FX I.S.F. thanks a CAPES and a CNPq Fellowship. T.V. acknowledges CNPq Grants 305219/2004-9, 303637/2007-2, 484378/2007-4, 308113/2010-1, 506269/2010-8, 502831/2008-1, 559197/2008-0 and 308876/2014-8, and FAPESP Grant 00/06770-2. The corresponding author and DB acknowledge support from the Fundacao para a Ciencia e a Tecnologia (FCT) the Portuguese National Funding Agency (SFRH/BD/76615/2011) and by FCT/MEC through national funds and when applicable co-funded by FEDER - PT2020 partnership agreement under the Project UID/EEA/50008/2013. DB acknowledges support from the ENGAGE SKA national Research Infrastructure. NR 15 TC 0 Z9 0 U1 0 U2 0 PU SPRINGER INTERNATIONAL PUBLISHING AG PI CHAM PA GEWERBESTRASSE 11, CHAM, CH-6330, SWITZERLAND SN 2193-1801 J9 SPRINGERPLUS JI SpringerPlus PD DEC 2 PY 2016 VL 5 AR 2069 DI 10.1186/s40064-016-3761-5 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EH5SZ UT WOS:000391834500001 PM 27995046 ER PT J AU Comeau, D Kurtze, DA Restrepo, JM AF Comeau, Darin Kurtze, Douglas A. Restrepo, Juan M. TI A conceptual model of oceanic heat transport in the Snowball Earth scenario SO EARTH SYSTEM DYNAMICS LA English DT Article ID MODERN SOFT SNOWBALL; SEA-ICE; POLYCRYSTALLINE ICE; INITIATION; CLIMATE; CIRCULATION; DYNAMICS; SIMULATION; ATMOSPHERE; CREEP AB Geologic evidence suggests that the Earth may have been completely covered in ice in the distant past, a state known as Snowball Earth. This is still the subject of controversy, and has been the focus of modeling work from low-dimensional models up to state-of-the-art general circulation models. In our present global climate, the ocean plays a large role in redistributing heat from the equatorial regions to high latitudes, and as an important part of the global heat budget, its role in the initiation a Snowball Earth, and the subsequent climate, is of great interest. To better understand the role of oceanic heat transport in the initiation of Snowball Earth, and the resulting global ice covered climate state, the goal of this inquiry is twofold: we wish to propose the least complex model that can capture the Snowball Earth scenario as well as the present-day climate with partial ice cover, and we want to determine the relative importance of oceanic heat transport. To do this, we develop a simple model, incorporating thermohaline dynamics from traditional box ocean models, a radiative balance from energy balance models, and the more contemporary "sea glacier" model to account for viscous flow effects of extremely thick sea ice. The resulting model, consisting of dynamic ocean and ice components, is able to reproduce both Snowball Earth and present-day conditions through reasonable changes in forcing parameters. We find that including or neglecting oceanic heat transport may lead to vastly different global climate states, and also that the parameterization of under-ice heat transfer in the ice-ocean coupling plays a key role in the resulting global climate state, demonstrating the regulatory effect of dynamic ocean heat transport. C1 [Comeau, Darin] NYU, Courant Inst Math Sci, Ctr Atmosphere Ocean Sci, New York, NY USA. [Kurtze, Douglas A.] St Josephs Univ, Dept Phys, Philadelphia, PA 19131 USA. [Restrepo, Juan M.] Oregon State Univ, Dept Math, Coll Earth Ocean & Atmospher Sci, Corvallis, OR 97331 USA. RP Comeau, D (reprint author), Los Alamos Natl Lab, Computat Phys & Methods Grp, Los Alamos, NM 87544 USA. EM comeau@cims.nyu.edu OI Restrepo, Juan/0000-0003-2609-2882 FU GoMRI/BP and from NSF DMS [0304890]; American Institute of Mathematics, an NSF FX Funding for this work was received from GoMRI/BP and from NSF DMS grant 0304890. J. M. Restrepo also wishes to thank the American Institute of Mathematics, an NSF-funded institute where some of this research was done. The authors also wish to thank Raymond Pierrehumbert and Dorian Abbot for stimulating conversations, as well as the two anonymous reviewers for helpful insights while reviewing this manuscript. NR 40 TC 0 Z9 0 U1 8 U2 8 PU COPERNICUS GESELLSCHAFT MBH PI GOTTINGEN PA BAHNHOFSALLEE 1E, GOTTINGEN, 37081, GERMANY SN 2190-4979 EI 2190-4987 J9 EARTH SYST DYNAM JI Earth Syst. Dynam. PD DEC 2 PY 2016 VL 7 IS 4 BP 937 EP 951 DI 10.5194/esd-7-937-2016 PG 15 WC Geosciences, Multidisciplinary SC Geology GA EF2HD UT WOS:000390144500001 ER PT J AU Zalewski, JK Mo, JH Heber, S Heroux, A Gardner, RG Hildebrand, JD VanDemark, AP AF Zalewski, Jenna K. Mo, Joshua H. Heber, Simone Heroux, Annie Gardner, Richard G. Hildebrand, Jeffrey D. VanDemark, Andrew P. TI Structure of the Shroom-Rho Kinase Complex Reveals a Binding Interface with Monomeric Shroom That Regulates Cell Morphology and Stimulates Kinase Activity SO JOURNAL OF BIOLOGICAL CHEMISTRY LA English DT Article DE cytoskeleton; Ras homolog gene family; member A (RhoA); serine; threonine protein kinase; structural biology; X-ray crystallography; Rho-kinase; RhoA; Shroom; coiled-coil ID SMOOTH-MUSCLE CONTRACTION; NEURAL-TUBE MORPHOGENESIS; APICAL CONSTRICTION; MYOSIN PHOSPHATASE; ACTIN CYTOSKELETON; PROTEIN-KINASE; ROK-ALPHA; IN-VIVO; ROCK-I; PHOSPHORYLATION AB Shroom-mediated remodeling of the actomyosin cytoskeleton is a critical driver of cellular shape and tissue morphology that underlies the development of many tissues including the neural tube, eye, intestines, and vasculature. Shroom uses a conserved SD2 domain to direct the subcellular localization of Rho-associated kinase (Rock), which in turn drives changes in the cytoskeleton and cellular morphology through its ability to phosphorylate and activate non-muscle myosin II. Here, we present the structure of the human Shroom-Rock binding module, revealing an unexpected stoichiometry for Shroom in which two Shroom SD2 domains bind independent surfaces on Rock. Mutation of interfacial residues impaired Shroom-Rock binding in vitro and resulted in altered remodeling of the cytoskeleton and loss of Shroom-mediated changes in cellular morphology. Additionally, we provide the first direct evidence that Shroom can function as a Rock activator. These data provide molecular insight into the Shroom-Rock interface and demonstrate that Shroom directly participates in regulating cytoskeletal dynamics, adding to its known role in Rock localization. C1 [Zalewski, Jenna K.; Mo, Joshua H.; Heber, Simone; Hildebrand, Jeffrey D.; VanDemark, Andrew P.] Univ Pittsburgh, Dept Biol Sci, 4249 Fifth Ave, Pittsburgh, PA 15260 USA. [Heroux, Annie] Brookhaven Natl Lab, Dept Biol, Upton, NY 11973 USA. [Gardner, Richard G.] Univ Washington, Dept Pharmacol, Seattle, WA 98195 USA. RP VanDemark, AP (reprint author), Univ Pittsburgh, Dept Biol Sci, 4249 Fifth Ave, Pittsburgh, PA 15260 USA. EM andyv@pitt.edu FU Department of Energy, Office of Basic Energy Sciences - National Institutes of Health FX We thank Dr. Andrea Berman, Dr. Joel Rosenbaum, and Ryan Corbo for helpful discussions and advice and Doowon Lee for technical assistance. Operations at the National Synchrotron Light Source are supported by the Department of Energy, Office of Basic Energy Sciences, and by the National Institutes of Health. NR 65 TC 0 Z9 0 U1 1 U2 1 PU AMER SOC BIOCHEMISTRY MOLECULAR BIOLOGY INC PI BETHESDA PA 9650 ROCKVILLE PIKE, BETHESDA, MD 20814-3996 USA SN 0021-9258 EI 1083-351X J9 J BIOL CHEM JI J. Biol. Chem. PD DEC 2 PY 2016 VL 291 IS 49 BP 25364 EP 25374 DI 10.1074/jbc.M116.738559 PG 11 WC Biochemistry & Molecular Biology SC Biochemistry & Molecular Biology GA EF1OV UT WOS:000390095300008 PM 27758857 ER PT J AU Jones, SM de Sompel, HV Shankar, H Klein, M Tobin, R Grover, C AF Jones, Shawn M. de Sompel, Herbert Van Shankar, Harihar Klein, Martin Tobin, Richard Grover, Claire TI Scholarly Context Adrift: Three out of Four URI References Lead to Changed Content SO PLOS ONE LA English DT Article ID WEB; CITATIONS; INTERNET AB Increasingly, scholarly articles contain URI references to "web at large" resources including project web sites, scholarly wikis, ontologies, online debates, presentations, blogs, and videos. Authors reference such resources to provide essential context for the research they report on. A reader who visits a web at large resource by following a URI reference in an article, some time after its publication, is led to believe that the resource's content is representative of what the author originally referenced. However, due to the dynamic nature of the web, that may very well not be the case. We reuse a dataset from a previous study in which several authors of this paper were involved, and investigate to what extent the textual content of web at large resources referenced in a vast collection of Science, Technology, and Medicine (STM) articles published between 1997 and 2012 has remained stable since the publication of the referencing article. We do so in a two-step approach that relies on various well-established similarity measures to compare textual content. In a first step, we use 19 web archives to find snapshots of referenced web at large resources that have textual content that is representative of the state of the resource around the time of publication of the referencing paper. We find that representative snapshots exist for about 30% of all URI references. In a second step, we compare the textual content of representative snapshots with that of their live web counterparts. We find that for over 75% of references the content has drifted away from what it was when referenced. These results raise significant concerns regarding the long term integrity of the web-based scholarly record and call for the deployment of techniques to combat these problems. C1 [Jones, Shawn M.; de Sompel, Herbert Van; Shankar, Harihar; Klein, Martin] Los Alamos Natl Lab, Digital Lib Res & Prototyping Team, Res Lib, Los Alamos, NM 87544 USA. [Tobin, Richard; Grover, Claire] Univ Edinburgh, Language Technol Grp, Edinburgh, Midlothian, Scotland. RP Jones, SM (reprint author), Los Alamos Natl Lab, Digital Lib Res & Prototyping Team, Res Lib, Los Alamos, NM 87544 USA. EM smjones@lanl.gov OI Jones, Shawn/0000-0002-4372-870X NR 57 TC 1 Z9 1 U1 2 U2 2 PU PUBLIC LIBRARY SCIENCE PI SAN FRANCISCO PA 1160 BATTERY STREET, STE 100, SAN FRANCISCO, CA 94111 USA SN 1932-6203 J9 PLOS ONE JI PLoS One PD DEC 2 PY 2016 VL 11 IS 12 AR e0167475 DI 10.1371/journal.pone.0167475 PG 32 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE3TF UT WOS:000389520600036 PM 27911955 ER PT J AU Somnath, S Belianinov, A Kalinin, SV Jesse, S AF Somnath, Suhas Belianinov, Alex Kalinin, Sergei V. Jesse, Stephen TI Rapid mapping of polarization switching through complete information acquisition SO Nature Communications LA English DT Article ID PIEZORESPONSE FORCE MICROSCOPY; LITHIUM-ION BATTERY; FERROELECTRIC MATERIALS; HIGH-RESOLUTION; NANOSCALE; SURFACE; FILMS; MULTIFERROICS; SPECTROSCOPY; CANTILEVERS AB Polarization switching in ferroelectric and multiferroic materials underpins a broad range of current and emergent applications, ranging from random access memories to field-effect transistors, and tunnelling devices. Switching in these materials is exquisitely sensitive to local defects and microstructure on the nanometre scale, necessitating spatially resolved high-resolution studies of these phenomena. Classical piezoresponse force microscopy and spectroscopy, although providing necessary spatial resolution, are fundamentally limited in data acquisition rates and energy resolution. This limitation stems from their two-tiered measurement protocol that combines slow (similar to 1 s) switching and fast (similar to 10 kHz-1 MHz) detection waveforms. Here we develop an approach for rapid probing of ferroelectric switching using direct strain detection of material response to probe bias. This approach, facilitated by high-sensitivity electronics and adaptive filtering, enables spectroscopic imaging at a rate 3,504 times faster the current state of the art, achieving high-veracity imaging of polarization dynamics in complex microstructures. C1 [Somnath, Suhas; Belianinov, Alex; Kalinin, Sergei V.; Jesse, Stephen] Oak Ridge Natl Lab, Inst Funct Imaging Mat, 1 Bethel Valley Rd,Mail Stop 6487, Oak Ridge, TN 37831 USA. [Somnath, Suhas; Belianinov, Alex; Kalinin, Sergei V.; Jesse, Stephen] Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, 1 Bethel Valley Rd,Mail Stop 6487, Oak Ridge, TN 37831 USA. RP Kalinin, SV; Jesse, S (reprint author), Oak Ridge Natl Lab, Inst Funct Imaging Mat, 1 Bethel Valley Rd,Mail Stop 6487, Oak Ridge, TN 37831 USA.; Kalinin, SV; Jesse, S (reprint author), Oak Ridge Natl Lab, Ctr Nanophase Mat Sci, 1 Bethel Valley Rd,Mail Stop 6487, Oak Ridge, TN 37831 USA. EM sergei2@ornl.gov; sjesse@ornl.gov OI Kalinin, Sergei/0000-0001-5354-6152 NR 64 TC 0 Z9 0 U1 23 U2 23 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2041-1723 J9 NAT COMMUN JI Nat. Commun. PD DEC 2 PY 2016 VL 7 AR 13290 DI 10.1038/ncomms13290 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA EE0XD UT WOS:000389302000001 PM 27910941 ER PT J AU Ablikim, U Bomme, C Xiong, H Savelyev, E Obaid, R Kaderiya, B Augustin, S Schnorr, K Dumitriu, I Osipov, T Bilodeau, R Kilcoyne, D Kumarappan, V Rudenko, A Berrah, N Rolles, D AF Ablikim, Utuq Bomme, Cedric Xiong, Hui Savelyev, Evgeny Obaid, Razib Kaderiya, Balram Augustin, Sven Schnorr, Kirsten Dumitriu, Ileana Osipov, Timur Bilodeau, Rene Kilcoyne, David Kumarappan, Vinod Rudenko, Artem Berrah, Nora Rolles, Daniel TI Identification of absolute geometries of cis and trans molecular isomers by Coulomb Explosion Imaging SO Scientific Reports LA English DT Article ID PHOTOACTIVE YELLOW PROTEIN; 3-BODY DISSOCIATIONS; GAS-PHASE; DYNAMICS; ISOMERIZATION; CONFIGURATION; IONIZATION; SPECTRA; AUGER; ION AB An experimental route to identify and separate geometric isomers by means of coincident Coulomb explosion imaging is presented, allowing isomer-resolved photoionization studies on isomerically mixed samples. We demonstrate the technique on cis/trans 1,2-dibromoethene (C2H2Br2). The momentum correlation between the bromine ions in a three-body fragmentation process induced by bromine 3d inner-shell photoionization is used to identify the cis and trans structures of the isomers. The experimentally determined momentum correlations and the isomer-resolved fragment-ion kinetic energies are matched closely by a classical Coulomb explosion model. C1 [Ablikim, Utuq; Kaderiya, Balram; Augustin, Sven; Kumarappan, Vinod; Rudenko, Artem; Rolles, Daniel] Kansas State Univ, Dept Phys, JR Macdonald Lab, Manhattan, KS 66506 USA. [Bomme, Cedric; Savelyev, Evgeny; Rolles, Daniel] DESY, D-22607 Hamburg, Germany. [Xiong, Hui; Obaid, Razib; Bilodeau, Rene; Berrah, Nora] Univ Connecticut, Dept Phys, Storrs, CT 06269 USA. [Augustin, Sven; Schnorr, Kirsten] Max Planck Inst Nucl Phys, D-69117 Heidelberg, Germany. [Dumitriu, Ileana] Hobart & William Smith Coll, Geneva, NY 14456 USA. [Schnorr, Kirsten] Univ Calif Berkeley, Dept Chem, Berkeley, CA 94720 USA. [Osipov, Timur] SLAC Natl Accelerator Lab, Menlo Pk, CA 94025 USA. [Bilodeau, Rene; Kilcoyne, David] Lawrence Berkeley Natl Lab, Adv Light Source, Berkeley, CA 94720 USA. RP Rolles, D (reprint author), Kansas State Univ, Dept Phys, JR Macdonald Lab, Manhattan, KS 66506 USA.; Rolles, D (reprint author), DESY, D-22607 Hamburg, Germany. EM rolles@phys.ksu.edu RI Rudenko, Artem/C-7412-2009; Kilcoyne, David/I-1465-2013 OI Rudenko, Artem/0000-0002-9154-8463; FU Chemical Sciences, Geosciences, and Biosciences Division, Office of Basic Energy Sciences, Office of Science, U.S. Department of Energy [DE-FG02-86ER13491, DE-SC0012376]; Helmholtz Young Investigator program for the DESY group FX This work is supported by the Chemical Sciences, Geosciences, and Biosciences Division, Office of Basic Energy Sciences, Office of Science, U.S. Department of Energy, Grant No. DE-FG02-86ER13491 (Kansas group) and DE-SC0012376 (U Conn group). D.R. also acknowledges support through the Helmholtz Young Investigator program for the DESY group. We thank the staff of the Advanced Light Source for their help and support before and during the experiment, in particular Doug Taube for his help acquiring and handling the samples. We also acknowledge Achim Czasch for his help configuring the CoboldPC data acquisition software. NR 37 TC 0 Z9 0 U1 14 U2 14 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 2 PY 2016 VL 6 AR 38202 DI 10.1038/srep38202 PG 8 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA ED9JK UT WOS:000389185800001 PM 27910943 ER PT J AU Gao, X Lee, S Nichols, J Meyer, TL Ward, TZ Chisholm, MF Lee, HN AF Gao, Xiang Lee, Shinbuhm Nichols, John Meyer, Tricia L. Ward, Thomas Z. Chisholm, Matthew F. Ho Nyung Lee TI Nanoscale self-templating for oxide epitaxy with large symmetry mismatch SO Scientific Reports LA English DT Article ID METAL-INSULATOR-TRANSITION; SURFACE EXCHANGE KINETICS; THIN-FILMS; SUPERCELL STRUCTURE; LITHIUM BATTERIES; VO2; HETEROSTRUCTURES; TEMPERATURE; STABILITY; STORAGE AB Direct observations using scanning transmission electron microscopy unveil an intriguing interfacial bi-layer that enables epitaxial growth of a strain-free, monoclinic, bronze-phase VO2(B) thin film on a perovskite SrTiO3 (STO) substrate. We observe an ultrathin (2-3 unit cells) interlayer best described as highly strained VO2(B) nanodomains combined with an extra (Ti,V) O-2 layer on the TiO2 terminated STO (001) surface. By forming a fully coherent interface with the STO substrate and a semi-coherent interface with the strain-free epitaxial VO2(B) film above, the interfacial bi-layer enables the epitaxial connection of the two materials despite their large symmetry and lattice mismatch. C1 [Gao, Xiang; Lee, Shinbuhm; Nichols, John; Meyer, Tricia L.; Ward, Thomas Z.; Chisholm, Matthew F.; Ho Nyung Lee] Oak Ridge Natl Lab, Div Mat Sci & Technol, Oak Ridge, TN 37831 USA. RP Lee, HN (reprint author), Oak Ridge Natl Lab, Div Mat Sci & Technol, Oak Ridge, TN 37831 USA. EM hnlee@ornl.gov OI Ward, Thomas/0000-0002-1027-9186 FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division FX This work was supported by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division. We would like to thank Qian He and Erjia Guo for helpful discussions. NR 43 TC 0 Z9 0 U1 22 U2 22 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 2 PY 2016 VL 6 AR 38168 DI 10.1038/srep38168 PG 6 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA ED9LZ UT WOS:000389193300001 PM 27909313 ER PT J AU Song, HS Hora, B Giorgi, EE Kumar, A Cai, FP Bhattacharya, T Perelson, AS Gao, F AF Song, Hongshuo Hora, Bhavna Giorgi, Elena E. Kumar, Amit Cai, Fangping Bhattacharya, Tanmoy Perelson, Alan S. Gao, Feng TI Transmission of Multiple HIV-1 Subtype C Transmitted/founder Viruses into the Same Recipients Was not Determined by Modest Phenotypic Differences SO Scientific Reports LA English DT Article ID HUMAN-IMMUNODEFICIENCY-VIRUS; HETEROSEXUAL TRANSMISSION; TYPE-1 SUBTYPE; DISEASE PROGRESSION; ENV GENES; INFECTION; CORECEPTOR; RECEPTORS; RESPONSES; VARIANTS AB A severe bottleneck exists during HIV-1 mucosal transmission. However, viral properties that determine HIV-1 transmissibility are not fully elucidated. We identified multiple transmitted/founder (T/F) viruses in six HIV-1-infected subjects by analyzing whole genome sequences. Comparison of biological phenotypes of different T/F viruses from the same individual allowed us to more precisely identify critical determinants for viral transmissibility since they were transmitted under similar conditions. All T/F viruses used coreceptor CCR5, while no T/F viruses used CXCR4 or GPR15. However, the efficiency for different T/F viruses from the same individual to use CCR5 was significantly variable, and the differences were even more significant for usage of coreceptors FPRL1, CCR3 and APJ. Resistance to IFN-alpha was also different between T/F viruses in 2 of 3 individuals. The relative fitness between T/F viruses from the same subject was highly variable (2-6%). Importantly, the levels of coreceptor usage efficiency, resistance to IFN-alpha and viral fitness were not associated with proportions of T/F viruses in each individual during acute infection. Our results show that the modest but significant differences in coreceptor usage efficiency, IFN-alpha sensitivity and viral fitness each alone may not play a critical role in HIV-1 transmission. C1 [Song, Hongshuo; Hora, Bhavna; Kumar, Amit; Cai, Fangping; Gao, Feng] Duke Univ, Med Ctr, Dept Med, Durham, NC 27710 USA. [Giorgi, Elena E.; Bhattacharya, Tanmoy; Perelson, Alan S.] Los Alamos Natl Lab, Theoret Div, Los Alamos, NM 87545 USA. [Gao, Feng] Jilin Univ, Sch Life Sci, Natl Engn Lab AIDS Vaccine, Changchun 130012, Peoples R China. RP Gao, F (reprint author), Duke Univ, Med Ctr, Dept Med, Durham, NC 27710 USA.; Gao, F (reprint author), Jilin Univ, Sch Life Sci, Natl Engn Lab AIDS Vaccine, Changchun 130012, Peoples R China. EM fgao@duke.edu FU Center for HIV/AIDS Vaccine Immunology [AI067854]; Center for HIV/AIDS Vaccine Immunology and Immunogen Discovery [AI100645]; National Institutes of Health [AI028433] FX This work was supported by the Center for HIV/AIDS Vaccine Immunology (AI067854), the Center for HIV/AIDS Vaccine Immunology and Immunogen Discovery (AI100645) and RO1 grant (AI028433) from National Institutes of Health. We thank Anna Berg for technical assistance. NR 47 TC 1 Z9 1 U1 5 U2 5 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2045-2322 J9 SCI REP-UK JI Sci Rep PD DEC 2 PY 2016 VL 6 AR 38130 DI 10.1038/srep38130 PG 13 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA ED9LP UT WOS:000389192100001 PM 27909304 ER PT J AU Blake, SF Hodovanets, H McCollam, A Bud'ko, SL Canfield, PC Coldea, AI AF Blake, S. F. Hodovanets, H. McCollam, A. Bud'ko, S. L. Canfield, P. C. Coldea, A. I. TI de Haas-van Alphen study of role of 4f electrons in antiferromagnetic CeZn11 as compared to its nonmagnetic analog LaZn11 SO PHYSICAL REVIEW B LA English DT Article ID FERMI-LIQUID; SYSTEM AB We present a de Haas-van Alphen study of the Fermi surface of the low-temperature antiferromagnet CeZn11 and its nonmagnetic analog LaZn11, measured by torque magnetometry up to fields of 33 T and at temperatures down to 320 mK. Both systems possess similar de Haas-van Alphen frequencies, with three clear sets of features-ranging from 50 T to 4 kT-corresponding to three bands of a complex Fermi surface, with an expected fourth band also seen weakly in CeZn11. The effective masses of the charge carriers are very light (< 1 m(e)) in LaZn11 but a factor of 2-4 larger in CeZn11, indicative of stronger electronic correlations. We perform detailed density functional theory (DFT) calculations for CeZn11 and find that only DFT+U calculations with U = 1.5 eV, which localize the 4f states, provide a good match to the measured de Haas-van Alphen frequencies, once the presence of magnetic breakdown orbits is also considered. Our study suggests that the Fermi surface of CeZn11 is very close to that of LaZn11 being dominated by Zn 3d, as the Ce 4f states are localized and have little influence on its electronic structure, however, they are responsible for its magnetic order and contribute to enhance electronic correlations. C1 [Blake, S. F.; Coldea, A. I.] Univ Oxford, Dept Phys, Clarendon Lab, Pk Rd, Oxford OX1 3PU, England. [Hodovanets, H.; Bud'ko, S. L.; Canfield, P. C.] Iowa State Univ, Ames Lab, Ames, IA 50011 USA. [Hodovanets, H.; Bud'ko, S. L.; Canfield, P. C.] Iowa State Univ, Dept Phys & Astron, Ames, IA 50011 USA. [McCollam, A.] Radboud Univ Nijmegen, High Field Magnet Lab HFML EMFL, NL-6525 ED Nijmegen, Netherlands. RP Blake, SF (reprint author), Univ Oxford, Dept Phys, Clarendon Lab, Pk Rd, Oxford OX1 3PU, England. RI Coldea, Amalia/C-1106-2013 FU EPSRC [EP/L001772/1, EP/I004475/1, EP/I017836/1]; HFML-RU/FOM, European Magnetic Field Laboratory (EMFL); EPSRC (UK) [EP/N01085X/1]; U.S. Department of Energy, Office of Basic Energy Science, Division of Materials Sciences and Engineering; U.S. Department of Energy [DE-AC02-07CH11358]; EPSRC Career Acceleration Fellowship [EP/I004475/1] FX We thank Roser Valenti and Milan Tomic for useful discussions and Arjun Narayanan and Matthew Watson for technical support. This work was mainly supported by the EPSRC (EP/L001772/1, EP/I004475/1, EP/I017836/1). Part of this work was supported by HFML-RU/FOM, member of the European Magnetic Field Laboratory (EMFL), and by EPSRC (UK) via its membership to the EMFL (Grant No. EP/N01085X/1). The authors would like to acknowledge the use of the University of Oxford Advanced Research Computing (ARC) facility in carrying out part of this work. Work done at Ames Labwas supported by the U.S. Department of Energy, Office of Basic Energy Science, Division of Materials Sciences and Engineering. Ames Laboratory is operated for the U.S. Department of Energy by Iowa State University under Contract No. DE-AC02-07CH11358. A.I.C. acknowledges the support of an EPSRC Career Acceleration Fellowship (EP/I004475/1). NR 22 TC 0 Z9 0 U1 6 U2 6 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9950 EI 2469-9969 J9 PHYS REV B JI Phys. Rev. B PD DEC 2 PY 2016 VL 94 IS 23 AR 235103 DI 10.1103/PhysRevB.94.235103 PG 11 WC Physics, Condensed Matter SC Physics GA ED7EO UT WOS:000389025100001 ER PT J AU Tandel, SK Chowdhury, P Kondev, FG Janssens, RVF Khoo, TL Carpenter, MP Lauritsen, T Lister, CJ Seweryniak, D Zhu, S Deacon, A Freeman, SJ Hammond, NJ Jones, GD Moore, EF Smith, JF AF Tandel, S. K. Chowdhury, P. Kondev, F. G. Janssens, R. V. F. Khoo, T. L. Carpenter, M. P. Lauritsen, T. Lister, C. J. Seweryniak, D. Zhu, S. Deacon, A. Freeman, S. J. Hammond, N. J. Jones, G. D. Moore, E. F. Smith, J. F. TI Configurations and decay hindrances of high-K states in Hf-180 SO PHYSICAL REVIEW C LA English DT Article ID MULTI-QUASI-PARTICLE; HIGH-SPIN STATES; ROTATIONAL BANDS; ISOMERS; NUCLEI; DEFORMATIONS; HAFNIUM; LINE AB Multi-quasiparticle high-K states, several of which are isomeric, were observed in Hf-180 with the Gammasphere array. Lifetimes in the ns-mu s range were determined using centroid-shift and decay measurements within a mu s coincidence time window. The configurations of high-K states involve two and four quasiparticles, with states up to K-pi = (18(-)) established. High-K excitations are found to be progressively more favored with increasing excitation energy. The K quantum number is quite robust up to the highest spins observed, as evidenced by the large values of the reduced hindrance for isomeric decays. Rotational bands built on three high-K states are identified, and the measured branching ratios in these sequences enable the assignment of underlying configurations. Multi-quasiparticle calculations using the Lipkin-Nogami approach for pairing, with blocking included, reproduce the observed high-K energies quite well. C1 [Tandel, S. K.; Chowdhury, P.; Lister, C. J.] Univ Massachusetts Lowell, Dept Phys, Lowell, MA 01854 USA. [Tandel, S. K.] UM DAE Ctr Excellence Basic Sci, Bombay 400098, Maharashtra, India. [Kondev, F. G.; Janssens, R. V. F.; Khoo, T. L.; Carpenter, M. P.; Lauritsen, T.; Lister, C. J.; Seweryniak, D.; Zhu, S.; Hammond, N. J.; Moore, E. F.] Argonne Natl Lab, 9700 S Cass Ave, Argonne, IL 60439 USA. [Deacon, A.; Freeman, S. J.; Smith, J. F.] Univ Manchester, Manchester M13 9PL, Lancs, England. [Jones, G. D.] Univ Liverpool, Liverpool L69 7ZE, Merseyside, England. [Hammond, N. J.] Cambridge Univ Press, Cambridge CB2 8RU, England. [Smith, J. F.] Univ West Scotland, Paisley PA1 2BE, Renfrew, Scotland. RP Tandel, SK (reprint author), Univ Massachusetts Lowell, Dept Phys, Lowell, MA 01854 USA.; Tandel, SK (reprint author), UM DAE Ctr Excellence Basic Sci, Bombay 400098, Maharashtra, India. FU U.S. Department of Energy, Office of Science, Office of Nuclear Physics [DE-FG02-94ER40848, DE-FG02-94ER40834, DE-AC02-06CH11357] FX This work is supported by the U.S. Department of Energy, Office of Science, Office of Nuclear Physics, under award nos. DE-FG02-94ER40848 and DE-FG02-94ER40834, and contract no. DE-AC02-06CH11357. The research described here utilized resources of the ATLAS facility at ANL, which is a DOE Office of Science user facility. The authors thank the ATLAS crew for providing a sustained, stable beam for the entire duration of the experiment. NR 34 TC 0 Z9 0 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2469-9985 EI 2469-9993 J9 PHYS REV C JI Phys. Rev. C PD DEC 2 PY 2016 VL 94 IS 6 AR 064304 DI 10.1103/PhysRevC.94.064304 PG 8 WC Physics, Nuclear SC Physics GA ED7FC UT WOS:000389026500005 ER PT J AU Grabowska, DM Kaplan, DB AF Grabowska, Dorota M. Kaplan, David B. TI Chiral solution to the Ginsparg-Wilson equation SO PHYSICAL REVIEW D LA English DT Article ID LATTICE GAUGE-THEORY; EXACTLY MASSLESS QUARKS; OVERLAP DIRAC OPERATOR; DOMAIN-WALL FERMIONS; SYMMETRY RESTORATION; SU(2) VACUUM; MONTE-CARLO; INSTANTONS; ANOMALIES; TOPOLOGY AB We present a chiral solution of the Ginsparg-Wilson equation. This work is motivated by our recent proposal for nonperturbatively regulating chiral gauge theories, where five-dimensional domain wall fermions couple to a four-dimensional gauge field that is extended into the extra dimension as the solution to a gradient flow equation. Mirror fermions at the far surface decouple from the gauge field as if they have form factors that become infinitely soft as the distance between the two surfaces is increased. In the limit of an infinite extra dimension we derive an effective four-dimensional chiral overlap operator which is shown to obey the Ginsparg-Wilson equation, and which correctly reproduces a number of properties expected of chiral gauge theories in the continuum. C1 [Grabowska, Dorota M.] Univ Calif Berkeley, Berkeley Ctr Theoret Phys, Berkeley, CA 94720 USA. [Grabowska, Dorota M.] Lawrence Berkeley Natl Lab, Theoret Phys Grp, Berkeley, CA 94720 USA. [Kaplan, David B.] Inst Nucl Theory, Box 351550, Seattle, WA 98195 USA. RP Grabowska, DM (reprint author), Univ Calif Berkeley, Berkeley Ctr Theoret Phys, Berkeley, CA 94720 USA.; Grabowska, DM (reprint author), Lawrence Berkeley Natl Lab, Theoret Phys Grp, Berkeley, CA 94720 USA.; Kaplan, DB (reprint author), Inst Nucl Theory, Box 351550, Seattle, WA 98195 USA. EM grabow@uw.edu; dbkaplan@uw.edu FU NSF [DGE-1256082, 32539-13067-44-PHHXM]; DOE [DE-FG02-00ER41132] FX We received many useful criticisms of an earlier version of this work which we have now addressed. M. Luscher pointed out problems with the assumption of abrupt flow from A to A. that we could treat analytically, but which will interfere with the decoupling of the mirror fermions; M. Golterman and Y. Shamir found an error in our original treatment of the index of the continuum operator in Eq. (35); E. Poppitz showed us that the result of Ref. [52] gave evidence for nondecoupling of the mirror fermions, as expected from M. Luscher's comments, when considering the divergence of anomaly-free U(1) currents in theories with gauge anomaly cancellation. We gratefully also acknowledge communications related to this work with H. Fukaya, M. Garcia Perez, A. Hasenfratz, H. Onogi, and H. Suzuki. D. M. G. would also like to acknowledge the hospitality of the University of Colorado Physics Department where part of this work was completed. This work was supported by the NSF Graduate Research Fellowship under Grant No. DGE-1256082, the DOE Grant No. DE-FG02-00ER41132 and the NSF Grant No. 32539-13067-44-PHHXM. NR 55 TC 0 Z9 0 U1 0 U2 0 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 2 PY 2016 VL 94 IS 11 AR 114504 DI 10.1103/PhysRevD.94.114504 PG 14 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA ED7FI UT WOS:000389027200009 ER PT J AU Sato, N Ethier, JJ Melnitchouk, W Hirai, M Kumano, S Accardi, A AF Sato, Nobuo Ethier, J. J. Melnitchouk, W. Hirai, M. Kumano, S. Accardi, A. CA Jefferson Lab Angular Momentum Col TI First Monte Carlo analysis of fragmentation functions from single-inclusive e(+)e(-) annihilation SO PHYSICAL REVIEW D LA English DT Article ID QUARK FLAVOR SEPARATION; E+E-ANNIHILATION; CROSS-SECTIONS; LEADING ORDER; PARTON DISTRIBUTIONS; HADRON-PRODUCTION; CHARGED HADRONS; EVOLUTION; ENERGY; PI(+/-) AB We perform the first iterative Monte Carlo (IMC) analysis of fragmentation functions constrained by all available data from single-inclusive e(+)e(-) annihilation into pions and kaons. The IMC method eliminates potential bias in traditional analyses based on single fits introduced by fixing parameters not well constrained by the data and provides a statistically rigorous determination of uncertainties. Our analysis reveals specific features of fragmentation functions using the new IMC methodology and those obtained from previous analyses, especially for light quarks and for strange quark fragmentation to kaons. C1 [Sato, Nobuo; Melnitchouk, W.; Accardi, A.] Jefferson Lab, Newport News, VA 23606 USA. [Ethier, J. J.] Coll William & Mary, Williamsburg, VA 23187 USA. [Hirai, M.] Nippon Inst Technol, Saitama 3458501, Japan. [Kumano, S.] High Energy Accelerator Res Org KEK, 1-1 Oho, Tsukuba, Ibaraki 3050801, Japan. [Kumano, S.] J PARC Ctr, 203-1 Shirakata, Tokai, Ibaraki 3191106, Japan. [Accardi, A.] Hampton Univ, Hampton, VA 23668 USA. RP Sato, N (reprint author), Jefferson Lab, Newport News, VA 23606 USA. FU U.S. Department of Energy (DOE) [DE-AC05- 06OR23177]; DOE [DE-SC008791]; Japan Society for the Promotion of Science (JSPS) [JP25105010] FX We are grateful to Hrayr Matevosyan and Felix Ringer for helpful discussions. This work was supported by the U.S. Department of Energy (DOE) Contract No. DE-AC05-06OR23177, under which Jefferson Science Associates, LLC operates Jefferson Lab, and by the DOE Contract No. DE-SC008791. N. S. thanks KEK and J-PARC for their hospitality during a visit where some of this work was performed. The work of S. K. was supported by the Japan Society for the Promotion of Science (JSPS) Grants-in-Aid for Scientific Research (KAKENHI) Grant No. JP25105010. NR 53 TC 2 Z9 2 U1 2 U2 2 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 2470-0010 EI 2470-0029 J9 PHYS REV D JI Phys. Rev. D PD DEC 2 PY 2016 VL 94 IS 11 AR 114004 DI 10.1103/PhysRevD.94.114004 PG 21 WC Astronomy & Astrophysics; Physics, Particles & Fields SC Astronomy & Astrophysics; Physics GA ED7FI UT WOS:000389027200005 ER PT J AU Babkevich, P Katukuri, VM Fak, B Rols, S Fennell, T Pajic, D Tanaka, H Pardini, T Singh, RRP Mitrushchenkov, A Yazyev, OV Ronnow, HM AF Babkevich, P. Katukuri, Vamshi M. Fak, B. Rols, S. Fennell, T. Pajic, D. Tanaka, H. Pardini, T. Singh, R. R. P. Mitrushchenkov, A. Yazyev, O. V. Ronnow, H. M. TI Magnetic Excitations and Electronic Interactions in Sr2CuTeO6: A Spin-1/2 Square Lattice Heisenberg Antiferromagnet SO PHYSICAL REVIEW LETTERS LA English DT Article ID MOLECULAR WAVE-FUNCTIONS; ANO BASIS-SETS; AB-INITIO; ENERGY DIFFERENCES; CRYSTAL-STRUCTURE; PARENT COMPOUNDS; PSEUDOPOTENTIALS; ATOMS; LA2CUO4; OXIDES AB Sr2CuTeO6 presents an opportunity for exploring low-dimensional magnetism on a square lattice of S = 1/2 Cu2+ ions. We employ ab initio multireference configuration interaction calculations to unravel the Cu2+ electronic structure and to evaluate exchange interactions in Sr2CuTeO6. The latter results are validated by inelastic neutron scattering using linear spin-wave theory and series-expansion corrections for quantum effects to extract true coupling parameters. Using this methodology, which is quite general, we demonstrate that Sr2CuTeO6 is an almost ideal realization of a nearest-neighbor Heisenberg antiferromagnet but with relatively weak coupling of 7.18(5) meV. C1 [Babkevich, P.; Ronnow, H. M.] Ecole Polytech Fed Lausanne, Inst Phys, Lab Quantum Magnetism, CH-1015 Lausanne, Switzerland. [Katukuri, Vamshi M.; Yazyev, O. V.] Ecole Polytech Fed Lausanne, Inst Phys, Chair Computat Condensed Matter Phys, CH-1015 Lausanne, Switzerland. [Fak, B.; Rols, S.] Inst Laue Langevin, CS 20156, F-38042 Grenoble 9, France. [Fennell, T.] Paul Scherrer Inst, Lab Neutron Scattering & Imaging, CH-5232 Villigen, Switzerland. [Pajic, D.] Univ Zagreb, Fac Sci, Dept Phys, Bijenicka Cesta 32, HR-10000 Zagreb, Croatia. [Tanaka, H.] Tokyo Inst Technol, Dept Phys, Meguro Ku, Tokyo 1528551, Japan. [Pardini, T.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Singh, R. R. P.] Univ Calif Davis, Dept Phys, Davis, CA 95616 USA. [Mitrushchenkov, A.] Univ Paris Est, Lab Modelisat & Simulat Multi Echelle, CNRS, MSME,UMR 8208, 5 Blvd Descartes, F-77454 Marne La Vallee, France. RP Babkevich, P (reprint author), Ecole Polytech Fed Lausanne, Inst Phys, Lab Quantum Magnetism, CH-1015 Lausanne, Switzerland. EM peter.babkevich@gmail.com; vamshi.katukuri@epfl.ch RI Katukuri, Vamshi Mohan/J-4048-2015 OI Katukuri, Vamshi Mohan/0000-0001-9355-0594 FU ERC project 'TopoMat' [306504]; European Research Council grant CONQUEST; SNSF; Sinergia network MPBH; U.S. Department of Energy by Lawrence Livermore National Laboratory [DE-AC52-07NA27344, LLNL-JRNL-692712]; Japan Society for the Promotion of Science [26247058]; Croatian Science Foundation [8276] FX We wish to thank I. Zivkovic, S. Katrych, L. Hozoi, and N. A. Bogdanov for fruitful discussions. P.B. is grateful for help from R.S. Ewings in implementing spherical powder averaging. V.M.K. and O.V.Y. acknowledge the support from ERC project 'TopoMat' (Grant No. 306504). This work was funded by the European Research Council grant CONQUEST, the SNSF and its Sinergia network MPBH. Series expansion simulations were performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract No. DE-AC52-07NA27344. Document Release No. LLNL-JRNL-692712. This work was supported by a Grant-in-Aid for Scientific Research (A) (Grant No. 26247058) from Japan Society for the Promotion of Science. D.P. acknowledges partial support of Croatian Science Foundation under the Project 8276. NR 66 TC 0 Z9 0 U1 14 U2 14 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0031-9007 EI 1079-7114 J9 PHYS REV LETT JI Phys. Rev. Lett. PD DEC 2 PY 2016 VL 117 IS 23 AR 237203 DI 10.1103/PhysRevLett.117.237203 PG 6 WC Physics, Multidisciplinary SC Physics GA ED7HF UT WOS:000389032600012 PM 27982654 ER PT J AU Norman, MR AF Norman, M. R. TI Colloquium: Herbertsmithite and the search for the quantum spin liquid SO REVIEWS OF MODERN PHYSICS LA English DT Article ID KAGOME HEISENBERG-ANTIFERROMAGNET; CRYSTAL-STRUCTURE; FRUSTRATED MAGNETS; TOPOLOGICAL ORDER; OXYSALT MINERALS; GROUND-STATE; LATTICE; PARATACAMITE; EXCITATIONS; CU-2(OH)(3)CL AB Quantum spin liquids form a novel class of matter where, despite the existence of strong exchange interactions, spins do not order down to the lowest measured temperature. Typically, these occur in lattices that act to frustrate the appearance of magnetism. In two dimensions, the classic example is the kagome lattice composed of corner sharing triangles. There are a variety of minerals whose transition metal ions form such a lattice. Hence, a number of them have been studied and were then subsequently synthesized in order to obtain more pristine samples. Of particular note was the report in 2005 by Dan Nocera's group of the synthesis of herbertsmithite, composed of a lattice of copper ions sitting on a kagome lattice, which indeed does not order down to the lowest measured temperature despite the existence of a large exchange interaction of 17 meV. Over the past decade, this material has been extensively studied, yielding a number of intriguing surprises that have in turn motivated a resurgence of interest in the theoretical study of the spin 1/2 Heisenberg model on a kagome lattice. This Colloquium reviews these developments and then discusses potential future directions, both experimental and theoretical, as well as the challenge of doping these materials with the hope that this could lead to the discovery of novel topological and superconducting phases. C1 [Norman, M. R.] Argonne Natl Lab, Div Mat Sci, Argonne, IL 60439 USA. RP Norman, MR (reprint author), Argonne Natl Lab, Div Mat Sci, Argonne, IL 60439 USA. EM norman@anl.gov RI Norman, Michael/C-3644-2013 FU Materials Sciences and Engineering Division, Basic Energy Sciences, Office of Science, U.S. Department of Energy FX This work was supported by the Materials Sciences and Engineering Division, Basic Energy Sciences, Office of Science, U.S. Department of Energy. I thank Tian-Heng Han, whose interest in herbertsmithite helped to inspire my own. NR 134 TC 6 Z9 6 U1 29 U2 29 PU AMER PHYSICAL SOC PI COLLEGE PK PA ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA SN 0034-6861 EI 1539-0756 J9 REV MOD PHYS JI Rev. Mod. Phys. PD DEC 2 PY 2016 VL 88 IS 4 AR 041002 DI 10.1103/RevModPhys.88.041002 PG 14 WC Physics, Multidisciplinary SC Physics GA ED7HN UT WOS:000389033500001 ER PT J AU Xantheas, SS AF Xantheas, Sotiris S. TI Spying on the neighbors' pool SO SCIENCE LA English DT Editorial Material ID LIQUID WATER; PROTON C1 [Xantheas, Sotiris S.] Pacific Northwest Natl Lab, Div Phys Sci, 902 Battelle Blvd,MS K1-83, Richland, WA 99352 USA. RP Xantheas, SS (reprint author), Pacific Northwest Natl Lab, Div Phys Sci, 902 Battelle Blvd,MS K1-83, Richland, WA 99352 USA. EM sotiris.xantheas@pnnl.gov OI Xantheas, Sotiris/0000-0002-6303-1037 NR 11 TC 0 Z9 0 U1 7 U2 7 PU AMER ASSOC ADVANCEMENT SCIENCE PI WASHINGTON PA 1200 NEW YORK AVE, NW, WASHINGTON, DC 20005 USA SN 0036-8075 EI 1095-9203 J9 SCIENCE JI Science PD DEC 2 PY 2016 VL 354 IS 6316 BP 1101 EP 1101 DI 10.1126/science.aal1413 PG 1 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA ED5TY UT WOS:000388916400018 PM 27934720 ER PT J AU Akiyama, BM Laurence, HM Massey, AR Costantino, DA Xie, XP Yang, YJ Shi, PY Nix, JC Beckham, JD Kieft, JS AF Akiyama, Benjamin M. Laurence, Hannah M. Massey, Aaron R. Costantino, David A. Xie, Xuping Yang, Yujiao Shi, Pei-Yong Nix, Jay C. Beckham, J. David Kieft, Jeffrey S. TI Zika virus produces noncoding RNAs using a multi-pseudoknot structure that confounds a cellular exonuclease SO SCIENCE LA English DT Article ID SUBGENOMIC FLAVIVIRUS RNA; WEST-NILE; JAPANESE ENCEPHALITIS; EXORIBONUCLEASE XRN1; HOST ADAPTATION; INTERFERON; CELLS; BINDS AB A specialized bone marrow microenvironment (niche) regulates hematopoietic stem cell (HSC) self-renewal and commitment. For successful donor-HSC engraftment, the niche must be emptied via myeloablative irradiation or chemotherapy. However, myeloablation can cause severe complications and even mortality. Here we report that the essential amino acid valine is indispensable for the proliferation and maintenance of HSCs. Both mouse and human HSCs failed to proliferate when cultured in valine-depleted conditions. In mice fed a valine-restricted diet, HSC frequency fell dramatically within 1 week. Furthermore, dietary valine restriction emptied the mouse bone marrow niche and afforded donor-HSC engraftment without chemoirradiative myeloablation. These findings indicate a critical role for valine in HSC maintenance and suggest that dietary valine restriction may reduce iatrogenic complications in HSC transplantation. C1 [Akiyama, Benjamin M.; Laurence, Hannah M.; Costantino, David A.; Kieft, Jeffrey S.] Univ Colorado Denver, Sch Med, Dept Biochem & Mol Genet, Aurora, CO 80045 USA. [Laurence, Hannah M.] Univ Colorado Denver, HHMI, Sch Med, Aurora, CO 80045 USA. [Laurence, Hannah M.] Univ Calif Davis, Sch Vet Med, Davis, CA 95616 USA. [Massey, Aaron R.; Beckham, J. David] Univ Colorado Denver, Sch Med, Dept Med, Aurora, CO 80045 USA. [Xie, Xuping; Yang, Yujiao; Shi, Pei-Yong] Univ Texas Med Branch, Dept Biochem & Mol Biol, Galveston, TX 77555 USA. [Nix, Jay C.] Lawrence Berkeley Natl Lab, Adv Light Source, Mol Biol Consortium, Berkeley, CA 94720 USA. [Kieft, Jeffrey S.] Univ Colorado Denver, Sch Med, RNA BioSci Initiat, Aurora, CO 80045 USA. RP Kieft, JS (reprint author), Univ Colorado Denver, Sch Med, Dept Biochem & Mol Genet, Aurora, CO 80045 USA.; Kieft, JS (reprint author), Univ Colorado Denver, Sch Med, RNA BioSci Initiat, Aurora, CO 80045 USA. EM jeffrey.kieft@ucdenver.edu FU NIH [F32GM117730, R35GM118070, R01GM081346, R01AI087856, S10OD012033]; HHMI; HHMI-Burroughs Wellcome Fund medical research fellowship; University of Colorado School of Medicine; University of Colorado Department of Medicine; Novartis Institutes for BioMedical Research; University of Texas Medical Branch; University of Texas; UC Cancer Center [P30CA046934]; Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy [DE-AC02-05CH11231] FX We thank the members of the Kieft lab for discussions; C. Musselman and M. Stone for critical reading of this manuscript; and R. Soto from the M. Garcia-Blanco and S. Bradrick laboratories for sharing their protocol for sfRNA blots. Supported by NIH fellowship F32GM117730 (B.M.A.); an HHMI Early Career Scientist award and NIH grants R35GM118070 and R01GM081346 (J.S.K.); a HHMI-Burroughs Wellcome Fund medical research fellowship (H.M.L.); University of Colorado School of Medicine and Department of Medicine institutional pilot funds (A.R.M. and J.D.B.); a postdoctoral fellowship from Novartis Institutes for BioMedical Research (X.X.); and a University of Texas Medical Branch startup award, a University of Texas STARs award, and NIH grant R01AI087856 (P.-Y.S.). The UC Denver X-ray Facility is supported by UC Cancer Center support grant P30CA046934 and NIH grant S10OD012033. The Advanced Light Source is supported by the Office of Science, Office of Basic Energy Sciences, of the U.S. Department of Energy under contract DE-AC02-05CH11231. The data presented in this manuscript are tabulated in the main paper and in the supplementary materials. Coordinates and structure factors have been deposited with PDB accession code 5TPY. NR 30 TC 3 Z9 3 U1 23 U2 23 PU AMER ASSOC ADVANCEMENT SCIENCE PI WASHINGTON PA 1200 NEW YORK AVE, NW, WASHINGTON, DC 20005 USA SN 0036-8075 EI 1095-9203 J9 SCIENCE JI Science PD DEC 2 PY 2016 VL 354 IS 6316 BP 1148 EP 1152 DI 10.1126/science.aah3963 PG 5 WC Multidisciplinary Sciences SC Science & Technology - Other Topics GA ED5TY UT WOS:000388916400042 PM 27934765 ER PT J AU Bao, F Archibald, R Niedziela, J Bansal, D Delaire, O AF Bao, Feng Archibald, Richard Niedziela, Jennifer Bansal, Dipanshu Delaire, Olivier TI Complex optimization for big computational and experimental neutron datasets SO NANOTECHNOLOGY LA English DT Article DE image processing; inelastic neutron scattering; hierarchical optimization; mathematical regularization ID TOTAL-ENERGY CALCULATIONS; WAVE BASIS-SET; METALS AB We present a framework to use high performance computing to determine accurate solutions to the inverse optimization problem of big experimental data against computational models. We demonstrate how image processing, mathematical regularization, and hierarchical modeling can be used to solve complex optimization problems on big data. We also demonstrate how both model and data information can be used to further increase solution accuracy of optimization by providing confidence regions for the processing and regularization algorithms. We use the framework in conjunction with the software package SIMPHONIES to analyze results from neutron scattering experiments on silicon single crystals, and refine first principles calculations to better describe the experimental data. C1 [Bao, Feng] Univ Tennessee, Dept Math, Chattanooga, TN 37403 USA. [Bao, Feng; Archibald, Richard] Oak Ridge Natl Lab, Comp Sci & Math Div, MS 6211, One Bethel Valley Rd,POB 2008, Oak Ridge, TN 37831 USA. [Niedziela, Jennifer; Bansal, Dipanshu] Oak Ridge Natl Lab, Div Mat Sci & Technol, MS 6064, One Bethel Valley Rd,POB 2008, Oak Ridge, TN 37831 USA. [Delaire, Olivier] Duke Univ, Dept Mech Engn & Mat Sci, Box 90300 Hudson Hall, Durham, NC 27708 USA. RP Bao, F (reprint author), Univ Tennessee, Dept Math, Chattanooga, TN 37403 USA.; Bao, F (reprint author), Oak Ridge Natl Lab, Comp Sci & Math Div, MS 6211, One Bethel Valley Rd,POB 2008, Oak Ridge, TN 37831 USA. EM feng-bao@utc.edu; archibaldrk@ornl.gov RI Bansal, Dipanshu/I-7895-2016 OI Bansal, Dipanshu/0000-0003-1181-1119 FU U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division through the Office of Science Early Career Research Program; Advanced Scientific Computing Research, through the ACUMEN project; US Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division through the Office of Science Early Career Research Program [DE-SC0016166]; S3TEC EFRC, an Energy Frontier Research Center - US Department of Energy, Office of Science, Basic Energy Sciences [DE-SC0001299]; Scientific User Facilities Division, Office of Basic Energy Sciences, US Department of Energy; U.S. Department of Energy [DE-AC05-00OR22725] FX Acknowledges support by the U.S. Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division through the Office of Science Early Career Research Program and Advanced Scientific Computing Research, through the ACUMEN project.; Lattice dynamics modeling was supported by the US Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division through the Office of Science Early Career Research Program DE-SC0016166. Neutron scattering measurements and data analysis were supported by the S3TEC EFRC, an Energy Frontier Research Center funded by the US Department of Energy, Office of Science, Basic Energy Sciences under Award No. DE-SC0001299. The use of ORNL's Spallation Neutron Source was sponsored by the Scientific User Facilities Division, Office of Basic Energy Sciences, US Department of Energy.; This manuscript has been authored by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a non-exclusive, paid-up, irrevocable, worldwide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan (http://energy.gov/downloads/doe-public-access-plan). NR 22 TC 0 Z9 0 U1 7 U2 7 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0957-4484 EI 1361-6528 J9 NANOTECHNOLOGY JI Nanotechnology PD DEC 2 PY 2016 VL 27 IS 48 AR 484002 DI 10.1088/0957-4484/27/48/484002 PG 7 WC Nanoscience & Nanotechnology; Materials Science, Multidisciplinary; Physics, Applied SC Science & Technology - Other Topics; Materials Science; Physics GA EC3DO UT WOS:000388005500001 ER PT J AU Pint, BA Dryepondt, S Brady, MP Yamamoto, Y Ruan, B McKeirnan, RD AF Pint, Bruce A. Dryepondt, Sebastien Brady, Michael P. Yamamoto, Yukinori Ruan, Bo McKeirnan, Robert D., Jr. TI Field and Laboratory Evaluations of Commercial and Next-Generation Alumina-Forming Austenitic Foil for Advanced Recuperators SO JOURNAL OF ENGINEERING FOR GAS TURBINES AND POWER-TRANSACTIONS OF THE ASME LA English DT Article ID STAINLESS-STEELS; WATER-VAPOR; TECHNOLOGIES; RESISTANCE; OXIDATION AB Alumina-forming austenitic (AFA) steels represent a new class of corrosion-and creep-resistant austenitic steels designed to enable higher temperature recuperators. Field trials are in progress for commercially rolled foil with widths over 39 cm. The first trial completed 3000 hrs in a microturbine recuperator with an elevated turbine inlet temperature and showed limited degradation. A longer microturbine trial is in progress. A third exposure in a larger turbine has passed 16,000 hrs. To reduce alloy cost and address foil fabrication issues with the initial AFA composition, several new AFA compositions are being evaluated in creep and laboratory oxidation testing at 650-800 degrees C and the results compared to commercially fabricated AFA foil and conventional recuperator foil performance. C1 [Pint, Bruce A.; Dryepondt, Sebastien; Brady, Michael P.; Yamamoto, Yukinori] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. [Ruan, Bo; McKeirnan, Robert D., Jr.] Capstone Turbine Corp, Chatsworth, CA 91311 USA. RP Pint, BA (reprint author), Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA. EM pintba@ornl.gov FU U.S. Department of Energy, Office of Energy Efficiency and Renewable Energy, Advanced Manufacturing Office (CHP); U.S. Department of Energy [DE-AC05-00OR22725]; United States Government; Department of Energy FX The author would like to thank M. Stephens, J. Moser, T. Lowe, and T. Jordan at ORNL for assistance with the experimental work, and P. F. Tortorelli for comments on the manuscript. This research was sponsored by the U.S. Department of Energy, Office of Energy Efficiency and Renewable Energy, Advanced Manufacturing Office (CHP).; This manuscript has been authored by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a nonexclusive, paid-up, irrevocable, world-wide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan.1 NR 31 TC 0 Z9 0 U1 0 U2 0 PU ASME PI NEW YORK PA TWO PARK AVE, NEW YORK, NY 10016-5990 USA SN 0742-4795 EI 1528-8919 J9 J ENG GAS TURB POWER JI J. Eng. Gas. Turbines Power-Trans. ASME PD DEC PY 2016 VL 138 IS 12 AR 122001 DI 10.1115/1.4033746 PG 5 WC Engineering, Mechanical SC Engineering GA EM7RW UT WOS:000395511000006 ER PT J AU Al-Shboul, KF Hassan, SM Harilal, SS AF Al-Shboul, K. F. Hassan, S. M. Harilal, S. S. TI Molecular formation in the stagnation region of colliding laser-produced plasmas SO PLASMA SOURCES SCIENCE & TECHNOLOGY LA English DT Article DE laser-produced plasma; colliding plasmas; stagnation layer; C2 emission; plasma diagnostics; optical emission spectroscopy; ICCD fast imaging ID MAGNESIUM PLASMAS; ABLATION PLASMAS; CARBON CLUSTERS; BACKGROUND GAS; EMISSION; SPECTROSCOPY; BREAKDOWN; PLUMES; SPECTROMETRY; FEMTOSECOND AB Laser-produced colliding plasmas have numerous attractive applications, and the stagnation layer formed during collisions between plasmas is a useful system for understanding particle collisions and molecular formation in a controlled way. In this article, we explore carbon dimer formation and its evolutionary paths in a stagnation layer formed during the interaction of two laser-produced plasmas. Colliding laser-produced plasmas are generated by splitting a laser beam into two sub-beams and then focusing them into either a single flat graphite target (laterally colliding plasmas) or a V-shaped graphite target (orthogonally colliding plasmas). C-2 formation in the stagnation region of both colliding plasma schemes is investigated using optical spectroscopic means and compared with emission features from a single seed plasma. Our results show that the collisions between the plasmas followed by stagnation layer formation lead to rapid cooling, causing enhanced carbon dimer formation. In addition, plasma electron temperature, density, and C-2 vibrational temperature were measured for the stagnation zone and compared with a single seed plasma. C1 [Al-Shboul, K. F.] Jordan Univ Sci & Technol, Dept Nucl Engn, Irbid 22110, Jordan. [Hassan, S. M.] Purdue Univ, W Lafayette, IN 47907 USA. [Harilal, S. S.] Pacific Northwest Natl Lab, Richland, WA 99352 USA. RP Al-Shboul, KF (reprint author), Jordan Univ Sci & Technol, Dept Nucl Engn, Irbid 22110, Jordan. EM kfshboul@just.edu.jo FU US National Science Foundation; US Department of Energy [DE-AC05-76RL01830] FX This work was supported in part by the US National Science Foundation. Pacific Northwest National Laboratory is a multiprogram national laboratory operated by Battelle for the US Department of Energy under Contract DE-AC05-76RL01830. NR 53 TC 0 Z9 0 U1 3 U2 3 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0963-0252 EI 1361-6595 J9 PLASMA SOURCES SCI T JI Plasma Sources Sci. Technol. PD DEC PY 2016 VL 25 IS 6 AR 065017 DI 10.1088/0963-0252/25/6/065017 PG 10 WC Physics, Fluids & Plasmas SC Physics GA EN9RX UT WOS:000396338400001 ER PT J AU Yan, RB Bundy, K Law, DR Bershady, MA Andrews, B Cherinka, B Diamond-Stanic, AM Drory, N MacDonald, N Sanchez-Gallego, JR Thomas, D Wake, DA Weijmans, AM Westfall, KB Zhang, K Aragon-Salamanca, A Belfiore, F Bizyaev, D Blanc, GA Blanton, MR Brownstein, J Cappellari, M D'Souza, R Emsellem, E Fu, H Gaulme, P Graham, MT Goddard, D Gunn, JE Harding, P Jones, A Kinemuchi, K Li, C Li, HY Maiolino, R Mao, SD Maraston, C Masters, K Merrifield, MR Oravetz, D Pan, KK Parejko, JK Sanchez, SF Schlegel, D Simmons, A Thanjavur, K Tinker, J Tremonti, C van den Bosch, R Zheng, Z AF Yan, Renbin Bundy, Kevin Law, David R. Bershady, Matthew A. Andrews, Brett Cherinka, Brian Diamond-Stanic, Aleksandar M. Drory, Niv MacDonald, Nicholas Sanchez-Gallego, Jose R. Thomas, Daniel Wake, David A. Weijmans, Anne-Marie Westfall, Kyle B. Zhang, Kai Aragon-Salamanca, Alfonso Belfiore, Francesco Bizyaev, Dmitry Blanc, Guillermo A. Blanton, Michael R. Brownstein, Joel Cappellari, Michele D'Souza, Richard Emsellem, Eric Fu, Hai Gaulme, Patrick Graham, Mark T. Goddard, Daniel Gunn, James E. Harding, Paul Jones, Amy Kinemuchi, Karen Li, Cheng Li, Hongyu Maiolino, Roberto Mao, Shude Maraston, Claudia Masters, Karen Merrifield, Michael R. Oravetz, Daniel Pan, Kaike Parejko, John K. Sanchez, Sebastian F. Schlegel, David Simmons, Audrey Thanjavur, Karun Tinker, Jeremy Tremonti, Christy van den Bosch, Remco Zheng, Zheng TI SDSS-IV MaNGA IFS GALAXY SURVEY-SURVEY DESIGN, EXECUTION, AND INITIAL DATA QUALITY SO ASTRONOMICAL JOURNAL LA English DT Article DE galaxies: evolution; galaxies: general; surveys; techniques: imaging spectroscopy ID DIGITAL SKY SURVEY; STAR-FORMING GALAXIES; MASS-METALLICITY RELATION; STELLAR POPULATION GRADIENTS; EARLY DATA RELEASE; 2.5 M TELESCOPE; TO-LIGHT RATIO; SAMI GALAXY; NEARBY GALAXIES; SAURON PROJECT AB The MaNGA Survey (Mapping Nearby Galaxies at Apache Point Observatory) is one of three core programs in the Sloan Digital Sky Survey IV. It is obtaining integral field spectroscopy for 10,000. nearby galaxies at a spectral resolution of R similar to 2000 from 3622 to 10354 angstrom. The design of the survey is driven by a set of science requirements on the precision of estimates of the following properties: star formation rate surface density, gas metallicity, gravitational mass as a function of radius. We describe how these science requirements set the depth of the observations and dictate sample selection. The majority of targeted galaxies are selected to ensure uniform spatial coverage in units of effective radius (R-e) while maximizing spatial resolution. About two-thirds of the sample is covered out to 1.5R(e) (Primary sample), and one-third. of the sample is covered to 2.5R(e) (Secondary sample). We describe the survey execution with details that would be useful in the design of similar future surveys. We also present statistics on the achieved data quality, specifically. the point-spread function, sampling uniformity, spectral resolution, sky subtraction, and flux calibration. For our Primary sample, the median r-band signal-to-noise ratio is similar to 70 per 1.4 angstrom pixel for spectra stacked between 1R(e) and 1.5R(e). Measurements of various galaxy properties from the first-year data show that we are meeting or exceeding the defined requirements for the majority of our science goals. C1 [Yan, Renbin; Zhang, Kai] Univ Kentucky, Dept Phys & Astron, 505 Rose St, Lexington, KY 40506 USA. [Bundy, Kevin] Univ Tokyo, Kavli IPMU WPI, UTIAS, Kashiwa, Chiba 2778583, Japan. [Law, David R.] Space Telescope Sci Inst, 3700 San Martin Dr, Baltimore, MD 21218 USA. [Bershady, Matthew A.; Diamond-Stanic, Aleksandar M.; Tremonti, Christy] Univ Wisconsin, Dept Astron, 475 N Charter St, Madison, WI 53706 USA. [Andrews, Brett] Univ Pittsburgh, Dept Phys & Astron, 3941 OHara St, Pittsburgh, PA 15260 USA. [Andrews, Brett] Univ Pittsburgh, Pittsburgh Particle Phys Astrophys & Cosmol Ctr P, 3941 OHara St, Pittsburgh, PA 15260 USA. [Cherinka, Brian] Johns Hopkins Univ, Bloomberg Ctr, Dept Phys & Astron, 3400 N Charles St, Baltimore, MD 21218 USA. [Drory, Niv] Univ Texas Austin, McDonald Observ, 1 Univ Stn, Austin, TX 78712 USA. [MacDonald, Nicholas; Sanchez-Gallego, Jose R.; Parejko, John K.] Univ Washington, Dept Astron, Box 351580, Seattle, WA 98195 USA. [Thomas, Daniel; Westfall, Kyle B.; Maraston, Claudia; Masters, Karen] Univ Portsmouth, Inst Cosmol & Gravitat, Portsmouth, Hants, England. [Wake, David A.] Open Univ, Dept Phys Sci, Milton Keynes MK7 6AA, Bucks, England. [Weijmans, Anne-Marie] Univ St Andrews, Sch Phys & Astron, St Andrews KY16 9SS, Fife, Scotland. [Aragon-Salamanca, Alfonso; Merrifield, Michael R.] Univ Nottingham, Sch Phys & Astron, Univ Pk, Nottingham NG7 2RD, England. [Belfiore, Francesco] Univ Cambridge, Cavendish Lab, 19 JJ Thomson Ave, Cambridge CB3 0HE, England. [Belfiore, Francesco; Maiolino, Roberto] Univ Cambridge, Kavli Inst Cosmol, Madingley Rd, Cambridge CB3 0HA, England. [Bizyaev, Dmitry; Gaulme, Patrick; Kinemuchi, Karen; Oravetz, Daniel; Pan, Kaike; Simmons, Audrey] Apache Point Observ, POB 59, Sunspot, NM 88349 USA. [Bizyaev, Dmitry; Gaulme, Patrick; Kinemuchi, Karen; Oravetz, Daniel; Pan, Kaike; Simmons, Audrey] New Mexico State Univ, POB 59, Sunspot, NM 88349 USA. [Bizyaev, Dmitry] Moscow MV Lomonosov State Univ, Sternberg Astron Inst, Univ Skij Pr 13, Moscow, Russia. [Blanc, Guillermo A.] Univ Chile, Dept Astron, Camino Observ 1515, Santiago, Chile. [Blanc, Guillermo A.] CATA, Camino Observ 1515, Santiago, Chile. [Blanton, Michael R.; Tinker, Jeremy] NYU, Dept Phys, Ctr Cosmol & Particle Phys, 4 Washington Pl, New York, NY 10003 USA. [Brownstein, Joel] Univ Utah, Dept Phys & Astron, 115 S 1400 E, Salt Lake City, UT 84112 USA. [Cappellari, Michele; Graham, Mark T.] Univ Oxford, Subdept Astrophys, Dept Phys, DenysWilkinson Bldg,Keble Rd, Oxford OX1 3RH, England. [D'Souza, Richard; Jones, Amy] Max Plank Inst Astrophys, D-85741 Garching, Germany. [Emsellem, Eric] European Southern Observ, Karl Schwarzschild Str 2, D-85748 Garching, Germany. [Emsellem, Eric] Univ Lyon 1, Observ Lyon, Ctr Rech Astrophys Lyon, 9 Ave Charles Andre, F-69561 St Genis Laval, France. [Emsellem, Eric] Ecole Normale Super Lyon, 9 Ave Charles Andre, F-69230 St Genis Laval, France. [Fu, Hai] Univ Iowa, Dept Phys & Astron, 203 Van Allen Hall, Iowa City, IA 52242 USA. [Gunn, James E.] Princeton Univ, Dept Astrophys Sci, Princeton, NJ 08544 USA. [Harding, Paul] Case Western Reserve Univ, Dept Astron, Cleveland, OH 44106 USA. [Li, Cheng] Shanghai Astron Observ, Nandan Rd 80, Shanghai 200030, Peoples R China. [Li, Cheng; Mao, Shude] Tsinghua Univ, Dept Phys, Beijing 100086, Peoples R China. [Li, Cheng; Mao, Shude] Tsinghua Univ, Tsinghua Ctr Astrophys, Beijing 100086, Peoples R China. [Li, Hongyu; Mao, Shude; Zheng, Zheng] Chinese Acad Sci, Natl Astron Observ, 20A Datun Rd, Beijing 100012, Peoples R China. [Li, Hongyu] Univ Chinese Acad Sci, Beijing 100049, Peoples R China. [Mao, Shude] Univ Manchester, Sch Phys & Astron, Jodrell Bank Ctr Astrophys, Oxford Rd, Oxford M13 9PL, England. [Sanchez, Sebastian F.] Univ Nacl Autonoma Mexico, Inst Astron, AP 70-264, Mexico City 04510, DF, Mexico. [Schlegel, David] Lawrence Berkeley Natl Lab, Div Phys, Berkeley, CA 94720 USA. [Thanjavur, Karun] Univ Victoria, Dept Phys & Astron, Victoria, BC V8P 5C2, Canada. [van den Bosch, Remco] Max Planck Inst Astron, Konigstuhl 17, D-69117 Heidelberg, Germany. [Thomas, Daniel; Westfall, Kyle B.; Goddard, Daniel; Maraston, Claudia; Masters, Karen] SEPnet, South East Phys Network, Southampton, Hants, England. RP Yan, RB (reprint author), Univ Kentucky, Dept Phys & Astron, 505 Rose St, Lexington, KY 40506 USA. EM yanrenbin@uky.edu OI Yan, Renbin/0000-0003-1025-1711; Cappellari, Michele/0000-0002-1283-8420 FU World Premier International Research Center Initiative (WPI Initiative), MEXT, Japan; Leverhulme Trust Early Career Fellowship; Grainger Foundation; Royal Society University Research Fellowship; Strategic Priority Research Program "The Emergence of Cosmological Structures" of the Chinese Academy of Sciences [XDB09000000]; National Natural Science Foundation of China (NSFC) [11333003, 11390372]; STFC; Alfred P. Sloan Foundation; U.S. Department of Energy Office of Science; Center for High-Performance Computing at the University of Utah; Carnegie Institution for Science; Carnegie Mellon University; Chilean Participation Group; French Participation Group; Harvard-Smithsonian Center for Astrophysics; Instituto de Astrofisica de Canarias; Johns Hopkins University; Kavli Institute for the Physics and Mathematics of the Universe (IPMU)/University of Tokyo; Lawrence Berkeley National Laboratory; Leibniz Institut fur Astrophysik Potsdam (AIP); Max-Planck-Institut fur Astronomie (MPIA Heidelberg); Max-Planck-Institut fur Astrophysik (MPA Garching); Max-Planck-Institut fur Extraterrestrische Physik (MPE); National Astronomical Observatory of China; New Mexico State University; New York University; University of Notre Dame; Observatario Nacional/MCTI; Ohio State University; Pennsylvania State University; Shanghai Astronomical Observatory; United Kingdom Participation Group; Universidad Nacional Autonoma de Mexico; University of Arizona; University of Colorado Boulder; University of Oxford; University of Portsmouth; University of Utah; University of Virginia; University of Washington; University of Wisconsin; Vanderbilt University; Yale University; [NSF/AST 1517007]; [RSF 14-50-00043] FX We thank the referee for a very constructive report that. helped us to improve the paper. K.B. is supported by World Premier International Research Center Initiative (WPI Initiative), MEXT, Japan. M.A.B. acknowledges support by grant NSF/AST 1517007. A.W. acknowledges support of a Leverhulme Trust Early Career Fellowship. A.D. acknowledges support from the Grainger Foundation. D.B. acknowledges support by grant RSF 14-50-00043. M.C. acknowledges support from a Royal Society University Research Fellowship. S.M. and H.L. acknowledge support by the Strategic Priority Research Program "The Emergence of Cosmological Structures" of the Chinese Academy of Sciences Grant No. XDB09000000, and by the National Natural Science Foundation of China (NSFC) under grant number 11333003 and 11390372 (S.M.). K.M. acknowledges support by STFC.; Funding for the Sloan Digital Sky Survey IV has been provided by the Alfred P. Sloan Foundation, the U.S. Department of Energy Office of Science, and the Participating Institutions. SDSS-IV acknowledges support and resources from the Center for High-Performance Computing at the University of Utah. The SDSS Web site is http://www.sdss.org.; SDSS-IV is managed by the Astrophysical Research Consortium for the Participating Institutions of the SDSS Collaboration, including the Brazilian Participation Group, the Carnegie Institution for Science, Carnegie Mellon University, the Chilean Participation Group, the French Participation Group, Harvard-Smithsonian Center for Astrophysics, Instituto de Astrofisica de Canarias, Johns Hopkins University, Kavli Institute for the Physics and Mathematics of the Universe (IPMU)/University of Tokyo, Lawrence Berkeley National Laboratory, Leibniz Institut fur Astrophysik Potsdam (AIP), Max-Planck-Institut fur Astronomie (MPIA Heidelberg), Max-Planck-Institut fur Astrophysik (MPA Garching), Max-Planck-Institut fur Extraterrestrische Physik (MPE), National Astronomical Observatory of China, New Mexico State University, New York University, University of Notre Dame, Observatario Nacional/MCTI, The Ohio State University, Pennsylvania State University, Shanghai Astronomical Observatory, United Kingdom Participation Group, Universidad Nacional Autonoma de Mexico, University of Arizona, University of Colorado Boulder, University of Oxford, University of Portsmouth, University of Utah, University of Virginia, University of Washington, University of Wisconsin, Vanderbilt University, and Yale University. NR 91 TC 0 Z9 0 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0004-6256 EI 1538-3881 J9 ASTRON J JI Astron. J. PD DEC PY 2016 VL 152 IS 6 AR 197 DI 10.3847/0004-6256/152/6/197 PG 32 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EN5IT UT WOS:000396039500001 ER PT J AU Gibbs, PJ Withey, EA Coker, EN Kruizenga, AM Andraka, CE AF Gibbs, P. J. Withey, E. A. Coker, E. N. Kruizenga, A. M. Andraka, C. E. TI Copper-Silicon-Magnesium Alloys for Latent Heat Storage SO METALLURGICAL AND MATERIALS TRANSACTIONS E-MATERIALS FOR ENERGY SYSTEMS LA English DT Article ID EUTECTIC ALLOYS AB The systematic development of microstructure, solidification characteristics, and heat of solidification with composition in copper-silicon-magnesium alloys for thermal energy storage is presented. Differential scanning calorimetry was used to relate the thermal characteristics to microstructural development in the investigated alloys and clarifies the location of one of the terminal three-phase eutectics. Repeated thermal cycling highlights the thermal storage stability of the transformation through multiple melting events. Two near-terminal eutectic alloys display high enthalpies of solidification, relatively narrow melting ranges, and stable transformation hysteresis behaviors suited to thermal energy storage. (C) ASM International (ASM) and The Minerals, Metals & Materials Society (TMS) 2016 C1 [Gibbs, P. J.; Withey, E. A.; Kruizenga, A. M.] Sandia Natl Labs, POB 0969, Livermore, CA 94550 USA. [Coker, E. N.; Andraka, C. E.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. RP Gibbs, PJ (reprint author), Sandia Natl Labs, POB 0969, Livermore, CA 94550 USA. EM pjgibbs@sandia.gov FU U.S. Department of Energy SunSHOT program; U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000] FX The authors would like to thank Ryan Nishimoto and Nancy Yang at Sandia National Laboratory-CA for performing the SEM characterization. Additionally, we thank Jim Patterson at Sophisticated Alloys Inc. for his observations while casting the alloys and Sam McFadden at Anamet Inc. for assistance in preparing the metallographic specimens. We acknowledge the funding support of the U.S. Department of Energy SunSHOT program for this project, a part of the Dish Stirling High Performance Thermal Storage project. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under Contract DE-AC04-94AL85000. NR 13 TC 0 Z9 0 U1 0 U2 0 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 2196-2936 EI 2196-2944 J9 METALL MATER TRANS E JI Metall. Mater. Trans. E-Mater. Energy Syst. PD DEC PY 2016 VL 3 IS 4 BP 272 EP 280 DI 10.1007/s40553-016-0089-6 PG 9 WC Materials Science, Multidisciplinary SC Materials Science GA EL0UQ UT WOS:000394337700006 ER PT J AU Ban, KY Kim, Y Kuciauskas, D Bremner, SP Honsberg, CB AF Ban, Keun-Yong Kim, Yeongho Kuciauskas, Darius Bremner, Stephen P. Honsberg, Christiana B. TI Investigation of carrier dynamics in InAs/GaAsSb quantum dots with different silicon delta-doping levels SO SEMICONDUCTOR SCIENCE AND TECHNOLOGY LA English DT Article DE quantum dots; carrier dynamics; intermediate band solar cells; delta-doping ID BAND SOLAR-CELLS; CAPTURE AB The optical properties of InAs quantum dots (QDs) embedded in a GaAsSb matrix with different delta (delta)-doping levels of 0, 2, 4, and 6 electrons per dot (e(-)/dot), incorporated to control the occupation of QD electronic states, are studied by photoluminescence (PL) spectroscopy. The time-resolved PL data taken at 10 K reveal that the increase of delta-doping density from 2 to 6 e(-)/dot decreases the recombination lifetime of carriers at ground states of the QDs from 996 +/- 36 to 792 +/- 19 ps, respectively. Furthermore, the carrier lifetime of the sample with 4 e(-)/dot is found to increase at a slower rate than that of the undoped sample as temperature increases above 70 K. An Arrhenius plot of the temperature dependent PL intensity indicates that the thermal activation energy of electrons in the QDs, required for carrier escape from the dot ground state to continuum state, is increased when the delta-doping density is high enough (>4 e(-)/dot). These results are attributed to the enhanced Coulomb interaction of electrons provided by the delta-doping, leading to reduced thermal quenching of the PL. C1 [Ban, Keun-Yong; Honsberg, Christiana B.] Arizona State Univ, Sch Elect Comp & Energy Engn, Tempe, AZ 85287 USA. [Kim, Yeongho] Korea Res Inst Stand & Sci, Div Metrol Future Technol, Daejeon 305340, South Korea. [Kuciauskas, Darius] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Bremner, Stephen P.] Univ New South Wales, Sch Photovolta & Renewable Energy Engn, Sydney, NSW 2052, Australia. RP Kim, Y (reprint author), Korea Res Inst Stand & Sci, Div Metrol Future Technol, Daejeon 305340, South Korea. EM ykim172@kriss.re.kr FU National Science Foundation [EEC-1041895]; Department of Energy [EEC-1041895]; Australian Research Council [DP130104231]; Korea Institute of Energy Technology Evaluation and Planning (KETEP); Ministry of Trade, Industry & Energy (MOTIE) of the Republic of Korea [20163030013380] FX This work is in part supported by the National Science Foundation and Department of Energy under Cooperative Agreement No. EEC-1041895. This work is partly funded through the Australian Research Council through Discovery Project DP130104231. This work was supported by the Korea Institute of Energy Technology Evaluation and Planning (KETEP) and the Ministry of Trade, Industry & Energy (MOTIE) of the Republic of Korea (No. 20163030013380). NR 19 TC 0 Z9 0 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0268-1242 EI 1361-6641 J9 SEMICOND SCI TECH JI Semicond. Sci. Technol. PD DEC PY 2016 VL 31 IS 12 AR 125010 DI 10.1088/0268-1242/31/12/125010 PG 5 WC Engineering, Electrical & Electronic; Materials Science, Multidisciplinary; Physics, Condensed Matter SC Engineering; Materials Science; Physics GA EN5KY UT WOS:000396045500004 ER PT J AU Baranowski, LL Zawadzki, P Lany, S Toberer, ES Zakutayev, A AF Baranowski, Lauryn L. Zawadzki, Pawel Lany, Stephan Toberer, Eric S. Zakutayev, Andriy TI A review of defects and disorder in multinary tetrahedrally bonded semiconductors SO SEMICONDUCTOR SCIENCE AND TECHNOLOGY LA English DT Review DE thin film deposition; density functional theory; Earth abundant materials; next generation photovoltaics; compound semiconductors; point defects; cation site disorder ID FILM SOLAR-CELLS; CU2SNS3 THIN-FILM; CU-SN-S; OPTICAL-PROPERTIES; ENERGY CONVERSION; SI-SIO2 INTERFACE; CHALCOPYRITE; PHOTOVOLTAICS; SPECTROSCOPY; DEPOSITION AB Defects are critical to understanding the electronic properties of semiconducting compounds, for applications such as light-emitting diodes, transistors, photovoltaics, and thermoelectrics. In this review, we describe our work investigating defects in tetrahedrally bonded, multinary semiconductors, and discuss the place of our research within the context of publications by other groups. We applied experimental and theory techniques to understand point defects, structural disorder, and extended antisite defects in one semiconductor of interest for photovoltaic applications, Cu2SnS3. We contrast our findings on Cu2SnS3 with other chemically related CuSn- S compounds, as well as structurally related compounds such as Cu2ZnSnS4 and Cu(In, Ga) Se-2. We find that evaluation of point defects alone is not sufficient to understand defect behavior in multinary tetrahedrally bonded semiconductors. In the case of Cu2SnS3 and Cu2ZnSnS4, structural disorder and entropy-driven cation clustering can result in nanoscale compositional inhomogeneities which detrimentally impact the electronic transport. Therefore, it is not sufficient to assess only the point defect behavior of new multinary tetrahedrally bonded compounds; effects such as structural disorder and extended antisite defects must also be considered. Overall, this review provides a framework for evaluating tetrahedrally bonded semiconducting compounds with respect to their defect behavior for photovoltaic and other applications, and suggests new materials that may not be as prone to such imperfections. C1 [Baranowski, Lauryn L.; Zawadzki, Pawel; Lany, Stephan; Toberer, Eric S.; Zakutayev, Andriy] Natl Renewable Energy Lab, Golden, CO 80401 USA. [Baranowski, Lauryn L.; Toberer, Eric S.] Colorado Sch Mines, Golden, CO 80401 USA. RP Zakutayev, A (reprint author), Natl Renewable Energy Lab, Golden, CO 80401 USA. EM l.l.baranowski@gmail.com; andriy.zakutayev@nrel.gov FU US Department of Energy, Office of Energy Efficiency and Renewable Energy, as a part of the 'Rapid Development of Earth-Abundant Thin Film Solar Cells' [DE-AC36-08GO28308]; Department of Defense through the National Defense Science and Engineering Graduate Fellowship Program; NSF MRSEC program, REMRSEC Center [DMR 0820518] FX This work was supported by the US Department of Energy, Office of Energy Efficiency and Renewable Energy, as a part of the 'Rapid Development of Earth-Abundant Thin Film Solar Cells' agreement, under contract No. DE-AC36-08GO28308 to NREL. LLB was supported by the Department of Defense through the National Defense Science and Engineering Graduate Fellowship Program. EST acknowledges support from the NSF MRSEC program, REMRSEC Center, Grant No. DMR 0820518. Thanks to Hannes Hempel of Helmholtz-Zentrum Berlin for providing artwork for figure 11(a). NR 89 TC 0 Z9 0 U1 5 U2 5 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0268-1242 EI 1361-6641 J9 SEMICOND SCI TECH JI Semicond. Sci. Technol. PD DEC PY 2016 VL 31 IS 12 AR 123004 DI 10.1088/0268-1242/31/12/123004 PG 16 WC Engineering, Electrical & Electronic; Materials Science, Multidisciplinary; Physics, Condensed Matter SC Engineering; Materials Science; Physics GA EN5KT UT WOS:000396045000003 ER PT J AU Anderson, J Bauer, K Borga, A Boterenbrood, H Chen, H Chen, K Drake, G Donszelmann, M Francis, D Guest, D Gorini, B Joos, M Lanni, F Miotto, GL Levinson, L Narevicius, J Vazquez, WP Roich, A Ryu, S Schreuder, F Schumacher, J Vandelli, W Vermeulen, J Whiteson, D Wu, W Zhang, J AF Anderson, J. Bauer, K. Borga, A. Boterenbrood, H. Chen, H. Chen, K. Drake, G. Donszelmann, M. Francis, D. Guest, D. Gorini, B. Joos, M. Lanni, F. Miotto, G. Lehmann Levinson, L. Narevicius, J. Vazquez, W. Panduro Roich, A. Ryu, S. Schreuder, F. Schumacher, J. Vandelli, W. Vermeulen, J. Whiteson, D. Wu, W. Zhang, J. TI FELIX: a PCIe based high-throughput approach for interfacing front-end and trigger electronics in the ATLAS Upgrade framework SO JOURNAL OF INSTRUMENTATION LA English DT Article DE Data acquisition circuits; Data acquisition concepts AB The ATLAS Phase-I upgrade (2019) requires a Trigger and Data Acquisition (TDAQ) system able to trigger and record data from up to three times the nominal LHC instantaneous luminosity. The Front-End LInk eXchange (FELIX) system provides an infrastructure to achieve this in a scalable, detector agnostic and easily upgradeableway. It is a PC-based gateway, interfacing custom radiation tolerant optical links from front-end electronics, via PCIe Gen3 cards, to a commodity switched Ethernet or InfiniBand network. FELIX enables reducing custom electronics in favour of software running on commercial servers. The FELIX system, the design of the PCIe prototype card and the integration test results are presented in this paper. C1 [Anderson, J.; Drake, G.; Ryu, S.; Zhang, J.] Argonne Natl Lab, 9700 South Cass Ave B109, Lemont, IL 60439 USA. [Chen, H.; Chen, K.; Lanni, F.; Wu, W.] Brookhaven Natl Lab, POB 5000, Upton, NY 11973 USA. [Bauer, K.; Whiteson, D.] Univ Calif Irvine, Irvine, CA 92697 USA. [Francis, D.; Gorini, B.; Joos, M.; Miotto, G. Lehmann; Schumacher, J.; Vandelli, W.] CERN, CH-1211 Geneva 23, Switzerland. [Vazquez, W. Panduro] Royal Holloway Univ London, Egham Hill, Egham TW20 0EX, Surrey, England. [Borga, A.; Boterenbrood, H.; Schreuder, F.] Univ Amsterdam, Nikhef Natl Inst Subat Phys, Sci Pk 105, NL-1098 XG Amsterdam, Netherlands. [Schumacher, J.] Univ Paderborn, Dept Comp Sci, Pohlweg 47, D-33098 Paderborn, Germany. [Levinson, L.; Narevicius, J.; Roich, A.] Weizmann Inst Sci, Dept Particle Phys, IL-76100 Rehovot, Israel. [Donszelmann, M.] Radboud Univ Nijmegen, Comeniuslaan 4, NL-6525 HP Nijmegen, Netherlands. RP Chen, K (reprint author), Brookhaven Natl Lab, POB 5000, Upton, NY 11973 USA. EM kchen@bnl.gov NR 21 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1748-0221 J9 J INSTRUM JI J. Instrum. PD DEC PY 2016 VL 11 AR C12023 DI 10.1088/1748-0221/11/12/C12023 PG 10 WC Instruments & Instrumentation SC Instruments & Instrumentation GA EN0WJ UT WOS:000395731900023 ER PT J AU Arduini, G Barranco, J Bertarelli, A Biancacci, N Bruce, R Bruning, O Buffat, X Cai, Y Carver, LR Fartoukh, S Giovannozzi, M Iadarola, G Li, K Lechner, A Medrano, LM Metral, E Nosochkov, Y Papaphilippou, Y Pellegrini, D Pieloni, T Qiang, J Redaelli, S Romano, A Rossi, L Rumolo, G Salvant, B Schenk, M Tambasco, C Tomas, R Valishev, S Van der Veken, FF AF Arduini, G. Barranco, J. Bertarelli, A. Biancacci, N. Bruce, R. Bruning, O. Buffat, X. Cai, Y. Carver, L. R. Fartoukh, S. Giovannozzi, M. Iadarola, G. Li, K. Lechner, A. Medrano, L. Medina Metral, E. Nosochkov, Y. Papaphilippou, Y. Pellegrini, D. Pieloni, T. Qiang, J. Redaelli, S. Romano, A. Rossi, L. Rumolo, G. Salvant, B. Schenk, M. Tambasco, C. Tomas, R. Valishev, S. Van der Veken, F. F. TI High Luminosity LHC: challenges and plans SO JOURNAL OF INSTRUMENTATION LA English DT Article DE Accelerator Subsystems and Technologies; Beam dynamics AB The Large Hadron Collider (LHC) is one of the largest scientific instruments ever built. Since opening up a new energy frontier for exploration in 2010, it has gathered a global user community working in fundamental particle physics and the physics of hadronic matter at extreme temperature and density. To sustain and extend its discovery potential, the LHC will undergo a major upgrade in the 2020s. This will increase its rate of collisions by a factor of five beyond the original design value and the integrated luminosity by a factor ten. The new configuration, known as High Luminosity LHC (HL-LHC), will rely on a number of key innovations that push accelerator technology beyond its present limits. Among these are cutting-edge 11 12 T superconducting magnets, including Nb3Sn-based magnets never used in accelerators before, compact superconducting cavities for longitudinal beam rotation, new technology and physical processes for beam collimation. The dynamics of the HL-LHC beams will be also particularly challenging and this aspect is the main focus of this paper. C1 [Arduini, G.; Barranco, J.; Bertarelli, A.; Biancacci, N.; Bruce, R.; Bruning, O.; Buffat, X.; Carver, L. R.; Fartoukh, S.; Giovannozzi, M.; Iadarola, G.; Li, K.; Lechner, A.; Medrano, L. Medina; Metral, E.; Papaphilippou, Y.; Pellegrini, D.; Pieloni, T.; Redaelli, S.; Romano, A.; Rossi, L.; Rumolo, G.; Salvant, B.; Schenk, M.; Tambasco, C.; Tomas, R.; Van der Veken, F. F.] CERN, Accelerator & Technol Sect, 385 Route Meyrin, CH-1217 Meyrin, Switzerland. [Cai, Y.; Nosochkov, Y.] SLAC Natl Accelerator Lab, Accelerator Res Div, 2575 Sand Hill Rd, Menlo Pk, CA 94025 USA. [Qiang, J.] Laurence Berkeley Natl Lab, Accelerator Technol & Appl Phys Div, 1 Cyclotron Rd, Berkeley, CA 94720 USA. [Valishev, S.] Fermilab Natl Accelerator Lab, Accelerator Div, POB 500, Batavia, IL 60510 USA. RP Giovannozzi, M (reprint author), CERN, Accelerator & Technol Sect, 385 Route Meyrin, CH-1217 Meyrin, Switzerland. EM massimo.giovannozzi@cern.ch NR 42 TC 0 Z9 0 U1 2 U2 2 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1748-0221 J9 J INSTRUM JI J. Instrum. PD DEC PY 2016 VL 11 AR C12081 DI 10.1088/1748-0221/11/12/C12081 PG 13 WC Instruments & Instrumentation SC Instruments & Instrumentation GA EN0WJ UT WOS:000395731900081 ER PT J AU Contin, G AF Contin, G. CA STAR Collaboration TI The STAR PXL detector SO JOURNAL OF INSTRUMENTATION LA English DT Article DE Large detector systems for particle and astroparticle physics; Particle tracking detectors (Solid-state detectors); Solid state detectors; Radiation damage to detector materials (solid state) ID COLLISIONS; MAPS AB The PiXeL detector (PXL) of the STAR experiment at RHIC is the first application of the state-of-the-art thin Monolithic Active Pixel Sensors ( MAPS) technology in a collider environment. Designed to extend the STAR measurement capabilities in the heavy flavor domain, it took data in Au+Au collisions, p+p and p+Au collisions at root sNN = 200 GeV at RHIC, during the period 2014- 2016. The PXL detector is based on 50 mu m-thin MAPS sensors with a pitch of 20.7 mu m. Each sensor includes an array of nearly 1 million pixels, read out in rolling shutter mode in 185.6 mu s. The 170 mW/cm(2) power dissipation allows for air cooling and contributes to reduce the global material budget to 0.4% radiation length on the innermost layer. Experience and lessons learned from construction and operations will be presented in this paper. Detector performance and results from 2014 Au+Au data analysis, demonstrating the STAR capabilities of charm reconstruction, will be shown. C1 [Contin, G.; STAR Collaboration] Lawrence Berkeley Natl Lab, 1 Cyclotron Rd, Berkeley, CA 94720 USA. RP Contin, G (reprint author), Lawrence Berkeley Natl Lab, 1 Cyclotron Rd, Berkeley, CA 94720 USA. EM gcontin@lbl.gov FU Office of Science, Office of Nuclear Science of the U.S. Department of Energy [DE-AC02-05CH11231] FX This work was supported by the Director, Office of Science, Office of Nuclear Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. We gratefully acknowledge the PICSEL group of IPHC Strasbourg (M. Winter et al.) for the development of the PXL detector sensors. NR 11 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1748-0221 J9 J INSTRUM JI J. Instrum. PD DEC PY 2016 VL 11 AR C12068 DI 10.1088/1748-0221/11/12/C12068 PG 9 WC Instruments & Instrumentation SC Instruments & Instrumentation GA EN0WJ UT WOS:000395731900068 ER PT J AU Demaria, N Barbero, MB Fougeron, D Gensolen, F Godiot, S Menouni, M Pangaud, P Rozanov, A Wang, A Bomben, M Calderini, G Crescioli, F Le Dortz, O Marchiori, G Dzahini, D Rarbi, FE Gaglione, R Gonella, L Hemperek, T Huegging, F Karagounis, M Kishishita, T Krueger, H Rymaszewski, P Wermes, N Ciciriello, F Corsi, F Marzocca, C De Robertis, G Loddo, F Licciulli, F Andreazza, A Liberali, V Shojaii, S Stabile, A Bagatin, M Bisello, D Mattiazzo, S Ding, L Gerardin, S Giubilato, P Neviani, A Paccagnella, A Vogrig, D Wyss, J Bacchetta, N De Canio, F Gaioni, L Nodari, B Manghisoni, M Re, V Traversi, G Comotti, D Ratti, L Vacchi, C Beccherle, R Bellazzini, R Magazzu, G Minuti, M Morsani, F Palla, F Poulios, S Fanucci, L Rizzi, A Saponara, S Androsov, K Bilei, GM Menichelli, M Conti, E Marconi, S Passeri, D Placidi, P Della Casa, G Mazza, G Rivetti, A Rolo, MDDR Monteil, E Pacher, L Gajanana, D Gromov, V Hessey, N Kluit, R Zivkovic, V Havranek, M Janoska, Z Marcisovsky, M Neue, G Tomasek, L Kafka, V Sicho, P Vrba, V Vila, I Lopez-Morillo, E Aguirre, MA Palomo, FR Munoz, F Abbaneo, D Christiansen, J Dannheim, D Dobos, D Linssen, L Pernegger, H Valerio, P Tehrani, NA Bell, S Prydderch, ML Thomas, S Christian, DC Fahim, F Hoff, J Lipton, R Liu, T Zimmerman, T Garcia-Sciveres, M Gnani, D Mekkaoui, A Gorelov, I Hoeferkamp, M Seidel, S Toms, K De Witt, JN Grillo, A Paterno, A AF Demaria, N. Barbero, M. B. Fougeron, D. Gensolen, F. Godiot, S. Menouni, M. Pangaud, P. Rozanov, A. Wang, A. Bomben, M. Calderini, G. Crescioli, F. Le Dortz, O. Marchiori, G. Dzahini, D. Rarbi, F. E. Gaglione, R. Gonella, L. Hemperek, T. Huegging, F. Karagounis, M. Kishishita, T. Krueger, H. Rymaszewski, P. Wermes, N. Ciciriello, F. Corsi, F. Marzocca, C. De Robertis, G. Loddo, F. Licciulli, F. Andreazza, A. Liberali, V. Shojaii, S. Stabile, A. Bagatin, M. Bisello, D. Mattiazzo, S. Ding, L. Gerardin, S. Giubilato, P. Neviani, A. Paccagnella, A. Vogrig, D. Wyss, J. Bacchetta, N. De Canio, F. Gaioni, L. Nodari, B. Manghisoni, M. Re, V. Traversi, G. Comotti, D. Ratti, L. Vacchi, C. Beccherle, R. Bellazzini, R. Magazzu, G. Minuti, M. Morsani, F. Palla, F. Poulios, S. Fanucci, L. Rizzi, A. Saponara, S. Androsov, K. Bilei, G. M. Menichelli, M. Conti, E. Marconi, S. Passeri, D. Placidi, P. Della Casa, G. Mazza, G. Rivetti, A. Rolo, M. D. Da Rocha Monteil, E. Pacher, L. Gajanana, D. Gromov, V. Hessey, N. Kluit, R. Zivkovic, V. Havranek, M. Janoska, Z. Marcisovsky, M. Neue, G. Tomasek, L. Kafka, V. Sicho, P. Vrba, V. Vila, I. Lopez-Morillo, E. Aguirre, M. A. Palomo, F. R. Munoz, F. Abbaneo, D. Christiansen, J. Dannheim, D. Dobos, D. Linssen, L. Pernegger, H. Valerio, P. Tehrani, N. Alipour Bell, S. Prydderch, M. L. Thomas, S. Christian, D. C. Fahim, F. Hoff, J. Lipton, R. Liu, T. Zimmerman, T. Garcia-Sciveres, M. Gnani, D. Mekkaoui, A. Gorelov, I. Hoeferkamp, M. Seidel, S. Toms, K. De Witt, J. N. Grillo, A. Paterno, A. TI Recent progress of RD53 Collaboration towards next generation Pixel Read-Out Chip for HL-LHC SO JOURNAL OF INSTRUMENTATION LA English DT Article DE Front-end electronics for detector readout; Particle tracking detectors (Solid-state detectors); Radiation-hard electronics; VLSI circuits AB This paper is a review of recent progress of RD53 Collaboration. Results obtained on the study of the radiation effects on 65 nm CMOS have matured enough to define first strategies to adopt in the design of analog and digital circuits. Critical building blocks and analog very front end chains have been designed, tested before and after 5-800 Mrad. Small prototypes of 64 x 64 pixels with complex digital architectures have been produced, and point to address the main issues of dealing with extremely high pixel rates, while operating at very small in-time thresholds in the analog front end. The collaboration is now proceeding at full speed towards the design of a large scale prototype, called RD53A, in 65 nm CMOS technology. C1 [Demaria, N.; Della Casa, G.; Mazza, G.; Rivetti, A.; Rolo, M. D. Da Rocha] INFN Torino, VP Giuria 1, I-10125 Turin, Italy. [Barbero, M. B.; Fougeron, D.; Gensolen, F.; Godiot, S.; Menouni, M.; Pangaud, P.; Rozanov, A.; Wang, A.] Aix Marseille Univ, CNRS, IN2P3, CPPM UMR 7346, F-13288 Marseille, France. [Bomben, M.; Calderini, G.; Crescioli, F.; Le Dortz, O.; Marchiori, G.] LPNHE, Paris, France. [Dzahini, D.; Rarbi, F. E.] LPSC, Grenoble, France. [Gaglione, R.] Lab Annecy Le Vieux Phys Particules, Annecy Le Vieux, France. [Gonella, L.; Hemperek, T.; Huegging, F.; Karagounis, M.; Kishishita, T.; Krueger, H.; Rymaszewski, P.; Wermes, N.] Rhein Friedrich Wilhelms Univ Bonn, Inst Phys, Bonn, Germany. [Ciciriello, F.; Corsi, F.; Marzocca, C.] Politecn Bari, Bari, Italy. [De Robertis, G.; Loddo, F.; Licciulli, F.] Ist Nazl Fis Nucl, Sez Bari, Bari, Italy. [Andreazza, A.; Liberali, V.; Shojaii, S.; Stabile, A.] Ist Nazl Fis Nucl, Sez Milano, Milan, Italy. [Andreazza, A.; Liberali, V.; Shojaii, S.; Stabile, A.] Univ Milan, Milan, Italy. [Bagatin, M.; Bisello, D.; Mattiazzo, S.; Ding, L.; Gerardin, S.; Giubilato, P.; Neviani, A.; Paccagnella, A.; Vogrig, D.; Wyss, J.; Bacchetta, N.] Ist Nazl Fis Nucl, Sez Padova, Padua, Italy. [Bagatin, M.; Bisello, D.; Mattiazzo, S.; Ding, L.; Gerardin, S.; Giubilato, P.; Neviani, A.; Paccagnella, A.; Vogrig, D.; Wyss, J.] Univ Padua, Padua, Italy. [De Canio, F.; Gaioni, L.; Nodari, B.; Manghisoni, M.; Re, V.; Traversi, G.; Comotti, D.; Ratti, L.; Vacchi, C.] Ist Nazl Fis Nucl, Sez Pavia, Bergamo, Italy. [De Canio, F.; Gaioni, L.; Nodari, B.; Manghisoni, M.; Re, V.; Traversi, G.] Univ Bergamo, Bergamo, Italy. [Comotti, D.; Ratti, L.; Vacchi, C.] Univ Pavia, Pavia, Italy. [Beccherle, R.; Bellazzini, R.; Magazzu, G.; Minuti, M.; Morsani, F.; Palla, F.; Poulios, S.; Fanucci, L.; Rizzi, A.; Saponara, S.] Ist Nazl Fis Nucl, Sez Pisa, Pisa, Italy. [Fanucci, L.; Rizzi, A.; Saponara, S.] Univ Pisa, Pisa, Italy. [Androsov, K.] INFN Pisa, Siena, Italy. [Androsov, K.] Univ Siena, Siena, Italy. [Bilei, G. M.; Menichelli, M.; Conti, E.; Marconi, S.; Passeri, D.; Placidi, P.] Ist Nazl Fis Nucl, Sez Perugia, Perugia, Italy. [Conti, E.; Marconi, S.; Passeri, D.; Placidi, P.] Univ Perugia, Dept Engn, I-06100 Perugia, Italy. [Monteil, E.; Pacher, L.; Paterno, A.] Ist Nazl Fis Nucl, Sez Torino, Turin, Italy. [Monteil, E.; Pacher, L.] Univ Turin, Turin, Italy. [Gajanana, D.; Gromov, V.; Hessey, N.; Kluit, R.; Zivkovic, V.] NIKHEF, Natl Inst Subatom Phys, Amsterdam, Netherlands. [Havranek, M.; Janoska, Z.; Marcisovsky, M.; Neue, G.; Tomasek, L.] Czech Tech Univ, Fac Nucl Sci & Phys Engn, Prague, Czech Republic. [Kafka, V.; Sicho, P.; Vrba, V.] Acad Sci Czech Republic, Inst Phys, Prague, Czech Republic. [Vila, I.] CSIC UC, Inst Fis Cantabria IFCA, Santander, Spain. [Lopez-Morillo, E.; Aguirre, M. A.; Palomo, F. R.; Munoz, F.] Univ Seville, Sch Engn, Dept Elect Engn, Seville, Spain. [Abbaneo, D.; Christiansen, J.; Dannheim, D.; Dobos, D.; Linssen, L.; Pernegger, H.; Valerio, P.; Tehrani, N. Alipour] CERN, European Org Nucl Res, Geneva, Switzerland. [Bell, S.; Prydderch, M. L.; Thomas, S.] Rutherford Appleton Lab, Sci & Technol Facil Council, Didcot, Oxon, England. [Christian, D. C.; Fahim, F.; Hoff, J.; Lipton, R.; Liu, T.; Zimmerman, T.] Fermilab Natl Accelerator Lab, POB 500, Batavia, IL 60510 USA. [Garcia-Sciveres, M.; Gnani, D.; Mekkaoui, A.] Lawrence Berkeley Natl Lab, Berkeley, CA USA. [Gorelov, I.; Hoeferkamp, M.; Seidel, S.; Toms, K.] Univ New Mexico, Albuquerque, NM 87131 USA. [De Witt, J. N.; Grillo, A.] Univ Calif Santa Cruz, Santa Cruz, CA 95064 USA. [Paterno, A.] Politecn Torino, Turin, Italy. RP Demaria, N (reprint author), INFN Torino, VP Giuria 1, I-10125 Turin, Italy. EM demaria@to.infn.it OI Liberali, Valentino/0000-0003-1333-6876; Giubilato, Piero/0000-0003-4358-5355; Re, Valerio/0000-0003-0697-3420 NR 14 TC 0 Z9 0 U1 1 U2 1 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1748-0221 J9 J INSTRUM JI J. Instrum. PD DEC PY 2016 VL 11 AR C12058 DI 10.1088/1748-0221/11/12/C12058 PG 9 WC Instruments & Instrumentation SC Instruments & Instrumentation GA EN0WJ UT WOS:000395731900058 ER PT J AU Pancheri, L Benkechcache, MEA Dalla Betta, GF Xu, H Verzellesi, G Ronchin, S Boscardin, M Ratti, L Grassi, M Lodola, L Malcovati, P Vacchi, C Manghisoni, M Re, V Traversi, G Batignani, G Bettarini, S Casarosa, G Giorgi, M Forti, F Paladino, A Paoloni, E Rizzo, G Morsani, F Fabris, L AF Pancheri, L. Benkechcache, M. E. A. Dalla Betta, G. -F. Xu, H. Verzellesi, G. Ronchin, S. Boscardin, M. Ratti, L. Grassi, M. Lodola, L. Malcovati, P. Vacchi, C. Manghisoni, M. Re, V. Traversi, G. Batignani, G. Bettarini, S. Casarosa, G. Giorgi, M. Forti, F. Paladino, A. Paoloni, E. Rizzo, G. Morsani, F. Fabris, L. TI First experimental results on active and slim-edge silicon sensors for XFEL SO JOURNAL OF INSTRUMENTATION LA English DT Article DE Instrumentation for FEL; Solid state detectors; X-ray detectors AB This work presents the first characterization results obtained on a pilot fabrication run of planar sensors, tailored for X-ray imaging applications at FELs, developed in the framework of INFN project PixFEL. Active and slim-edge p-on-n sensors are fabricated on n-type high-resistivity silicon with 450 mu m thickness, bonded to a support wafer. Both diodes and pixelated sensors with a pitch of 110 mu m are included in the design. Edge structures with different number of guard rings are designed to comply with the large bias voltage required by the application after accumulating an ionizing radiation dose as large as 1GGy. Preliminary results from the electrical characterization of the produced sensors, providing a first assessment of the proposed approach, are discussed. A functional characterization of the sensors with a pulsed infrared laser is also presented, demonstrating the validity of slim-edge configurations. C1 [Pancheri, L.; Benkechcache, M. E. A.; Dalla Betta, G. -F.; Xu, H.] Univ Trento, Dipartimento Ingn Ind, I-38123 Trento, Italy. [Pancheri, L.; Benkechcache, M. E. A.; Dalla Betta, G. -F.; Xu, H.; Verzellesi, G.; Ronchin, S.; Boscardin, M.] TIFPA, I-38123 Trento, Italy. [Verzellesi, G.] Univ Modena & Reggio Emilia, I-41121 Modena, Italy. [Ronchin, S.; Boscardin, M.] Fdn Bruno Kessler, Trento, Italy. [Grassi, M.; Lodola, L.; Malcovati, P.; Vacchi, C.] Univ Pavia, Dipartimento Ingn Ind & Informaz, I-27100 Pavia, Italy. [Ratti, L.; Grassi, M.; Lodola, L.; Malcovati, P.; Vacchi, C.; Manghisoni, M.; Re, V.; Traversi, G.] INFN Sezione Pavia, I-27100 Pavia, Italy. [Manghisoni, M.; Re, V.] Univ Bergamo, Dipartimento Ingn & Sci Applicate, I-24044 Dalmine, Italy. [Batignani, G.; Bettarini, S.; Casarosa, G.; Giorgi, M.; Forti, F.; Paladino, A.; Paoloni, E.] Univ Pisa, Dipartimento Fis, I-56127 Pisa, Italy. [Bettarini, S.; Casarosa, G.; Giorgi, M.; Forti, F.; Paladino, A.; Paoloni, E.; Rizzo, G.; Morsani, F.] INFN Sezione Pisa, I-56127 Pisa, Italy. [Fabris, L.] Oak Ridge Natl Lab, Oak Ridge, TN USA. RP Pancheri, L (reprint author), Univ Trento, Dipartimento Ingn Ind, I-38123 Trento, Italy. EM lucio.pancheri@unitn.it RI Malcovati, Piero/S-2458-2016; OI Malcovati, Piero/0000-0001-6514-9672; Re, Valerio/0000-0003-0697-3420 FU Istituto Nazionale di Fisica Nucleare (INFN) FX The research activity presented in this paper has been carried out in the framework of the PixFEL experiment funded by Istituto Nazionale di Fisica Nucleare (INFN). NR 7 TC 0 Z9 0 U1 0 U2 0 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1748-0221 J9 J INSTRUM JI J. Instrum. PD DEC PY 2016 VL 11 AR C12018 DI 10.1088/1748-0221/11/12/C12018 PG 8 WC Instruments & Instrumentation SC Instruments & Instrumentation GA EN0WJ UT WOS:000395731900018 ER PT J AU Liu, Y Meliopoulos, AP Sun, LY Fan, R AF Liu, Yu Meliopoulos, A. P. Sun, Liangyi Fan, Rui TI Dynamic State Estimation Based Protection of Mutually Coupled Transmission Lines SO CSEE JOURNAL OF POWER AND ENERGY SYSTEMS LA English DT Article DE Estimation based protection (EBP); high impedance faults; inter-circuit faults; mutually coupled lines; partial coupling ID DISTANCE RELAYING SCHEME; WAVELET TRANSFORM; PARALLEL; FAULTS AB Mutually coupled lines create challenges for legacy protection schemes. In this paper, a dynamic state estimation based protection (EBP) method is proposed to address these challenges. The method requires GPS synchronized measurements at both ends of the line and a high fidelity model of the protected line. The paper presents the dynamic model of the protected line and its impact on the performance of the protection scheme. Numerical simulations prove that the method can correctly identify faults, independent of position and type. The work also demonstrates the advantages of the proposed method versus legacy protection functions such as distance protection and line differential. These advantages include reliable and faster detection of internal low impedance faults, inter-circuit faults, and high impedance faults, even in cases of 1) partially coupled lines and 2) lack of measurements in adjacent lines. C1 [Liu, Yu; Meliopoulos, A. P.; Sun, Liangyi] Georgia Inst Technol, Sch Elect & Comp Engn, Atlanta, GA 30332 USA. [Fan, Rui] Pacific Northwest Natl Lab, Richland, WA 99354 USA. RP Sun, LY (reprint author), Georgia Inst Technol, Sch Elect & Comp Engn, Atlanta, GA 30332 USA. EM lsun30@gatech.edu FU Electric Power Research Institute (EPRI); Power Systems Engineering Research Center (PSERC) FX This work was supported by the Electric Power Research Institute (EPRI) and the Power Systems Engineering Research Center (PSERC). NR 17 TC 1 Z9 1 U1 0 U2 0 PU CHINA ELECTRIC POWER RESEARCH INST PI BEIJING PA 15, QINGHE XIAOYING DONG LU, HAIDIAN-QU, BEIJING, 100192, PEOPLES R CHINA SN 2096-0042 J9 CSEE J POWER ENERGY JI CSEE J. Power Energy Syst. PD DEC PY 2016 VL 2 IS 4 BP 6 EP 14 DI 10.17775/CSEEJPES.2016.00043 PG 9 WC Engineering, Electrical & Electronic SC Engineering GA EM4XR UT WOS:000395316900002 ER PT J AU West, RD Gunther, JH Moon, TK AF West, R. Derek Gunther, Jacob H. Moon, Todd K. TI Inverse Problems-Based Maximum Likelihood Estimation of Ground Reflectivity for Selected Regions of Interest from Stripmap SAR Data SO IEEE TRANSACTIONS ON AEROSPACE AND ELECTRONIC SYSTEMS LA English DT Article ID IMAGE-FORMATION AB In this paper, we derive a comprehensive forward model for the data collected by stripmap synthetic aperture radar (SAR) that is linear in the ground reflectivity parameters. It is also shown that if the noise model is additive, then the forward model fits into the linear statistical model framework, and the ground reflectivity parameters can be estimated by statistical methods. We derive the maximum likelihood (ML) estimates for the ground reflectivity parameters in the case of additive white Gaussian noise. Furthermore, we show that obtaining the ML estimates of the ground reflectivity requires two steps. The first step amounts to a cross-correlation of the data with a model of the data acquisition parameters, and it is shown that this step has essentially the same processing as the so-called convolution back-projection algorithm. The second step is a complete system inversion that is capable of mitigating the sidelobes of the spatially variant impulse responses remaining after the correlation processing. We also state the Cramer-Rao lower bound (CRLB) for the ML ground reflectivity estimates. We show that the CRLB is linked to the SAR system parameters, the flight path of the SAR sensor, and the image reconstruction grid. We demonstrate the ML image formation and the CRLB bound for synthetically generated data. C1 [West, R. Derek] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. [Gunther, Jacob H.; Moon, Todd K.] Utah State Univ, Elect & Comp Engn, 4120 Old Main Hill, Logan, UT 84322 USA. RP West, RD (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. EM r.d.west@aggiemail.usu.edu NR 20 TC 0 Z9 0 U1 0 U2 0 PU IEEE-INST ELECTRICAL ELECTRONICS ENGINEERS INC PI PISCATAWAY PA 445 HOES LANE, PISCATAWAY, NJ 08855-4141 USA SN 0018-9251 EI 1557-9603 J9 IEEE T AERO ELEC SYS JI IEEE Trans. Aerosp. Electron. Syst. PD DEC PY 2016 VL 52 IS 6 BP 2930 EP 2939 DI 10.1109/TAES.2016.140519 PG 10 WC Engineering, Aerospace; Engineering, Electrical & Electronic; Telecommunications SC Engineering; Telecommunications GA EN1XV UT WOS:000395804700025 ER PT J AU Castro-Castro, C Shen, YN Srinivasan, G Aceves, AB Kevrekidis, PG AF Castro-Castro, Claudia Shen, Yannan Srinivasan, Gowri Aceves, Alejandro B. Kevrekidis, Panayotis G. TI Light dynamics in nonlinear trimers and twisted multicore fibers SO JOURNAL OF NONLINEAR OPTICAL PHYSICS & MATERIALS LA English DT Article; Proceedings Paper CT 8th Conference on Nonlinear Guided Waves CY APR, 2016 CL Oaxaca, MEXICO DE Fiber optics; PT-symmetry; discrete NLS ID WAVE-GUIDE ARRAYS; SOLITONS AB Novel photonic structures such as multicore fibers and graphene based arrays present unique opportunities to manipulate and control the propagation of light. Here, we discuss nonlinear dynamics for structures with a few (2-6) elements for which linear and nonlinear properties can be tuned. Specifically, we show how nonlinearity, coupling, and parity-time (PT) symmetric gain/loss relate to existence, stability and in general, dynamical properties of nonlinear optical modes. The main emphasis of our presentation will be on systems with few degrees of freedom, most notably couplers, trimers and generalizations thereof to systems with six nodes. C1 [Castro-Castro, Claudia; Aceves, Alejandro B.] Southern Methodist Univ, Dept Math, Dallas, TX 75275 USA. [Shen, Yannan] Univ Calif Northridge, Dept Math, Northridge, CA 91330 USA. [Srinivasan, Gowri] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87544 USA. [Kevrekidis, Panayotis G.] Univ Massachusetts, Dept Math & Stat, Amherst, MA 01003 USA. RP Castro-Castro, C (reprint author), Southern Methodist Univ, Dept Math, Dallas, TX 75275 USA. EM ccastrocastr@smu.edu; yannan.shen@csun.edu FU LANL Grant [LA-UR-15-26399] FX Castro-Castro acknowledges partial support from LANL Grant No. LA-UR-15-26399. NR 12 TC 0 Z9 0 U1 2 U2 2 PU WORLD SCIENTIFIC PUBL CO PTE LTD PI SINGAPORE PA 5 TOH TUCK LINK, SINGAPORE 596224, SINGAPORE SN 0218-8635 EI 1793-6624 J9 J NONLINEAR OPT PHYS JI J. Nonlinear Opt. Phys. Mater. PD DEC PY 2016 VL 25 IS 4 AR 1650042 DI 10.1142/S0218863516500429 PG 12 WC Optics; Physics, Applied SC Optics; Physics GA EL9KO UT WOS:000394939300002 ER PT J AU Abraham, PE Yin, HF Borland, AM Weighill, D Lim, SD De Paoli, HC Engle, N Jones, PC Agh, R Weston, DJ Wullschleger, SD Tschaplinski, T Jacobson, D Cushman, JC Hettich, RL Tuskan, GA Yang, XH AF Abraham, Paul E. Yin, Hengfu Borland, Anne M. Weighill, Deborah Lim, Sung Don De Paoli, Henrique Cestari Engle, Nancy Jones, Piet C. Agh, Ryan Weston, David J. Wullschleger, Stan D. Tschaplinski, Timothy Jacobson, Daniel Cushman, John C. Hettich, Robert L. Tuskan, Gerald A. Yang, Xiaohan TI Transcript, protein and metabolite temporal dynamics in the CAM plant Agave SO NATURE PLANTS LA English DT Article ID CRASSULACEAN-ACID-METABOLISM; ARABIDOPSIS GUARD-CELLS; STOMATAL MOVEMENTS; REDOX HOMEOSTASIS; STRESS RESPONSES; SALT TOLERANCE; LIGHT; PHOTOSYNTHESIS; PATTERNS; LEAVES AB Already a proven mechanism for drought resilience, crassulacean acid metabolism (CAM) is a specialized type of photosynthesis that maximizes water-use efficiency by means of an inverse (compared to C-3 and C-4 photosynthesis) day/night pattern of stomatal closure/opening to shift CO2 uptake to the night, when evapotranspiration rates are low. A systems-level understanding of temporal molecular and metabolic controls is needed to define the cellular behaviour underpinning CAM. Here, we report high-resolution temporal behaviours of transcript, protein and metabolite abundances across a CAM diel cycle and, where applicable, compare the observations to the well-established C-3 model plant Arabidopsis. A mechanistic finding that emerged is that CAM operates with a diel redox poise that is shifted relative to that in Arabidopsis. Moreover, we identify widespread rescheduled expression of genes associated with signal transduction mechanisms that regulate stomatal opening/closing. Controlled production and degradation of transcripts and proteins represents a timing mechanism by which to regulate cellular function, yet knowledge of how this molecular timekeeping regulates CAM is unknown. Here, we provide new insights into complex post-transcriptional and -translational hierarchies that govern CAM in Agave. These data sets provide a resource to inform efforts to engineer more efficient CAM traits into economically valuable C-3 crops. C1 [Abraham, Paul E.; Hettich, Robert L.] Oak Ridge Natl Lab, Div Chem Sci, Oak Ridge, TN 37831 USA. [Yin, Hengfu; Borland, Anne M.; Weighill, Deborah; De Paoli, Henrique Cestari; Engle, Nancy; Jones, Piet C.; Agh, Ryan; Weston, David J.; Tschaplinski, Timothy; Jacobson, Daniel; Tuskan, Gerald A.; Yang, Xiaohan] Oak Ridge Natl Lab, Biosci Div, Oak Ridge, TN 37831 USA. [Borland, Anne M.] Univ Newcastle, Sch Biol, Newcastle Upon Tyne NE1 7RU, Tyne & Wear, England. [Weighill, Deborah; Jones, Piet C.; Jacobson, Daniel] Univ Tennessee, Bredesen Ctr Interdisciplinary Res & Grad Educ, Knoxville, TN 37996 USA. [Lim, Sung Don; Cushman, John C.] Univ Nevada, Dept Biochem & Mol Biol, MS330, Reno, NV 89557 USA. [Wullschleger, Stan D.] Oak Ridge Natl Lab, Div Environm Sci, Oak Ridge, TN 37831 USA. RP Yang, XH (reprint author), Oak Ridge Natl Lab, Biosci Div, Oak Ridge, TN 37831 USA. EM yangx@ornl.gov RI Yang, Xiaohan/A-6975-2011 OI Yang, Xiaohan/0000-0001-5207-4210 FU Department of Energy Office of Science Genomic Science Program [DE-SC0008834]; US Department of Energy [DE-AC05-00OR22725] FX This material is based on work supported by the Department of Energy Office of Science Genomic Science Program under award number DE-SC0008834. The authors would like to thank R. Giannone and M.A. Cushman for critical review and clarifying comments on the manuscript. This research used resources of the Compute and Data Environment for Science (CADES) and the Oak Ridge Leadership Computing Facility (OLCF) at the Oak Ridge National Laboratory. Oak Ridge National Laboratory is managed by UT-Battelle, LLC for the US Department of Energy (under contract number DE-AC05-00OR22725). NR 52 TC 1 Z9 1 U1 9 U2 9 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2055-026X EI 2055-0278 J9 NAT PLANTS JI Nat. Plants PD DEC PY 2016 VL 2 IS 12 AR 16178 DI 10.1038/NPLANTS.2016.178 PG 10 WC Plant Sciences SC Plant Sciences GA EN1TO UT WOS:000395793200001 PM 27869799 ER PT J AU Kirilovsky, D Kerfeld, CA AF Kirilovsky, Diana Kerfeld, Cheryl A. TI Cyanobacterial photoprotection by the orange carotenoid protein SO NATURE PLANTS LA English DT Review ID SYNECHOCYSTIS PCC 6803; PHOTOSYSTEM-II FLUORESCENCE; OCP-MEDIATED PHOTOPROTECTION; EXCITED-STATE PROPERTIES; N-TERMINAL DOMAIN; PHYCOBILISOME FLUORESCENCE; ENERGY-DISSIPATION; BINDING PROTEINS; SP PCC-6803; ARTHROSPIRA-MAXIMA AB In photosynthetic organisms, the production of dangerous oxygen species is stimulated under high irradiance. To cope with this stress, these organisms have evolved photoprotective mechanisms. One type of mechanism functions to decrease the energy arriving at the photochemical centres by increasing thermal dissipation at the level of antennae. In cyanobacteria, the trigger for this mechanism is the photoactivation of a soluble carotenoid protein, the orange carotenoid protein (OCP), which is a structurally and functionally modular protein. The inactive orange form (OCPo) is compact and globular, with the carotenoid spanning the effector and the regulatory domains. In the active red form (OCPr), the two domains are completely separated and the carotenoid has translocated entirely into the effector domain. The activated OCPr interacts with the phycobilisome (PBS), the cyanobacterial antenna, and induces excitation-energy quenching. A second protein, the fluorescence recovery protein (FRP), dislodges the active OCPr from the PBSs and accelerates its conversion to the inactive OCPo. C1 [Kirilovsky, Diana] Univ Paris Saclay, Univ Paris Sud, CNRS, CEA,I2BC, F-91198 Gif Sur Yvette, France. [Kirilovsky, Diana] CEA, Inst Biol & Technol Saclay iBiTec S, F-91191 Gif Sur Yvette, France. [Kerfeld, Cheryl A.] Michigan State Univ, MSU DOE Plant Res Lab, E Lansing, MI 48824 USA. [Kerfeld, Cheryl A.] Michigan State Univ, Dept Biochem & Mol Biol, E Lansing, MI 48824 USA. [Kerfeld, Cheryl A.] Univ Calif Berkeley, Dept Plant & Microbial Biol, Berkeley, CA 94720 USA. [Kerfeld, Cheryl A.] Lawrence Berkeley Natl Lab, Phys Biosci Div, Berkeley, CA 6 USA. [Kerfeld, Cheryl A.] Berkeley Synthet Biol Inst, Berkeley, CA 94720 USA. RP Kirilovsky, D (reprint author), Univ Paris Saclay, Univ Paris Sud, CNRS, CEA,I2BC, F-91198 Gif Sur Yvette, France.; Kirilovsky, D (reprint author), CEA, Inst Biol & Technol Saclay iBiTec S, F-91191 Gif Sur Yvette, France.; Kerfeld, CA (reprint author), Michigan State Univ, MSU DOE Plant Res Lab, E Lansing, MI 48824 USA.; Kerfeld, CA (reprint author), Michigan State Univ, Dept Biochem & Mol Biol, E Lansing, MI 48824 USA.; Kerfeld, CA (reprint author), Univ Calif Berkeley, Dept Plant & Microbial Biol, Berkeley, CA 94720 USA.; Kerfeld, CA (reprint author), Lawrence Berkeley Natl Lab, Phys Biosci Div, Berkeley, CA 6 USA.; Kerfeld, CA (reprint author), Berkeley Synthet Biol Inst, Berkeley, CA 94720 USA. EM diana.kirilovsky@cea.fr; ckerfeld@lbl.gov FU Commissariat a l'Energie Atomique; Centre National de la Recherche Scientifique; Agence Nationale de la Recherche (project CYANOPROTECT); EU network INTRO2; EU network HARVEST; Office of Science of the US Department of Energy [DE-FG02-91ER20021]; MSU AgBIO Research FX The authors thank M. Sutter for assistance in figure preparation. D.K. is supported by the Commissariat a l'Energie Atomique, the Centre National de la Recherche Scientifique, and the Agence Nationale de la Recherche (project CYANOPROTECT). D.K.'s work was also partially supported by EU networks INTRO2 and HARVEST. C.A.K. is supported by the Office of Science of the US Department of Energy DE-FG02-91ER20021 with infrastructure support from MSU AgBIO Research. The authors thank all of the students, collaborators and colleagues that were involved in the characterization of the structure and function of the OCP. NR 82 TC 0 Z9 0 U1 6 U2 6 PU NATURE PUBLISHING GROUP PI LONDON PA MACMILLAN BUILDING, 4 CRINAN ST, LONDON N1 9XW, ENGLAND SN 2055-026X EI 2055-0278 J9 NAT PLANTS JI Nat. Plants PD DEC PY 2016 VL 2 IS 12 AR 16180 DI 10.1038/NPLANTS.2016.180 PG 7 WC Plant Sciences SC Plant Sciences GA EN1TO UT WOS:000395793200003 PM 27909300 ER PT J AU Rigali, MJ Brady, PV Moore, RC AF Rigali, Mark J. Brady, Patrick V. Moore, Robert C. TI Radionuclide removal by apatite SO AMERICAN MINERALOGIST LA English DT Article DE Apatite; apatite; radionuclides; radionuclides; sorption; remediation ID NUCLEAR-WASTE FORMS; NANOCRYSTALLINE HYDROXYAPATITE; SYNTHETIC HYDROXYAPATITE; CONTAMINATED SEDIMENTS; BEARING BRITHOLITES; AQUEOUS-SOLUTIONS; ION-EXCHANGE; PHOSPHATE; URANIUM; SORPTION AB A growing body of research supports widespread future reliance on apatite for radioactive waste cleanup. Apatite is a multi-functional radionuclide sorbent that lowers dissolved radionuclide concentrations by surface sorption, ion exchange, surface precipitation, and by providing phosphate to precipitate low-solubility radionuclide-containing minerals. Natural apatites are rich in trace elements, and apatite's stability in the geologic record suggest that radionuclides incorporated into apatite, whether in a permeable reactive barrier or a waste form, are likely to remain isolated from the biosphere for long periods of time. Here we outline the mineralogic and surface origins of apatite-radionuclide reactivity and show how apatites might be used to environmental advantage in the future. C1 [Rigali, Mark J.; Brady, Patrick V.; Moore, Robert C.] Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. RP Rigali, MJ (reprint author), Sandia Natl Labs, POB 5800, Albuquerque, NM 87185 USA. EM mjrigal@sandia.gov FU U.S. Department of Energy's National Nuclear Security Administration [DE-AC04-94AL85000]; DOE Office of Nuclear Energy, Office of Used Nuclear Fuel Disposition; DOE Office of Legacy Management FX Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. This work is supported by DOE Office of Nuclear Energy, Office of Used Nuclear Fuel Disposition and DOE Office of Legacy Management. NR 96 TC 0 Z9 0 U1 2 U2 2 PU MINERALOGICAL SOC AMER PI CHANTILLY PA 3635 CONCORDE PKWY STE 500, CHANTILLY, VA 20151-1125 USA SN 0003-004X EI 1945-3027 J9 AM MINERAL JI Am. Miner. PD DEC PY 2016 VL 101 IS 12 BP 2611 EP 2619 DI 10.2138/am-2016-5769 PG 9 WC Geochemistry & Geophysics; Mineralogy SC Geochemistry & Geophysics; Mineralogy GA EI2BP UT WOS:000392291600003 ER PT J AU Ganne, J Feng, XJ Rey, P De Andrade, V AF Ganne, Jerome Feng, Xiaojun Rey, Patrice De Andrade, Vincent TI Statistical petrology reveals a link between supercontinents cycle and mantle global climate SO AMERICAN MINERALOGIST LA English DT Article DE Pangea supercontinent; mantle heating; magma thermicity; global cycles; geostatistics ID BILLION YEARS AGO; FRACTIONAL CRYSTALLIZATION; FLOOD BASALTS; CONVECTION; MAGMAS; EVOLUTION; MODELS; THERMOMETERS; EQUILIBRIUM; GEODYNAMICS AB The breakup of supercontinents is accompanied by the emplacement of continental flood basalts and dike swarms, the origin of which is often attributed to mantle plumes. However, convection modeling has showed that the formation of supercontinents result in the warming of the sub-continental asthenospheric mantle (SCAM), which could also explain syn-breakup volcanism. Temperature variations during the formation then breakup of supercontinents are therefore fundamental to understand volcanism related to supercontinent cycles. Magmatic minerals record the thermal state of their magmatic sources. Here we present a data mining analysis on the first global compilation of chemical information on magmatic rocks and minerals formed over the past 600 million years: a time period spanning the aggregation and breakup of Pangea, the last supercontinent. We show that following a period of increasingly hotter Mgrich magmatism with dominant tholeiitic affinity during the aggregation of Pangea, lower-temperature minerals crystallized within Mg-poorer magma with a dominant calc-alkaline affinity during Pangea disassembly. These trends reflect temporal changes in global mantle climate and global plate tectonics in response to continental masses assembly and dispersal. We also show that the final amalgamation of Pangea at similar to 300 Myr led to a long period of lithospheric collapse and cooling until the major step of Pangea disassembly started at similar to 125 Myr. The geological control on the geosphere magma budget has implications on the oxidation state and temperature of the Earth's outer envelopes in the Phanerozoic and may have exerted indirect influence on the evolution of climate and life on Earth. C1 [Ganne, Jerome; Feng, Xiaojun] Univ Toulouse 3, UR 234, IRD, 14 Ave Edouard Belin, F-31400 Toulouse, France. [Rey, Patrice] Univ Sydney, Sch Geosci, Earthbyte Res Grp, Sydney, NSW 2006, Australia. [De Andrade, Vincent] Argonne Natl Lab, 9700 South Cass Ave, Lemont, IL 60439 USA. RP Ganne, J (reprint author), Univ Toulouse 3, UR 234, IRD, 14 Ave Edouard Belin, F-31400 Toulouse, France. EM ganne@get.obs-mip.fr FU IRD; INSU-CNRS FX The project was supported by IRD and INSU-CNRS research funds. Keith Putirka, Richard Ernst, and three anonymous reviewers are warmly thanked for their stimulating reviews and for the wonderfully spirited exchange of ideas (in sometimes mutual skepticism) surrounding data interpretation. Comments by Blair Schoene and an anonymous reviewer on an early draft of this paper are gratefully acknowledged. They are thanked for providing helpful comments and suggestions. Final thanks go to H. McFarlane and I. Swainson for their great editing work on the manuscript. NR 44 TC 0 Z9 0 U1 2 U2 2 PU MINERALOGICAL SOC AMER PI CHANTILLY PA 3635 CONCORDE PKWY STE 500, CHANTILLY, VA 20151-1125 USA SN 0003-004X EI 1945-3027 J9 AM MINERAL JI Am. Miner. PD DEC PY 2016 VL 101 IS 12 BP 2768 EP 2773 DI 10.2138/am-2016-5868 PG 6 WC Geochemistry & Geophysics; Mineralogy SC Geochemistry & Geophysics; Mineralogy GA EI2BP UT WOS:000392291600019 ER PT J AU Rolston, N Watson, BL Bailie, CD McGehee, MD Bastos, JP Gehlhaar, R Kim, JE Vak, D Mallajosyula, AT Gupta, G Mohite, AD Dauskardt, RH AF Rolston, Nicholas Watson, Brian L. Bailie, Colin D. McGehee, Michael D. Bastos, Joao P. Gehlhaar, Robert Kim, Jueng-Eun Vak, Doojin Mallajosyula, Arun Tej Gupta, Gautam Mohite, Aditya D. Dauskardt, Reinhold H. TI Mechanical integrity of solution-processed perovskite solar cells SO EXTREME MECHANICS LETTERS LA English DT Article DE Perovskite solar cells; Thermomechanical reliability; Grain boundaries; Degradation modes; Fracture processes ID SPIRO-OMETAD; STABILITY; DEGRADATION; SALTS AB Low-cost solar technologies such as perovskite solar cells are not only required to be efficient, but durable too, exhibiting chemical, thermal and mechanical stability. To determine the mechanical stability of perovskite solar cells, the fracture resistance of a multitude of solution-processed organometal trihalide perovskite films and cells utilizing these films were studied. The influence of stoichiometry, precursor chemistry, deposition techniques, and processing conditions on the fracture resistance of perovskite layers was investigated. In all cases, the perovskites offered negligible resistance to fracture, failing cohesively below 1.5 J/m(2). The solar cells studied featured these perovskites and a variety of organic and inorganic charge transporting layers and carrier-selective contacts. These ancillary layers were found to significantly influence the overall mechanical stability of the perovskite solar cells and were repeatedly the primary source of mechanical failure, failing at values below those measured for the isolated fragile perovskite films. A detailed insight into the nature of perovskite and perovskite solar cell fracture is presented and the influence of grain size, device architecture, deposition techniques, environmental variables, and molecular additives on these fracture processes is reported. Understanding the influence of materials selection, deposition techniques and processing variables on the mechanical stability of perovskite solar cells is a crucial step in their development. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Rolston, Nicholas] Stanford Univ, Dept Appl Phys, Stanford, CA 94305 USA. [Watson, Brian L.; Bailie, Colin D.; McGehee, Michael D.; Dauskardt, Reinhold H.] Stanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA. [Bastos, Joao P.; Gehlhaar, Robert] Vzw, IMEC, Kapeldreef 75, B-3001 Leuven, Belgium. [Kim, Jueng-Eun; Vak, Doojin] Commonwealth Sci & Ind Res Org CSIRO Mfg, Bayview Ave, Clayton, Vic 3169, Australia. [Mallajosyula, Arun Tej; Gupta, Gautam; Mohite, Aditya D.] Los Alamos Natl Lab, Mat Phys & Applicat Div, Los Alamos, NM 87545 USA. RP Dauskardt, RH (reprint author), Stanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA. EM dauskardt@stanford.edu RI Vak, Doojin/B-3894-2008; OI Vak, Doojin/0000-0001-7704-5563; Watson, Brian/0000-0002-3743-983X; bastos, joao/0000-0002-8877-9850 FU Bay Area Photovoltaics Consortium (BAPVC) [DE-EE004946]; Australian Centre for Advanced Photovoltaics (ACAP) program - Australian Government through the Australian Renewable Energy Agency (ARENA) [6-F023]; LANL by Los Alamos Directed Research [XW11] FX This research was supported by the Bay Area Photovoltaics Consortium (BAPVC) (Grant number: DE-EE004946). Part of this work was performed at the Stanford Nano Shared Facilities (SNSF). We thank William. H. Nguyen (Stanford) for helpful discussion. J.-E. Kim and D. Vak were supported by Australian Centre for Advanced Photovoltaics (ACAP) program funded by the Australian Government through the Australian Renewable Energy Agency (ARENA) (Grant number: 6-F023). This work was supported at LANL by Los Alamos Directed Research grant (Program XW11). NR 32 TC 5 Z9 5 U1 2 U2 2 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 2352-4316 J9 EXTREME MECH LETT JI EXTREME MECH. LETT. PD DEC PY 2016 VL 9 BP 353 EP 358 DI 10.1016/j.eml.2016.06.006 PN 3 PG 6 WC Engineering, Mechanical SC Engineering GA EM4CO UT WOS:000395261100002 ER PT J AU Barai, P Mistry, A Mukherjee, PP AF Barai, Pallab Mistry, Aashutosh Mukherjee, Partha P. TI Poromechanical effect in the lithium-sulfur battery cathode SO EXTREME MECHANICS LETTERS LA English DT Article DE Lithium-sulfur battery cathode; Precipitation induced volume expansion; Poromechanical effect; Microcrack formation ID MATHEMATICAL-MODEL; POROUS-ELECTRODES; BINARY-MIXTURES; DISCHARGE; CELLS; TEMPERATURES; KINETICS; SOUND AB In lithium-sulfur (Li-S) batteries, during discharge, solid sulfur (S-8(s)) gets dissolved and undergoes successive reduction and finally precipitates as lithium sulfide (Li2S) in a typical carbon-based, porous cathode. Deposition of Li2S leads to 80% volume expansion compared to solid S-8(s). During the dissolution-precipitation process, the total volume change of the electrolyte in the pore space can be attributed to two factors: (a) precipitation/dissolution of the solid sulfur phase; and (b) the cathode microstructure shrinks or swells to accommodate the changes in the pore volume resulting from the electrolyte induced hydrostatic pressure. Current lithium-sulfur performance models neglect this contribution. In this work, a computational methodology has been developed to quantify the impact of precipitation induced volume change, pore morphology and confinement attributes in a Li-S cathode. Impact of volume expansion on cell voltage has also been analyzed using a performance model. It is found that the poromechanical interaction significantly affects the second voltage plateau. Cathode microstructures with relatively smaller pores tend to experience less volume expansion, for the same operating conditions. It has been found that non-uniform precipitation may lead to significant pore confinement, which has the potential to cause microcrack formation in the pore walls of a typical carbon-based cathode microstructure. (C) 2016 Elsevier Ltd. All rights reserved. C1 [Barai, Pallab; Mistry, Aashutosh; Mukherjee, Partha P.] Texas A&M Univ, Dept Mech Engn, College Stn, TX 77843 USA. [Barai, Pallab] Lawrence Berkeley Natl Lab, Energy Storage & Distributed Resources Div, Berkeley, CA 94720 USA. RP Mukherjee, PP (reprint author), Texas A&M Univ, Dept Mech Engn, College Stn, TX 77843 USA. EM pmukherjee@tamu.edu FU Assistant Secretary for Energy Efficiency and Renewable Energy, Office of Vehicle Technologies of the US Department of Energy Advanced Battery Materials Research (BMR) Program [DE-EE0006832] FX Financial support from the Assistant Secretary for Energy Efficiency and Renewable Energy, Office of Vehicle Technologies of the US Department of Energy under Contract No. DE-EE0006832 from the Advanced Battery Materials Research (BMR) Program is gratefully acknowledged. NR 35 TC 0 Z9 0 U1 3 U2 3 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 2352-4316 J9 EXTREME MECH LETT JI EXTREME MECH. LETT. PD DEC PY 2016 VL 9 BP 359 EP 370 DI 10.1016/j.eml.2016.05.007 PN 3 PG 12 WC Engineering, Mechanical SC Engineering GA EM4CO UT WOS:000395261100003 ER PT J AU de Vasconcelos, LS Xu, R Li, JL Zhao, KJ AF de Vasconcelos, Luize Scalco Xu, Rong Li, Jianlin Zhao, Kejie TI Grid indentation analysis of mechanical properties of composite electrodes in Li-ion batteries SO EXTREME MECHANICS LETTERS LA English DT Article DE NMC cathode; Grid indentation; Statistical analysis; Mechanical properties; Batteries ID PLASTIC-DEFORMATION; CRYSTALLINE SILICON; INITIAL LITHIATION; STRESS EVOLUTION; ENERGY-STORAGE; LITHIUM; FRACTURE; DISCHARGE; MODULUS; CATHODE AB Electrodes in commercial rechargeable batteries are microscopically heterogeneous materials. The constituent components, including active materials, polymeric binders, and porous conductive matrix, often have large variation in their mechanical properties, making the mechanical characterization of composite electrodes a challenging task. In a model system of LiNi0.5Mn0.3Co0.2O2 cathode, we employ the instrumented grid indentation to determine the elastic modulus and hardness of the constituent phases. The approach relies on a large array of nanoindentation experiments and statistical analysis of the resulting data provided that the maximum indentation depth is carefully chosen. The statistically extracted properties of the active particles and the surrounding medium are in good agreement with the tests of targeted indentation at selected sites. The combinatory technique of grid indentation and statistical deconvolution represents a fast and reliable route to quantify the mechanical properties of composite electrodes that feed the parametric input for the mechanics models. (C) 2016 Elsevier Ltd. All rights reserved. C1 [de Vasconcelos, Luize Scalco; Xu, Rong; Zhao, Kejie] Purdue Univ, Sch Mech Engn, W Lafayette, IN 47906 USA. [Li, Jianlin] Oak Ridge Natl Lab, Energy & Transportat Sci Div, Oak Ridge, TN 37831 USA. RP Zhao, KJ (reprint author), Purdue Univ, Sch Mech Engn, W Lafayette, IN 47906 USA. EM kjzhao@purdue.edu OI Li, Jianlin/0000-0002-8710-9847 FU Purdue University; US Department of Energy (DOE) [DE-AC05-00OR22725]; Office of Energy Efficiency and Renewable Energy's Vehicle Technologies Office FX The research project is supported by the start-up funds at Purdue University. K.Z. is grateful for the research funds of 3M nontenured faculty award. Research at Oak Ridge National Laboratory (ORNL), managed by UT Battelle, LLC, for the US Department of Energy (DOE) under contract DE-AC05-00OR22725, utilized the DOE Battery Manufacturing R&D Facility at ORNL sponsored by the Office of Energy Efficiency and Renewable Energy's Vehicle Technologies Office to fabricate electrode samples. NR 42 TC 1 Z9 1 U1 3 U2 3 PU ELSEVIER SCIENCE BV PI AMSTERDAM PA PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS SN 2352-4316 J9 EXTREME MECH LETT JI EXTREME MECH. LETT. PD DEC PY 2016 VL 9 BP 495 EP 502 DI 10.1016/j.eml.2016.03.002 PN 3 PG 8 WC Engineering, Mechanical SC Engineering GA EM4CO UT WOS:000395261100016 ER PT J AU Feng, Y Chu, MY Seljak, U McDonald, P AF Feng, Yu Chu, Man-Yat Seljak, Uros McDonald, Patrick TI FASTPM: a new scheme for fast simulations of dark matter and haloes SO MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY LA English DT Article DE methods: numerical; galaxies: haloes; cosmology: theory; dark matter; large-scale structure of Universe ID BARYON ACOUSTIC-OSCILLATIONS; LARGE-SCALE STRUCTURE; INITIAL CONDITIONS; MASS FUNCTION; GALAXIES; CATALOGS; CODE; UNIVERSE; SDSS; GENERATION AB We introduce FASTPM, a highly scalable approximated particle mesh (PM) N-body solver, which implements the PM scheme enforcing correct linear displacement (1LPT) evolution via modified kick and drift factors. Employing a two-dimensional domain decomposing scheme, FASTPM scales extremely well with a very large number of CPUs. In contrast to Comoving-Lagrangian (COLA) approach, we do not require to split the force or track separately the 2LPT solution, reducing the code complexity and memory requirements. We compare FASTPM with different number of steps (N-s) and force resolution factor (B) against three benchmarks: halo mass function from friends-of-friends halo finder; halo and dark matter power spectrum; and cross-correlation coefficient (or stochasticity), relative to a high-resolution TREEPM simulation. We show that the modified time stepping scheme reduces the halo stochasticity when compared to COLA with the same number of steps and force resolution. While increasing N-s and B improves the transfer function and cross-correlation coefficient, for many applications FASTPM achieves sufficient accuracy at low N-s and B. For example, N-s = 10 and B = 2 simulation provides a substantial saving (a factor of 10) of computing time relative to N-s = 40, B = 3 simulation, yet the halo benchmarks are very similar at z = 0. We find that for abundance matched haloes the stochasticity remains low even for N-s = 5. FASTPM compares well against less expensive schemes, being only 7 (4) times more expensive than 2LPT initial condition generator for N-s = 10 (N-s = 5). Some of the applications where FASTPM can be useful are generating a large number of mocks, producing non-linear statistics where one varies a large number of nuisance or cosmological parameters, or serving as part of an initial conditions solver. C1 [Feng, Yu; Chu, Man-Yat; Seljak, Uros] Univ Calif Berkeley, Dept Phys, Berkeley Ctr Cosmol Phys, Berkeley, CA 94720 USA. [Seljak, Uros; McDonald, Patrick] Lawrence Berkeley Natl Lab, Berkeley, CA 94705 USA. RP Feng, Y (reprint author), Univ Calif Berkeley, Dept Phys, Berkeley Ctr Cosmol Phys, Berkeley, CA 94720 USA. EM yfeng1@berkeley.edu OI McDonald, Patrick/0000-0001-8346-8394 FU NASA [NNX15AL17G] FX We acknowledge support of NASA grant NNX15AL17G. The majority of the computing resources are provided at NERSC through the allocations for the Baryon Oscillation Spectroscopic Survey (BOSS) program and for the Berkeley Institute for Data Science (BIDS) program. We thank Dr Jun Kuda for distributing the source code of COLA_HALO under the GPLv3 license, which served both as a design inspiration and as a reference implementation of the COLA scheme. We thank Alejandro Cervantes and Marcel Schmittfull for their generous help in testing the code. We thank Martin White for providing the RUNPB TREEPM simulation and initial condition that formed the foundations of our benchmarks. The development of FASTPM is hosted by github.com at https://github.com/rainwoodman/fastpm. The version of code used in this paper is based on commit 9219d0. The data analysis software NBODYKIT is used for identifying FoF haloes and calculating of power spectra.3 We welcome collaboration on development of both software packages. NR 42 TC 1 Z9 1 U1 0 U2 0 PU OXFORD UNIV PRESS PI OXFORD PA GREAT CLARENDON ST, OXFORD OX2 6DP, ENGLAND SN 0035-8711 EI 1365-2966 J9 MON NOT R ASTRON SOC JI Mon. Not. Roy. Astron. Soc. PD DEC PY 2016 VL 463 IS 3 BP 2273 EP 2286 DI 10.1093/mnras/stw2123 PG 14 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EJ9SC UT WOS:000393566000001 ER PT J AU D'Ai, A Evans, PA Burrows, DN Kuin, NPM Kann, DA Campana, S Maselli, A Romano, P Cusumano, G La Parola, V Barthelmy, SD Beardmore, AP Cenko, SB De Pasquale, M Gehrels, N Greiner, J Kennea, JA Klose, S Melandri, A Nousek, JA Osborne, JP Palmer, DM Sbarufatti, B Schady, P Siegel, MH Tagliaferri, G Yates, R Zane, S AF D'Ai, A. Evans, P. A. Burrows, D. N. Kuin, N. P. M. Kann, D. A. Campana, S. Maselli, A. Romano, P. Cusumano, G. La Parola, V. Barthelmy, S. D. Beardmore, A. P. Cenko, S. B. De Pasquale, M. Gehrels, N. Greiner, J. Kennea, J. A. Klose, S. Melandri, A. Nousek, J. A. Osborne, J. P. Palmer, D. M. Sbarufatti, B. Schady, P. Siegel, M. H. Tagliaferri, G. Yates, R. Zane, S. TI Evidence for the magnetar nature of 1E 161348-5055 in RCW 103 SO MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY LA English DT Article DE X-rays: general; X-rays: individual: 1E 161348-5055 ID X-RAY SOURCE; SUPERNOVA REMNANT RCW-103; CENTRAL COMPACT OBJECTS; NEUTRON-STARS; GALACTIC MAGNETAR; ANTI-MAGNETARS; SPIN-DOWN; OUTBURST; PULSAR; TELESCOPE AB We report on the detection of a bright, short, structured X-ray burst coming from the supernova remnant RCW 103 on 2016 June 22 caught by the Swift/Burst Alert Telescope (BAT) monitor, and on the follow-up campaign made with Swift/X-ray Telescope, Swift/UV/Optical Telescope, and the optical/near-infrared (NIR) Gamma-Ray burst Optical and Near-infrared Detector. The characteristics of this flash, such as duration and spectral shape, are consistent with typical short bursts observed from soft gamma repeaters. The BAT error circle at 68 per cent confidence range encloses the point-like X-ray source at the centre of the nebula, 1E 161348-5055. Its nature has been long debated due to a periodicity of 6.67 h in X-rays, which could indicate either an extremely slow pulsating neutron star, or the orbital period of a very compact X-ray binary system. We found that 20 min before the BAT trigger, the soft X-ray emission of 1E 161348-5055 was a factor of similar to 100 higher than measured 2 yr earlier, indicating that an outburst had already started. By comparing the spectral and timing characteristics of the source in the 2 yr before the outburst and after the BAT event, we find that, besides a change in luminosity and spectral shape, also the 6.67 h pulsed profile has significantly changed with a clear phase shift with respect to its low-flux profile. The UV/optical/NIR observations did not reveal any counterpart at the position of 1E 161348-5055. Based on these findings, we associate the BAT burst with 1E 161348-5055, we classify it as a magnetar, and pinpoint the 6.67 h periodicity as the magnetar spin period. C1 [D'Ai, A.; Maselli, A.; Romano, P.; Cusumano, G.; La Parola, V.] INAF IASF Palermo, Via Ugo La Malfa 153, I-90146 Palermo, Italy. [Evans, P. A.; Beardmore, A. P.; Osborne, J. P.] Univ Leicester, Dept Phys & Astron, Leicester LE1 7RH, Leics, England. [Burrows, D. N.; Kennea, J. A.; Nousek, J. A.; Sbarufatti, B.; Siegel, M. H.] Penn State Univ, Dept Astron & Astrophys, 525 Davey Lab, University Pk, PA 16802 USA. [Kuin, N. P. M.; De Pasquale, M.; Zane, S.] UCL, Mullard Space Sci Lab, Dorking RH5 6NT, Surrey, England. [Kann, D. A.] Thuringer Landessternwarte Tautenburg, Sternwarte 5, D-07778 Tautenburg, Germany. [Campana, S.; Melandri, A.; Sbarufatti, B.; Tagliaferri, G.] Osserv Astron Brera, INAF, Via E Bianchi 46, I-23807 Merate, Italy. [Barthelmy, S. D.; Cenko, S. B.; Gehrels, N.] NASA, Goddard Space Flight Ctr, Mail Code 661, Greenbelt, MD 20771 USA. [Cenko, S. B.] Univ Maryland, Joint Space Sci Inst, College Pk, MD 20742 USA. [Greiner, J.; Schady, P.; Yates, R.] Max Planck Inst Extraterr Phys, Giessenbachstr 1, D-85748 Garching, Germany. [Palmer, D. M.] Los Alamos Natl Lab, B244, Los Alamos, NM 87545 USA. RP D'Ai, A (reprint author), INAF IASF Palermo, Via Ugo La Malfa 153, I-90146 Palermo, Italy. EM antonino.dai@ifc.inaf.it OI Sbarufatti, Boris/0000-0001-6620-8347 FU UK Space Agency; Leibniz-Prize; DFG [HA 1850/28-1]; [ASI-INAF I/004/11/0] FX The authors are very grateful to Amy Y. Lien for her support in the data reduction and analysis of the BAT data. PAE, APB, NPMK, and JPO acknowledge Swift funding from the UK Space Agency. We acknowledge contract ASI-INAF I/004/11/0.; Part of the funding for GROND (both hardware as well as personnel) was generously granted from the Leibniz-Prize to Professor G. Hasinger (DFG grant HA 1850/28-1). This work made use of data supplied by the UK Swift Science Data Centre at the University of Leicester. This research has made use of the XRT Data Analysis Software (XRTDAS) developed under the responsibility of the ASI Science Data Center (ASDC), Italy. NR 59 TC 3 Z9 3 U1 0 U2 0 PU OXFORD UNIV PRESS PI OXFORD PA GREAT CLARENDON ST, OXFORD OX2 6DP, ENGLAND SN 0035-8711 EI 1365-2966 J9 MON NOT R ASTRON SOC JI Mon. Not. Roy. Astron. Soc. PD DEC PY 2016 VL 463 IS 3 BP 2394 EP 2404 DI 10.1093/mnras/stw2023 PG 11 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EJ9SC UT WOS:000393566000011 ER PT J AU Rosen, AL Krumholz, MR McKee, CF Klein, RI AF Rosen, Anna L. Krumholz, Mark R. McKee, Christopher F. Klein, Richard I. TI An unstable truth: how massive stars get their mass SO MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY LA English DT Article DE hydrodynamics; instabilities; stars: formation; stars: massive; ISM: bubbles ID ADAPTIVE MESH REFINEMENT; SELF-GRAVITATIONAL HYDRODYNAMICS; HIGH ANGULAR RESOLUTION; RADIATION-PRESSURE; PROTOSTELLAR OUTFLOWS; DARK CLOUDS; MOLECULAR CLOUDS; ACCRETION DISKS; SINK PARTICLES; DENSE CORES AB The pressure exerted by massive stars' radiation fields is an important mechanism regulating their formation. Detailed simulation of massive star formation therefore requires an accurate treatment of radiation. However, all published simulations have either used a diffusion approximation of limited validity; have only been able to simulate a single star fixed in space, thereby suppressing potentially important instabilities; or did not provide adequate resolution at locations where instabilities may develop. To remedy this, we have developed a new, highly accurate radiation algorithm that properly treats the absorption of the direct radiation field from stars and the re-emission and processing by interstellar dust. We use our new tool to perform 3D radiation-hydrodynamic simulations of the collapse of massive pre-stellar cores with laminar and turbulent initial conditions and properly resolve regions where we expect instabilities to grow. We find that mass is channelled to the stellar system via gravitational and Rayleigh-Taylor (RT) instabilities, in agreement with previous results using stars capable of moving, but in disagreement with methods where the star is held fixed or with simulations that do not adequately resolve the development of RT instabilities. For laminar initial conditions, proper treatment of the direct radiation field produces later onset of instability, but does not suppress it entirely provided the edges of radiation-dominated bubbles are adequately resolved. Instabilities arise immediately for turbulent pre-stellar cores because the initial turbulence seeds the instabilities. Our results suggest that RT features should be present around accreting massive stars throughout their formation. C1 [Rosen, Anna L.] Univ Calif Santa Cruz, Dept Astron & Astrophys, Santa Cruz, CA 95064 USA. [Krumholz, Mark R.] Australian Natl Univ, Res Sch Astron & Astrophys, Canberra, ACT 2611, Australia. [McKee, Christopher F.; Klein, Richard I.] Univ Calif Berkeley, Dept Astron, Berkeley, CA 94720 USA. [McKee, Christopher F.] Univ Calif Berkeley, Dept Phys, Berkeley, CA 94720 USA. [Klein, Richard I.] Lawrence Livermore Natl Lab, POB L-23, Livermore, CA 94550 USA. RP Rosen, AL (reprint author), Univ Calif Santa Cruz, Dept Astron & Astrophys, Santa Cruz, CA 95064 USA. EM alrosen@ucsc.edu OI Krumholz, Mark/0000-0003-3893-854X FU National Aeronautics and Space Administration (NASA) by the Space Telescope Science Institute [HST-AR-13265.02-A]; NASA [NAS 5-26555, NAS8-03060]; Chandra Theory Grant by the Chandra X-ray Observatory Center [TM5-16007X]; NSF; AAUW American Fellowship Programme; NASA through ATP [NNX13AB84G]; NSF [AST-1211729]; US Department of Energy at the Lawrence Livermore National Laboratory [DE-AC52-07NA27344]; NASA TCAN [NNX-14AB52G]; Australian Research Council [DP160100695] FX We thank Andrew Myers and Pak Shing Li for useful discussions regarding the ORION simulation code. We would also like to thank the referee and editor for their comments. ALR thanks Rolf Kuiper, Benoit Commercon, and Kaitlin Kratter for useful discussions about the results of our work. ALR and MRK acknowledge support from the National Aeronautics and Space Administration (NASA) through Hubble Archival Research grant HST-AR-13265.02-A issued by the Space Telescope Science Institute, which is operated by the Association of Universities for Research in Astronomy, Inc., under NASA contract NAS 5-26555 and Chandra Theory Grant Award Number TM5-16007X issued by the Chandra X-ray Observatory Center, which is operated by the Smithsonian Astrophysical Observatory for and on behalf of NASA under contract NAS8-03060. ALR acknowledges support from the NSF Graduate Research Fellowship Programme and the AAUW American Fellowship Programme. CFM and RIK acknowledge support from NASA through ATP grant NNX13AB84G and the NSF through grant AST-1211729. RIK acknowledges the US Department of Energy at the Lawrence Livermore National Laboratory under contract DE-AC52-07NA27344. MRK, CFM, and RIK acknowledge support from NASA TCAN grant NNX-14AB52G. MRK acknowledges support from Australian Research Council grant DP160100695. This research was undertaken with the assistance of resources from the National Computational Infrastructure (NCI), which is supported by the Australian Government. NR 78 TC 2 Z9 2 U1 0 U2 0 PU OXFORD UNIV PRESS PI OXFORD PA GREAT CLARENDON ST, OXFORD OX2 6DP, ENGLAND SN 0035-8711 EI 1365-2966 J9 MON NOT R ASTRON SOC JI Mon. Not. Roy. Astron. Soc. PD DEC PY 2016 VL 463 IS 3 BP 2553 EP 2573 DI 10.1093/mnras/stw2153 PG 21 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EJ9SC UT WOS:000393566000022 ER PT J AU Guillot, S Kaspi, VM Archibald, RF Bachetti, M Flynn, C Jankowski, F Bailes, M Boggs, S Christensen, FE Craig, WW Hailey, CA Harrison, FA Stern, D Zhang, WW AF Guillot, S. Kaspi, V. M. Archibald, R. F. Bachetti, M. Flynn, C. Jankowski, F. Bailes, M. Boggs, S. Christensen, F. E. Craig, W. W. Hailey, C. A. Harrison, F. A. Stern, D. Zhang, W. W. TI The NuSTAR view of the non-thermal emission from PSR J0437-4715 SO MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY LA English DT Article DE stars: neutron; pulsars: individual: PSR 0437-4715 ID MILLISECOND PULSAR J0437-4715; HIGH-ENERGY EMISSION; EQUATION-OF-STATE; XMM-NEWTON OBSERVATIONS; X-RAY OBSERVATIONS; NEUTRON-STAR; DENSE MATTER; RADIUS CONSTRAINTS; GLOBULAR-CLUSTERS; IMPROVED MASS AB We present a hard X-ray Nuclear Spectroscopic Telescope Array (NuSTAR) observation of PSR J0437-4715, the nearest millisecond pulsar. The known pulsations at the apparent pulse period similar to 5.76 ms are observed with a significance of 3.7 sigma, at energies up to 20 keV above which the NuSTAR background dominates. We measure a photon index Gamma = 1.50 +/- 0.25 (90 per cent confidence) for the power-law fit to the non-thermal emission. It had been shown that spectral models with two or three thermal components fit the XMM-Newton spectrum of PSR J0437-4715, depending on the slope of the power-law component, and the amount of absorption of soft X-rays. The new constraint on the high-energy emission provided by NuSTAR removes ambiguities regarding the thermal components of the emission below 3 keV. We performed a simultaneous spectral analysis of the XMM-Newton and NuSTAR data to confirm that three thermal components and a power law are required to fit the 0.3-20 keV emission of PSR J0437-4715. Adding a ROSAT-PSPC spectrum further confirmed this result and allowed us to better constrain the temperatures of the three thermal components. A phase-resolved analysis of the NuSTAR data revealed no significant change in the photon index of the high-energy emission. This NuSTAR observation provides further impetus for future observations with the NICER mission (Neutron Star Interior Composition Explorer) whose sensitivity will provide much stricter constraints on the equation of state of nuclear matter by combining model fits to the pulsar's phase-folded light curve with the pulsar's well-defined mass and distance from radio timing observations. C1 [Guillot, S.] Pontificia Univ Catolica Chile, Fac Fis, Inst Astrofis, Av Vicuna Mackenna 4860, Santiago 7820436, Chile. [Guillot, S.; Kaspi, V. M.; Archibald, R. F.] McGill Univ, Dept Phys, 3600 Rue Univ Montreal, Montreal, PQ H3A 2T8, Canada. [Guillot, S.; Kaspi, V. M.; Archibald, R. F.] McGill Univ, McGill Space Inst, 3600 Rue Univ Montreal, Montreal, PQ H3A 2T8, Canada. [Bachetti, M.] Osservatorio Astron Cagliari, Via Sci 5, I-09047 Selargius, Italy. [Flynn, C.; Jankowski, F.; Bailes, M.] Swinburne Univ Technol, Ctr Astrophys & Supercomp, POB 218, Hawthorn, Vic 3122, Australia. [Flynn, C.; Jankowski, F.; Bailes, M.] Swinburne Univ Technol, ARC Ctr All Sky Astrophys CAASTRO, POB 218, Hawthorn, Vic 3122, Australia. [Boggs, S.] Univ Calif Berkeley, Space Sci Lab, Berkeley, CA 94720 USA. [Christensen, F. E.; Craig, W. W.] Tech Univ Denmark, Natl Space Inst, DTU Space, Elektrovej 327, DK-2800 Lyngby, Denmark. [Craig, W. W.] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA. [Hailey, C. A.] Columbia Univ, Columbia Astrophys Lab, New York, NY 10027 USA. [Harrison, F. A.] CALTECH, Space Radiat Lab, 1200 E Calif Blvd,MC 249-17, Pasadena, CA 91125 USA. [Stern, D.] CALTECH, Jet Prop Lab, Pasadena, CA 91109 USA. [Zhang, W. W.] NASA, Goddard Space Flight Ctr, Astrophys Sci Div, Code 661, Greenbelt, MD 20771 USA. RP Guillot, S (reprint author), Pontificia Univ Catolica Chile, Fac Fis, Inst Astrofis, Av Vicuna Mackenna 4860, Santiago 7820436, Chile.; Guillot, S (reprint author), McGill Univ, Dept Phys, 3600 Rue Univ Montreal, Montreal, PQ H3A 2T8, Canada.; Guillot, S (reprint author), McGill Univ, McGill Space Inst, 3600 Rue Univ Montreal, Montreal, PQ H3A 2T8, Canada. EM sguillot@astro.puc.cl OI Jankowski, Fabian/0000-0002-6658-2811 FU National Aeronautics and Space Administration; NSERC; Centre de Recherche en Astrophysique du Quebec; R. Howard Webster Foundation from the Canadian Institute for Advanced Study; Canada Research Chairs Program; Lorne Trottier Chair in Astrophysics and Cosmology; Australian Research Council Centre of Excellence for All-sky Astrophysics (CAASTRO) [CE110001020]; [3150428] FX The authors thank the referee, Slavko Bogdanov, for very useful suggestions that significantly improved this paper. This work made use of data from the NuSTAR mission, a project led by the California Institute of Technology, managed by the Jet Propulsion Laboratory, and funded by the National Aeronautics and Space Administration. The data analysis was performed with the NuSTAR Data Analysis Software (NUSTARDAS) jointly developed by the ASI Science Data Center (ASDC, Italy) and the California Institute of Technology (USA). SG is a FONDECYT post-doctoral fellow, funded by grant # 3150428. VMK receives support from an NSERC Discovery Grant and Accelerator Supplement, from the Centre de Recherche en Astrophysique du Quebec, an R. Howard Webster Foundation Fellowship from the Canadian Institute for Advanced Study, the Canada Research Chairs Program and the Lorne Trottier Chair in Astrophysics and Cosmology. Parts of this research were conducted by the Australian Research Council Centre of Excellence for All-sky Astrophysics (CAASTRO), through project number CE110001020. NR 52 TC 0 Z9 0 U1 2 U2 2 PU OXFORD UNIV PRESS PI OXFORD PA GREAT CLARENDON ST, OXFORD OX2 6DP, ENGLAND SN 0035-8711 EI 1365-2966 J9 MON NOT R ASTRON SOC JI Mon. Not. Roy. Astron. Soc. PD DEC PY 2016 VL 463 IS 3 BP 2612 EP 2622 DI 10.1093/mnras/stw2194 PG 11 WC Astronomy & Astrophysics SC Astronomy & Astrophysics GA EJ9SC UT WOS:000393566000026 ER PT J AU Bridges, RA Collins, J Ferragut, EM Laska, J Sullivan, BD AF Bridges, Robert A. Collins, John Ferragut, Erik M. Laska, Jason Sullivan, Blair D. TI A multi-level anomaly detection algorithm for time-varying graph data with interactive visualization SO SOCIAL NETWORK ANALYSIS AND MINING LA English DT Article DE Anomaly detection; Graph sequence; Visualization AB This work presents a modeling and analysis framework for graph sequences which addresses the challenge of detecting and contextualizing anomalies in streaming graph data. Our goal is to detect changes at multiple levels of granularity, thereby identifying specific nodes and subgraphs causing a graph to appear anomalously. In particular, the framework detects changes in community membership, density, and node degree in a sequence of graphs where these are relatively stable. In route to this end, we introduce a new graph model, a generalization of the BTER model of Seshadhri et al., by adding flexibility to community structure, and use this model to perform multi-scale graph anomaly detection. This technique provides insight into a graph's structure and internal context that may shed light on a detected event. Additionally, this multi-scale analysis facilitates intuitive visualizations by allowing users to narrow focus from an anomalous graph to particular subgraphs or nodes causing the anomaly. For evaluation, two hierarchical anomaly detectors are tested against a baseline Gaussian method on a series of sampled graphs. We demonstrate that our graph statistics-based approach outperforms both a distribution-based detector and the baseline in a labeled setting with community structure, and it accurately detects anomalies in synthetic and real-world datasets at the node, subgraph, and graph levels. To illustrate the accessibility of information made possible via this technique, the anomaly detector and an associated interactive visualization tool are tested on NCAA football data, where teams and conferences that moved within the league are identified with perfect recall, and precision >0.786. C1 [Bridges, Robert A.; Collins, John; Ferragut, Erik M.; Laska, Jason] Oak Ridge Natl Lab, Computat Sci & Engn Div, Oak Ridge, TN 32831 USA. [Sullivan, Blair D.] North Carolina State Univ, Dept Comp Sci, Raleigh, NC 27695 USA. RP Bridges, RA (reprint author), Oak Ridge Natl Lab, Computat Sci & Engn Div, Oak Ridge, TN 32831 USA. EM bridgesra@ornl.gov; jparcoll@gmail.com; ferragutem@ornl.gov; laskaja@ornl.gov; blair_sullivan@ncsu.edu FU U.S. Department of Energy [DE-AC05-00OR22725]; Department of Energy; DARPA GRAPHS/SPAWAR [N66001-14-1-4063]; Gordon and Betty Moore Foundation; National Consortium for Data Science FX This manuscript has been authored in part by UT-Battelle, LLC under Contract No. DE-AC05-00OR22725 with the U.S. Department of Energy. The United States Government retains and the publisher, by accepting the article for publication, acknowledges that the United States Government retains a non-exclusive, paid-up, irrevocable, world-wide license to publish or reproduce the published form of this manuscript, or allow others to do so, for United States Government purposes. The Department of Energy will provide public access to these results of federally sponsored research in accordance with the DOE Public Access Plan (http://energy.gov/downloads/doe-public-access-plan). Blair D. Sullivan supported in part by DARPA GRAPHS/SPAWAR Grant N66001-14-1-4063, the Gordon and Betty Moore Foundation, and the National Consortium for Data Science. Any opinions, findings, and conclusions or recommendations expressed in this publication are those of the author(s) and do not necessarily reflect the views of DOE, DARPA, SSC Pacific, the Moore Foundation, or the NCDS. NR 22 TC 0 Z9 0 U1 0 U2 0 PU SPRINGER WIEN PI WIEN PA SACHSENPLATZ 4-6, PO BOX 89, A-1201 WIEN, AUSTRIA SN 1869-5450 EI 1869-5469 J9 SOC NETW ANAL MIN JI Soc. Netw. Anal. Min. PD DEC PY 2016 VL 6 IS 1 AR UNSP 99 DI 10.1007/s13278-016-0409-y PG 14 WC Computer Science, Information Systems SC Computer Science GA EK9BO UT WOS:000394219100009 ER PT J AU Zareapour, P Xu, JW Zhao, SYF Jain, A Xu, ZJ Liu, TS Gu, GD Burch, KS AF Zareapour, Parisa Xu, Jianwei Zhao, Shu Yang F. Jain, Achint Xu, Zhijun Liu, T. S. Gu, G. D. Burch, Kenneth S. TI Modeling tunneling for the unconventional superconducting proximity effect SO SUPERCONDUCTOR SCIENCE & TECHNOLOGY LA English DT Article DE unconventional superconductors; proximity effect; cuprates; topological insulators ID CUPRATE SUPERCONDUCTORS; TOPOLOGICAL INSULATORS; JOSEPHSON-JUNCTIONS; GAP STRUCTURE; SPECTROSCOPY; REFLECTIONS; CONTACTS; BI2TE3; BI2SE3; STATES AB Recently there has been reinvigorated interest in the superconducting proximity effect, driven by predictions of the emergence of Majorana fermions. To help guide this search, we have developed a phenomenological model for the tunneling spectra in anisotropic superconductor-normal metal proximity devices. We combine successful approaches used in s-wave proximity and standard d-wave tunneling to reproduce tunneling spectra in d-wave proximity devices, and clarify the origin of various features. Different variations of the pair potential are considered, resulting from the proximity-induced superconductivity. Furthermore, the effective pair potential felt by the quasiparticles is momentum-dependent in contrast to s-wave superconductors. The probabilities of reflection and transmission are calculated by solving the Bogoliubov equations. Our results are consistent with experimental observations of the unconventional proximity effect and provide important experimental parameters such as the size and length scale of the proximity induced gap, as well as the conditions needed to observe the reduced and full superconducting gaps. C1 [Zareapour, Parisa; Xu, Jianwei; Zhao, Shu Yang F.; Jain, Achint; Burch, Kenneth S.] Univ Toronto, Dept Phys, 60 St George St, Toronto, ON M5S 1A7, Canada. [Zareapour, Parisa; Xu, Jianwei; Zhao, Shu Yang F.; Jain, Achint; Burch, Kenneth S.] Univ Toronto, Inst Opt Sci, 60 St George St, Toronto, ON M5S 1A7, Canada. [Xu, Zhijun; Liu, T. S.; Gu, G. D.] Brookhaven Natl Lab, Dept Condensed Matter Phys & Mat Sci CMPMS, Upton, NY 11973 USA. [Liu, T. S.] North Univ China, Sch Chem Engn & Environm, Beijing, Peoples R China. [Burch, Kenneth S.] Boston Coll, Dept Phys, 140 Commonwealth Ave, Chestnut Hill, MA 02467 USA. RP Burch, KS (reprint author), Univ Toronto, Dept Phys, 60 St George St, Toronto, ON M5S 1A7, Canada.; Burch, KS (reprint author), Univ Toronto, Inst Opt Sci, 60 St George St, Toronto, ON M5S 1A7, Canada.; Burch, KS (reprint author), Boston Coll, Dept Phys, 140 Commonwealth Ave, Chestnut Hill, MA 02467 USA. EM ks.burch@bc.edu RI xu, zhijun/A-3264-2013; OI xu, zhijun/0000-0001-7486-2015; Burch, Kenneth/0000-0002-7541-0245 FU Natural Sciences and Engineering Research Council of Canada; Canadian Foundation for Innovation; Ontario Ministry for Innovation; National Science Foundation [DMR-1410846]; Office of Basic Energy Sciences, U S Department of Energy [DE-SC00112704]; Center for Emergent Superconductivity, an Energy Frontier Research Center, headquartered at Brookhaven National Laboratory; U S Department of Energy [DE-2009-BNL-PM015] FX The work at the University of Toronto was supported by the Natural Sciences and Engineering Research Council of Canada, the Canadian Foundation for Innovation, and the Ontario Ministry for Innovation. KSB acknowledges support from the National Science Foundation (grant DMR-1410846). The work at Brookhaven National Laboratory was supported by the Office of Basic Energy Sciences, U S Department of Energy, under Contract No. DE-SC00112704. Z J X was supported by the Center for Emergent Superconductivity, an Energy Frontier Research Center, headquartered at Brookhaven National Laboratory and funded by the U S Department of Energy, under DE-2009-BNL-PM015. NR 62 TC 0 Z9 0 U1 11 U2 11 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 0953-2048 EI 1361-6668 J9 SUPERCOND SCI TECH JI Supercond. Sci. Technol. PD DEC PY 2016 VL 29 IS 12 AR 125006 DI 10.1088/0953-2048/29/12/125006 PG 8 WC Physics, Applied; Physics, Condensed Matter SC Physics GA EL8MC UT WOS:000394873000001 ER PT J AU Ghosh, A Ahmed, T Yarotski, DA Nakhmanson, SM Zhu, JX AF Ghosh, Ayana Ahmed, Towfiq Yarotski, Dzmitry A. Nakhmanson, Serge M. Zhu, Jian-Xin TI Oxygen vacancy effects on double perovskite Bi2FeMnO6: A first-principles study SO EPL LA English DT Article ID ROOM-TEMPERATURE; THIN-FILMS; MAGNETORESISTANCE; LA2NIMNO6; BIMNO3 AB Double perovskite Bi2FeMnO6 (BFMO) is a potential candidate for the highly sought single-phase multiferroic system. The large orbital radius of the Bi 6s(2) lone pairs is responsible for BFMO to exhibit low symmetries and spontaneous polarization, whereas B-site ordering of Mn and Fe contributes to its magnetic properties. In this work, we study both electronic correlation and oxygen vacancy effects on magnetic, electronic and optical properties of BFMO by performing first-principles simulations using density functional theory within the local spin-density approximation (LSDA) and the LSDA+U method. We have numerically demonstrated that a strong on-site Hubbard interaction is critical for the gap opening in a pristine BFMO. We have performed calculations on a supercell constructed with eight chemical formula units of BFMO, from which oxygen atoms were removed incrementally. We showed that the average magnetization decreases with the increase of oxygen vacancy concentration. From the calculated band structure and optical conductivity, an insulator-metal transition or crossover was identified with oxygen in BFMO. Copyright (C) EPLA, 2016 C1 [Ghosh, Ayana; Nakhmanson, Serge M.] Univ Connecticut, Dept Mat Sci & Engn, Storrs, CT 06269 USA. [Ghosh, Ayana; Nakhmanson, Serge M.] Univ Connecticut, Inst Mat Sci, Storrs, CT 06269 USA. [Ghosh, Ayana; Zhu, Jian-Xin] Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA. [Ghosh, Ayana; Ahmed, Towfiq; Yarotski, Dzmitry A.; Zhu, Jian-Xin] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. RP Ghosh, A (reprint author), Univ Connecticut, Dept Mat Sci & Engn, Storrs, CT 06269 USA.; Ghosh, A (reprint author), Univ Connecticut, Inst Mat Sci, Storrs, CT 06269 USA.; Ghosh, A; Zhu, JX (reprint author), Los Alamos Natl Lab, Ctr Integrated Nanotechnol, Los Alamos, NM 87545 USA.; Ghosh, A; Zhu, JX (reprint author), Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA. EM ayana.ghosh@uconn.edu; jxzhu@lanl.gov FU U.S. DOE through the LDRD Program [DE-AC5206NA25396]; Center for Integrated Nanotechnologies, a DOE BES FX AG acknowledges the support of the Student Programs at Los Alamos National Laboratory (LANL). This work was supported by the U.S. DOE Contract No. DE-AC5206NA25396 through the LDRD Program, and was in part supported by the Center for Integrated Nanotechnologies, a DOE BES user facility. NR 26 TC 0 Z9 0 U1 10 U2 10 PU EPL ASSOCIATION, EUROPEAN PHYSICAL SOCIETY PI MULHOUSE PA 6 RUE DES FRERES LUMIERE, MULHOUSE, 68200, FRANCE SN 0295-5075 EI 1286-4854 J9 EPL-EUROPHYS LETT JI EPL PD DEC PY 2016 VL 116 IS 5 AR 57002 DI 10.1209/0295-5075/116/57002 PG 6 WC Physics, Multidisciplinary SC Physics GA EJ9TW UT WOS:000393571000023 ER EF