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[1] DAVE: A comprehensive software suite for the reduction, visualization, and analysis of low energy neutron spectroscopic data , R.T. Azuah, L.R. Kneller, Y. Qiu, P.L.W. Tregenna-Piggott, C.M. Brown, J.R.D. Copley, and R.M. Dimeo, J. Res. Natl. Inst. Stan. Technol. 114, 341 (2009).

Note: For 2006 to 2012, items marked with a * include citations or acknowledgments of use of DAVE or its modules in their text, while for all others the authors personally acknowledge use of DAVE software.

Submitted, In press
2016, 2015, 2014, 2013, 2012, 2011, 2010
2009, 2008, 2007, 2006, 2005, 2004, 2003



Submitted


In press


2016 (65 publications)

1 C. E. Bertrand, J. L. Self, J. R. D. Copley, and A. Faraone, "Dynamic signature of molecular association in methanol," Journal of Chemical Physics 145 (1) (2016).

2 M. S. Bryan, T. R. Prisk, R. T. Azuah, W. G. Stirling, and P. E. Sokol, "The momentum distribution of liquid He-3," Epl 115 (6) (2016).

3 Nicholas P. Butch, Sheng Ran, Inho Jeon, Noravee Kanchanavatee, Kevin Huang, Alexander Breindel, M. Brian Maple, Ryan L. Stillwell, Yang Zhao, Leland Harriger, and Jeffrey W. Lynn, "Distinct magnetic spectra in the hidden order and antiferromagnetic phases in URu2-xFexSi2," Physical Review B 94 (20) (2016).

4 Sergiu Calancea, Samira G. Reis, Guilherme P. Guedes, Rafael A. Allao Cassaro, Felipe Semaan, Fernando Lopez-Ortiz, and Maria G. F. Vaz, "A new family of multinuclear mixed-ligand copper(II) clusters: Crystal structures, magnetic properties and catecholase-like activity," Inorganica Chimica Acta 453, 104-114 (2016).

5 Rafael A. Allao Cassaro, Jonathan R. Friedman, and Paul M. Lahti, "Copper(II) coordination compounds with sterically constraining pyrenyl nitronyl nitroxide and imino nitroxide," Polyhedron 117, 7-13 (2016).

6 L. Chen, H. H. Cui, S. E. Stavretis, S. C. Hunter, Y. Q. Zhang, X. T. Chen, Y. C. Sun, Z. X. Wang, Y. Song, A. A. Podlesnyak, Z. W. Ouyang, and Z. L. Xue, "Slow Magnetic Relaxations in Cobalt(II) Tetranitrate Complexes. Studies of Magnetic. Anisotropy by Inelastic Neutron Scattering and High-Frequency and High-Field EPR Spectroscopy," Inorganic Chemistry 55 (24), 12603-12617 (2016).

7 C. Cruz, D. O. Soares-Pinto, P. Brandao, A. M. dos Santos, and M. S. Reis, "Carboxylate-based molecular magnet: One path toward achieving stable quantum correlations at room temperature," Epl 113 (4) (2016).

8 Gurpreet K. Dhindsa, Debsindhu Bhowmik, Monojoy Goswami, Hugh O'Neill, Eugene Mamontov, Bobby G. Sumpter, Liang Hong, Panchapakesan Ganesh, and Xiang-qiang Chu, "Enhanced Dynamics of Hydrated tRNA on Nanodiamond Surfaces: A Combined Neutron Scattering and MD Simulation Study," Journal of Physical Chemistry B 120 (38), 10059-10068 (2016).

9 S. O. Diallo, J. Y. Y. Lin, D. L. Abernathy, and R. T. Azuah, "Momentum and energy dependent resolution function of the ARCS neutron chopper spectrometer at high momentum transfer: Comparing simulation and experiment," Nuclear Instruments & Methods in Physics Research Section a-Accelerators Spectrometers Detectors and Associated Equipment 835, 34-41 (2016).

10 Kang Du and T. David Harris, "A Cu-2(II) Paramagnetic Chemical Exchange Saturation Transfer Contrast Agent Enabled by Magnetic Exchange Coupling," Journal of the American Chemical Society 138 (25), 7804-7807 (2016).

11 G. Ehlers, A. A. Podlesnyak, and A. I. Kolesnikov, "The cold neutron chopper spectrometer at the Spallation Neutron Source-A review of the first 8 years of operation," Review of Scientific Instruments 87 (9) (2016).

12 Livia B. L. Escobar, Charlane C. Correa, Guilherme P. Guedes, Maria G. F. Vaz, Samuel M. Greer, Stephen Hill, Renata Diniz, and Flavia C. Machado, "Two coordination polymers containing the dicyanamide ligand: Synthesis, crystal structures, and HFEPR studies," Inorganica Chimica Acta 451, 59-64 (2016).

13 R. A. Ewings, A. Buts, M. D. Le, J. van Duijn, I. Bustinduy, and T. G. Perring, "HORACE: Software for the analysis of data from single crystal spectroscopy experiments at time-of-flight neutron instruments," Nuclear Instruments & Methods in Physics Research Section a-Accelerators Spectrometers Detectors and Associated Equipment 834, 132-142 (2016).

14 Majed S. Fataftah, Scott C. Coste, Bess Vlaisavljevich, Joseph M. Zadrozny, and Danna E. Freedman, "Transformation of the coordination complex Co(C3S5)(2) (2-) from a molecular magnet to a potential qubit," Chemical Science 7 (9), 6160-6166 (2016).

15 J. Gaudet, K. A. Ross, E. Kermarrec, N. P. Butch, G. Ehlers, H. A. Dabkowska, and B. D. Gaulin, "Gapless quantum excitations from an icelike splayed ferromagnetic ground state in stoichiometric Yb2Ti2O7," Physical Review B 93 (6) (2016).

16 Tomohiko Hamaguchi, Michael D. Doud, Jeremy Hilgar, Jeffrey D. Rinehart, and Clifford P. Kubiak, "Competing ferro- and antiferromagnetic interactions in a hexagonal bipyramidal nickel thiolate cluster," Dalton Transactions 45 (6), 2374-2377 (2016).

17 Alexander Jeremies, Sina Gruschinski, Michel Meyer, Vitaly Matulis, Oleg A. Ivashkevich, Karolin Kobalz, and Berthold Kersting, "Azide Binding Controlled by Steric Interactions in Second Sphere. Synthesis, Crystal Structure, and Magnetic Properties of Ni-2(II)(L)(mu(1,1)-N-3) ClO4 (L = Macrocyclic N6S2 Ligand)," Inorganic Chemistry 55 (4), 1843-1853 (2016).

18 Alexander Jeremies, Ulrike Lehmann, Sina Gruschinski, Vitaly Matulis, Oleg A. Ivashkevich, Astrid Jaeschke, and Berthold Kersting, "Synthesis, structure, electrochemistry, and magnetic properties of face-sharing bioctahedral nickel complexes containing a N3Ni(mu-S-2)(mu-X)NiN3 core (X = F-, Cl-, Br-, OH-)," Journal of Organometallic Chemistry 821, 171-181 (2016).

19 Maiko Kofu, Naoki Hashimoto, Hiroshi Akiba, Hirokazu Kobayashi, Hiroshi Kitagawa, Madhusudan Tyagi, Antonio Faraone, John R. D. Copley, Wiebke Lohstroh, and Osamu Yamamuro, "Hydrogen diffusion in bulk and nanocrystalline palladium: A quasielastic neutron scattering study," Physical Review B 94 (6) (2016).

20 A. I. Kolesnikov, A. Podlesnyak, R. A. Sadykov, V. E. Antonov, M. A. Kuzovnikov, G. Ehlers, and G. E. Granroth, "Pressure effect on hydrogen tunneling and vibrational spectrum in alpha-Mn," Physical Review B 94 (13) (2016).

21 Alexander I. Kolesnikov, George F. Reiter, Narayani Choudhury, Timothy R. Prisk, Eugene Mamontov, Andrey Podlesnyak, George Ehlers, Andrew G. Seel, David J. Wesolowski, and Lawrence M. Anovitz, "Quantum Tunneling of Water in Beryl: A New State of the Water Molecule," Physical Review Letters 116 (16) (2016).

22 C. M. N. Kumar, Y. Xiao, H. S. Nair, J. Voigt, B. Schmitz, T. Chatterji, N. H. Jalarvo, and Th Brueckel, "Hyperfine and crystal field interactions in multiferroic HoCrO3," Journal of Physics-Condensed Matter 28 (47) (2016).

23 Kunal Kupwade-Patil, Souleymane O. Diallo, Dewan Zayid Hossain, Md Rashedul Islam, and Erez N. Allouche, "Investigation of activation kinetics in geopolymer paste using quasielastic neutron scattering," Construction and Building Materials 120, 181-188 (2016).

24 Kunal Kupwade-Patil, Madhusudan Tyagi, Craig M. Brown, and Oral Buyukozturk, "Water dynamics in cement paste at early age prepared with pozzolanic volcanic ash and Ordinary Portland Cement using quasielastic neutron scattering," Cement and Concrete Research 86, 55-62 (2016).

25 B. Li, D. Louca, J. Niedziela, Z. Y. Li, L. B. Zhang, J. S. Zhou, and J. B. Goodenough, "Lattice and magnetic dynamics in perovskite Y1-xLaxTiO3," Physical Review B 94 (22), 7 (2016).

26 Yiwen Li, Yijun Xie, Zhao Wang, Nanzhi Zang, Fabio Carniato, Yuran Huang, Christopher M. Andolina, Lucas R. Parent, Treffly B. Ditri, Eric D. Walter, Mauro Botta, Jeffrey D. Rinehart, and Nathan C. Gianneschi, "Structure and Function of Iron-Loaded Synthetic Melanin," Acs Nano 10 (11), 10186-10194 (2016).

27 Ming Liu, Linjiang Chen, Scott Lewis, Samantha Y. Chong, Marc A. Little, Tom Hasell, Iain M. Aldous, Craig M. Brown, Martin W. Smith, Carole A. Morrison, Laurence J. Hardwick, and Andrew I. Cooper, "Three-dimensional protonic conductivity in porous organic cage solids," Nature Communications 7 (2016).

28 L. R. Middleton, J. D. Tarver, J. Cordaro, M. Tyagi, C. L. Soles, A. L. Frischknecht, and K. I. Winey, "Heterogeneous Chain Dynamics and Aggregate Lifetimes in Precise Acid-Containing Polyethylenes: Experiments and Simulations," Macromolecules 49 (23), 9176-9185 (2016).

29 S. K. Mishra, M. K. Gupta, R. Mittal, A. I. Kolesnikov, and S. L. Chaplot, "Spin-phonon coupling and high-pressure phase transitions of RMnO3 (R = Ca and Pr): An inelastic neutron scattering and first-principles study," Physical Review B 93 (21) (2016).

30 S. Mitra, V. K. Sharma, V. Garcia-Sakai, A. Orecchini, T. Seydel, M. Johnson, and R. Mukhopadhyay, "Enhancement of Lateral Diffusion in Catanionic Vesicles during Multilamellar-to-Unilamellar Transition," Journal of Physical Chemistry B 120 (15), 3777-3784 (2016).

31 Ryuhei Motokawa, Hitoshi Endo, Michihiro Nagao, and William T. Heller, "Neutron Polarization Analysis for Biphasic Solvent Extraction Systems," Solvent Extraction and Ion Exchange 34 (5), 399-406 (2016).

32 Shathabish NaraseGowda, Craig M. Brown, Madhusudan Tyagi, Timothy Jenkins, and Tabbetha A. Dobbins, "Quasi-Elastic Neutron Scattering Studies of Hydrogen Dynamics for Nanoconfined NaAIH(4)," Journal of Physical Chemistry C 120 (27), 14863-14873 (2016).

33 Jonathan D. Nickels, John Atkinson, Erzsebet Papp-Szabo, Christopher Stanley, Souleymane O. Diallo, Stefania Perticaroli, Benjamin Baylis, Perry Mahon, Georg Ehlers, John Katsaras, and John R. Dutcher, "Structure and Hydration of Highly-Branched, Monodisperse Phytoglycogen Nanoparticles," Biomacromolecules 17 (3), 735-743 (2016).

34 Alexander J. O'Malley, Iain Hitchcock, Misbah Sarwar, Ian P. Silverwood, Sheena Hindocha, C. Richard A. Catlow, Andrew P. E. York, and P. J. Collier, "Ammonia mobility in chabazite: insight into the diffusion component of the NH3-SCR process," Physical Chemistry Chemical Physics 18 (26), 17159-17168 (2016).

35 Alexander J. O'Malley, Victoria Garcia Sakai, Ian P. Silverwood, Nikolaos Dimitratos, Stewart F. Parker, and C. Richard A. Catlow, "Methanol diffusion in zeolite HY: a combined quasielastic neutron scattering and molecular dynamics simulation study," Physical Chemistry Chemical Physics 18 (26), 17294-17302 (2016).

36 Carin Osterberg, Henrik Fahlquist, Ulrich Haussermann, Craig M. Brown, Terrence J. Udovic, and Maths Karlsson, "Dynamics of Pyramidal SiH3- Ions in ASiH(3) (A = K and Rb) Investigated with Quasielastic Neutron Scattering," Journal of Physical Chemistry C 120 (12), 6369-6376 (2016).

37 N. C. Osti, A. Cote, E. Mamontov, A. Ramirez-Cuesta, D. J. Wesolowski, and S. O. Diallo, "Characteristic features of water dynamics in restricted geometries investigated with quasi-elastic neutron scattering," Chemical Physics 465, 1-8 (2016).

38 J. A. M. Paddison, H. S. Ong, J. O. Hamp, P. Mukherjee, X. J. Bai, M. G. Tucker, N. P. Butch, C. Castelnovo, M. Mourigal, and S. E. Dutton, "Emergent order in the kagome Ising magnet Dy3Mg2Sb3O14," Nature Communications 7, 8 (2016).

39 Aleksandra Pajzderska, Kacper Druzbicki, Anna Kiwilsza, Miguel Angel Gonzalez, Jacek Jenczyk, Stefan Jurga, Jadwiga Mielcarek, and Jan Wasicki, "On the molecular dynamics in long-acting calcium channel blocker lacidipine: solid-state NMR, neutron scattering and periodic DFT study," Rsc Advances 6 (71), 66617-66629 (2016).

40 Sumant Patankar, Siddharth Gautam, Gernot Rother, Andrey Podlesnyak, Georg Ehlers, Tingling Liu, David R. Cole, and David L. Tomasko, "Role of Confinement on Adsorption and Dynamics of Ethane and an Ethane-CO2 Mixture in Mesoporous CPG Silica," Journal of Physical Chemistry C 120 (9), 4843-4853 (2016).

41 Giuseppe Maria Paterno, J. Ross Stewart, Andrew Wildes, Franco Cacialli, and Victoria Garcia Sakai, "Neutron polarisation analysis of Polymer: Fullerene blends for organic photovoltaics," Polymer 105, 407-413 (2016).

42 Andrei A. Patrascu, Sergiu Calancea, Rafael A. Allao Cassaro, Stephane Soriano, Augustin M. Madalan, Catalin Maxim, Miguel A. Novak, Maria G. F. Vaz, and Marius Andruh, "One-dimensional coordination polymers constructed from binuclear 3d-4f nodes and isonicotinato spacer," Crystengcomm 18 (25), 4779-4786 (2016).

43 Tyler J. Pearson, Majed S. Fataftah, and Danna E. Freedman, "Enhancement of magnetic anisotropy in a Mn-Bi heterobimetallic complex," Chemical Communications 52 (76), 11394-11397 (2016).

44 Ruben Perez-Aguirre, Garikoitz Beobide, Oscar Castillo, Imanol de Pedro, Antonio Luque, Sonia Perez-Yanez, Jesus Rodriguez Fernandez, and Pascual Roman, "3D Magnetically Ordered Open Supramolecular Architectures Based on Ferrimagnetic Cu/Adenine/Hydroxide Heptameric Wheels," Inorganic Chemistry 55 (15), 7755-7763 (2016).

45 Mariusz Pietruszka and Aleksandra Haduch-Sendecka, "Effective diffusion rates and cross-correlation analysis of "acid growth'' data," Acta Physiologiae Plantarum 38 (2) (2016).

46 A. Podlesnyak, L. M. Anovitz, A. I. Kolesnikov, M. Matsuda, T. R. Prisk, S. Toth, and G. Ehlers, "Coupled antiferromagnetic spin-1/2 chains in green dioptase Cu-6 Si6O18 center dot 6H(2)O," Physical Review B 93 (6) (2016).

47 Ryan Poling-Skutvik, Katrina Irene S. Mongcopa, Antonio Faraone, Suresh Narayanan, Jacinta C. Conrad, and Ramanan Krishnamoorti, "Structure and Dynamics of Interacting Nanoparticles in Semidilute Polymer Solutions," Macromolecules 49 (17), 6568-6577 (2016).

48 Durgesh K. Rai, Veerendra K. Sharma, Divina Anunciado, Hugh O'Neill, Eugene Mamontov, Volker Urban, William T. Heller, and Shuo Qian, "Neutron Scattering Studies of the Interplay of Amyloid beta Peptide(1-40) and An Anionic Lipid 1,2-dimyristoyl-sn-glycero-3-phosphoglycerol," Scientific Reports 6 (2016).

49 Samira G. Reis, Matteo Briganti, Daniel O. T. A. Martins, Handan Akpinar, Sergiu Calancea, Guilherme P. Guedes, Stephane Soriano, Marius Andruh, Rafael A. A. Cassaro, Paul M. Lahti, Federico Totti, and Maria G. F. Vaz, "First coordination compounds based on a bis-(imino nitroxide) biradical and 4f metal ions: synthesis, crystal structures and magnetic properties," Dalton Transactions 45 (7), 2936-2944 (2016).

50 Samira G. Reis, Matteo Briganti, Stephane Soriano, Guilherme P. Guedes, Sergiu Calancea, Carmen Tiseanu, Miguel A. Novak, Miguel A. del Aguila-Sanchez, Federico Totti, Fernando Lopez-Ortiz, Marius Andruh, and Maria G. F. Vaz, "Binuclear Lanthanide-Radical Complexes Featuring Two Centers with Different Magnetic and Luminescence Properties," Inorganic Chemistry 55 (22), 11676-11684 (2016).

51 Kenneth A. Rubinson and Antonio Faraone, "The relative diffusive transport rate of SrI2 in water changes over the nanometer length scale as measured by coherent quasielastic neutron scattering," Physical Chemistry Chemical Physics 18 (18), 12707-12715 (2016).

52 Erkan Senses, Antonio Faraone, and Pinar Akcora, "Microscopic Chain Motion in Polymer Nanocomposites with Dynamically Asymmetric Interphases," Scientific Reports 6 (2016).

53 V. K. Sharma, E. Mamontov, M. Tyagi, and V. S. Urban, "Effect of alpha-Tocopherol on the Microscopic Dynamics of Dimyristoylphosphatidylcholine Membrane," Journal of Physical Chemistry B 120 (1), 154-163 (2016).

54 V. K. Sharma, E. Marnontov, M. Tyagi, S. Qian, D. K. Rai, and V. S. Urban, "Dynamical and Phase Behavior of a Phospholipid Membrane Altered by an Antimicrobial Peptide at Low Concentration," Journal of Physical Chemistry Letters 7 (13), 2394-2401 (2016).

55 M. N. Simon, I. Pascucci, S. Edwards, W. Feng, U. Gorti, D. Hollenbach, E. Rigliaco, and J. T. Keane, "TRACING SLOW WINDS FROM T TAURI STARS VIA LOW-VELOCITY FORBIDDEN LINE EMISSION," Astrophysical Journal 831 (2) (2016).

56 Veronique Sproll, Gergely Nagy, Urs Gasser, Jan Peter Embs, Marc Obiols-Rabasa, Thomas J. Schmidt, Lorenz Gubler, and Sandor Balog, "Radiation Grafted Ion-Conducting Membranes: The Influence of Variations in Base Film Nanostructure," Macromolecules 49 (11), 4253-4264 (2016).

57 Wan Si Tang, Mirjana Dimitrievska, Jean-Noel Chotard, Wei Zhou, Raphael Janot, Alexander V. Skripov, and Terrence J. Udovic, "Structural and Dynamical Trends in Alkali-Metal Silanides Characterized by Neutron-Scattering Methods," Journal of Physical Chemistry C 120 (38), 21218-21227 (2016).

58 C. M. Thompson, C. A. Marjerrison, A. Z. Sharma, C. R. Wiebe, D. D. Maharaj, G. Sala, R. Flacau, A. M. Hallas, Y. Cai, B. D. Gaulin, G. M. Luke, and J. E. Greedan, "Frustrated magnetism in the double perovskite La2LiOsO6: A comparison with La2LiRuO6," Physical Review B 93 (1) (2016).

59 Ruoming Tian, Gordon J. Kearley, Dehong Yu, Chris D. Ling, Pham Anh, Jan P. Embs, Elvis Shoko, and Sean Li, "Phononic Structure Engineering: the Realization of Einstein Rattling in Calcium Cobaltate for the Suppression of Thermal Conductivity," Scientific Reports 6 (2016).

60 V. Vaissier, V. G. Sakai, X. Li, J. T. Cabral, J. Nelson, and P. R. F. Barnes, "How mobile are dye adsorbates and acetonitrile molecules on the surface of TiO2 nanoparticles? A quasi-elastic neutron scattering study," Scientific Reports 6, 8 (2016).

61 Clinton G. Wiener, Madhusudan Tyagi, Yun Liu, R. A. Weiss, and Bryan D. Vogt, "Supramolecular Hydrophobic Aggregates in Hydrogels Partially Inhibit Ice Formation," Journal of Physical Chemistry B 120 (24), 5543-5552 (2016).

62 Junjie Yang, Anjana M. Samarakoon, Kyun Woo Hong, John R. D. Copley, Qingzhen Huang, Alan Tennant, Taku J. Sato, and Seung-Hun Lee, "Glassy Behavior and Isolated Spin Dimers in a New Frustrated Magnet BaCr9pGa12-9pO19," Journal of the Physical Society of Japan 85 (9) (2016).

63 Panchao Yin, Bin Wu, Eugene Mamontov, Luke L. Daemen, Yonqiang Cheng, Tao Lo, Soenke Seifert, Kunlun Hong, Peter V. Bonnesen, Jong Kahk Keum, and Anibal J. Ramirez-Cuesta, "X-ray and Neutron Scattering Study of the Formation of Core-Shell-Type Polyoxometalates," Journal of the American Chemical Society 138 (8), 2638-2643 (2016).

64 Joseph M. Zadrozny, Samuel M. Greer, Stephen Hill, and Danna E. Freedman, "A flexible iron(II) complex in which zero-field splitting is resistant to structural variation," Chemical Science 7 (1), 416-423 (2016).

65 Sven Ziegenbalg, David Hornig, Helmar Goerls, and Winfried Plass, "Cobalt(II)-Based Single-Ion Magnets with Distorted Pseudotetrahedral N2O2 Coordination: Experimental and Theoretical Investigations," Inorganic Chemistry 55 (8), 4047-4058 (2016).



2015 (48 publications)

Scattering Methods in Complex Fluids,
Sow-Hsin Chen, Piero Tartaglia,
Cambridge University Press (2015). DOI:

Study of solvent relaxation of pristine succinonitrile and succinonitrile–salt mixtures using quasielastic neutron scattering,
Supti Das and S. Mitra and J. Combet and R. Mukhopadhyay and Aninda J. Bhattacharyya,
Solid State Ionics 279, 72 (2015). DOI: 10.1016/j.ssi.2015.07.019

Structure and Dynamics of Aqueous Dispersions of Highly-Branched Monodisperse Phytoglycogen Nanoparticles,
Atkinson, John,
M.Sc. Thesis, Dep't of Physics, University of Guelph (2015). DOI:

Ionogel based on biopolymer–silica interpenetrated networks: dynamics of confined ionic liquid with lithium salt,
Cerclier, Carole V. and Zanotti, Jean-Marc and Bideau, Jean Le,
Phys. Chem. Chem. Phys. 17, 29707 (2015). DOI: 10.1039/C5CP04889C

Investigation of low-dimensional and frustrated spin-1/2 magnets,
Christian Balz,
M.Sc. Thesis, Technischen Universität Berlin (2015). DOI:

Quasielastic neutron scattering studies on glass-forming ionic liquids with imidazolium cations,
Kofu, Maiko and Tyagi, Madhusudan and Inamura, Yasuhiro and Miyazaki, Kyoko and Yamamuro, Osamu,
J. Chem. Phys. 143, 234502, (2015). DOI: 10.1063/1.4937413

Relationship between Structural Relaxation, Shear Viscosity, and Ionic Conduction of LiPF6/Propylene Carbonate Solutions,
Yamaguchi, Tsuyoshi and Yonezawa, Takuya and Yoshida, Koji and Yamaguchi, Toshio and Nagao, Michihiro and Faraone, Antonio and Seki, Shiro,
J. Phys. Chem. B 119, 15675 (2015). DOI: 10.1021/acs.jpcb.5b08701

Gapped and gapless short-range-ordered magnetic states with (1/2,1/2,1/2) wave vectors in the pyrochlore magnet Tb2+xTi2-xO7+delta,
Kermarrec, E. and Maharaj, D. D. and Gaudet, J. and Fritsch, K. and Pomaranski, D. and Kycia, J. B. and Qiu, Y. and Copley, J. R. D. and Couchman, M. M. P. and Morningstar, A. O. R. and Dabkowska, H. A. and Gaulin, B. D.,
Phys. Rev. B 92, 245114 (2015). DOI: 10.1103/PhysRevB.92.245114

Pressure Effect on the Boson Peak in Deeply Cooled Confined Water: Evidence of a Liquid-Liquid Transition,
Wang, Zhe and Kolesnikov, Alexander I. and Ito, Kanae and Podlesnyak, Andrey and Chen, Sow-Hsin,
Phys. Rev. Lett. 115, 235701 (2015). DOI: 10.1103/PhysRevLett.115.235701

Observation of drastic change of generalized phonon density-of-states in nanostructured half-Heusler using inelastic neutron scattering,
Wong-Ng, W. and Lynn, J. W. and Huang, Q. and Brown, C. M. and Kaduk, J. A. and Joshi, G.,
Appl. Phys. Lett. 107, 213901 (2015). DOI: 10.1063/1.4936163

Effects of pressure on the dynamics of an oligomeric protein from deep-sea hyperthermophile,
Shrestha, Utsab R. and Bhowmik, Debsindhu and Copley, John R. D. and Tyagi, Madhusudan and Leao, Juscelino B. and Chu, Xiang-qiang,
Proc. Natl. Acad. Sci. U. S. A. 112, 13886 (2015). DOI: 10.1073/pnas.1514478112

Enhanced spin-phonon-electronic coupling in a 5d oxide,
Calder, S. and Lee, J. H. and Stone, M. B. and Lumsden, M. D. and Lang, J. C. and Feygenson, M. and Zhao, Z. and Yan, J. -Q. and Shi, Y. G. and Sun, Y. S. and Tsujimoto, Y. and Yamaura, K. and Christianson, A. D.,
Nat. Commun. 6, 8916 (2015). DOI: 10.1038/ncomms9916

Neutron spectroscopic study of crystalline electric field excitations in stoichiometric and lightly stuffed Yb2Ti2O7,
Gaudet, J. and Maharaj, D. D. and Sala, G. and Kermarrec, E. and Ross, K. A. and Dabkowska, H. A. and Kolesnikov, A. I. and Granroth, G. E. and Gaulin, B. D.,
Phys. Rev. B 92, 134420 (2015). DOI: 10.1103/PhysRevB.92.134420

Magnetic Transitions in Iron Porphyrin Halides by Inelastic Neutron Scattering and Ab Initio Studies of Zero-Field Splittings,
Stavretis, Shelby E. and Atanasov, Mihail and Podlesnyak, Andrey A. and Hunter, Seth C. and Neese, Frank and Xue, Zi-Ling,
Inorg. Chem. 54, 9790 (2015). DOI: 10.1021/acs.inorgchem.5b01505

Electron Hopping through Double-Exchange Coupling in a Mixed-Valence Diiminobenzoquinone-Bridged Fe-2 Complex,
Gaudette, Alexandra I. and Jeon, Ie-Rang and Anderson, John S. and Grandjean, Fernande and Long, Gary J. and Harris, T. David,
J. Am. Chem. Soc. 137, 12617 (2015). DOI: 10.1021/jacs.5b07251

Quasielastic neutron scattering study of tetrahydroborate anion dynamical perturbations in sodium borohydride due to partial halide anion substitution,
Verdal, Nina and Udovic, Terrence J. and Rush, John J. and Skripov, Alexander V.,
J. Alloy. Compd. 645, S513 (2015). DOI: 10.1016/j.jallcom.2014.12.070

A general and Eu specific perspective on lattice dynamics in pyrochlore and defect fluorite (Eu1-xNdx)(2)Zr2O7,
Klobes, Benedikt and Finkeldei, Sarah and Brandt, Felix and Bosbach, Dirk and Bessas, Dimitrios and Embs, Jan-Peter and Hermann, Raphael P.,
Phys. Status Solidi B-Basic Solid State Phys. 252, 1940 (2015). DOI: 10.1002/pssb.201552076

Direct Observation of Coupling between Structural Fluctuation and Ultrafast Hydration Dynamics of Fluorescent Probes in Anionic Micelles,
Choudhury, Susobhan and Mondal, Prasanna Kumar and Sharma, V. K. and Mitra, S. and Sakai, V. Garcia and Mukhopadhyay, R. and Pal, Samir Kumar,
J. Phys. Chem. B 119, 10849 (2015). DOI: 10.1021/jp511899q

Proton Diffusivity in the Protic Ionic Liquid Triethylammonium Triflate Probed by Quasielastic Neutron Scattering,
Burankova, Tatsiana and Hempelmann, Rolf and Fossog, Verlaine and Ollivier, Jacques and Seydel, Tilo and Embs, Jan P.,
J. Phys. Chem. B 119, 10643 (2015). DOI: 10.1021/acs.jpcb.5b04000

Differential Microscopic Mobility of Components within a Deep Eutectic Solvent,
Wagle, Durgesh V. and Baker, Gary A. and Mamontov, Eugene,
J. Phys. Chem. Lett. 6, 2924 (2015). DOI: 10.1021/acs.jpclett.5b01192

Coincidence of collective relaxation anomaly and specific heat peak in a bulk metallic glass-forming liquid,
Jaiswal, Abhishek and Podlesynak, Andrey and Ehlers, Georg and Mills, Rebecca and O'Keeffe, Stephanie and Stevick, Joseph and Kempton, James and Jelbert, Glenton and Dmowski, Wojciech and Lokshin, Konstantin and Egami, Takeshi and Zhang, Yang,
Phys. Rev. B 92, 024202 (2015). DOI: 10.1103/PhysRevB.92.024202

Tuning Membrane Thickness Fluctuations in Model Lipid Bilayers,
Ashkar, Rana and Nagao, Michihiro and Butler, Paul D. and Woodka, Andrea C. and Sen, Mani K. and Koga, Tadanori,
Biophys. J. 109, 106 (2015). DOI: 10.1016/j.bpj.2015.05.033

First Non-Centrosymmetric Deca-Vanadoborate with Borate Vacancies, Self-Assembled around a 1,3-Propanediammonium Cation,
Munoz-Becerra, Karina and Hermosilla-Ibanez, Patricio and Le Fur, Eric and Cador, Olivier and Paredes-Garcia, Veronica and Spodine, Evgenia and Venegas-Yazigi, Diego,
Cryst. Growth Des. 15, 2561 (2015). DOI: 10.1021/acs.cgd.5b00102

Zero-Field Splitting in \{Mn-3(III)((3)-O)\} Core Single-Molecule Magnets Investigated by Inelastic Neutron Scattering and High-Field Electron Paramagnetic Resonance Spectroscopy,
Sigrist, Marc and Tregenna-Piggott, Philip L. W. and Pedersen, Kasper S. and Sorensen, Mikkel A. and Barra, Anne-Laure and Hauser, Juerg and Liu, Shi-Xia and Decurtins, Silvio and Mutka, Hannu and Bendix, Jesper,
Eur. J. Inorg. Chem. (2015). DOI: 10.1002/ejic.201500084

Magnetic order in alpha-RuCl3: A honeycomb-lattice quantum magnet with strong spin-orbit coupling,
Sears, J. A. and Songvilay, M. and Plumb, K. W. and Clancy, J. P. and Qiu, Y. and Zhao, Y. and Parshall, D. and Kim, Young-June,
Phys. Rev. B 91, 144420 (2015). DOI: 10.1103/PhysRevB.91.144420

A Spin-Frustrated Trinuclear Copper Complex Based on Triaminoguanidine with an Energetically Well-Separated Degenerate Ground State,
Spielberg, Eike T. and Gilb, Aksana and Plaul, Daniel and Geibig, Daniel and Hornig, David and Schuch, Dirk and Buchholz, Axel and Ardavan, Arzhang and Plass, Winfried,
Inorg. Chem. 54, 3432 (2015). DOI: 10.1021/ic503095t

Structural Behavior of Li2B10H10,
Wu, Hui and Tang, Wan Si and Stavila, Vitalie and Zhou, Wei and Rush, John J. and Udovic, Terrence J.,
J. Phys. Chem. C 119, 6481 (2015). DOI: 10.1021/acs.jpcc.5b00533

Nanoscopic Dynamics of Phospholipid in Unilamellar Vesicles: Effect of Gel to Fluid Phase Transition,
Sharma, V. K. and Mamontov, E. and Anunciado, D. B. and O'Neill, H. and Urban, V.,
J. Phys. Chem. B 119, 4460 (2015). DOI: 10.1021/acs.jpcb.5b00220

Monitoring the dynamics of miscible P3HT:PCBM blends: A quasi elastic neutron scattering study of organic photovoltaic active layers,
Etampawala, Thusitha and Ratnaweera, Dilru and Morgan, Brian and Diallo, Souleymane and Mamontov, Eugene and Dadmun, Mark,
Polymer 61, 155 (2015). DOI: 10.1016/j.polymer.2015.01.064

Reconciliation of local and long-range tilt correlations in underdoped La2-xBaxCuO4 (0 <= x <= 0.155),
Bozin, Emil S. and Zhong, Ruidan and Knox, Kevin R. and Gu, Genda and Hill, John P. and Tranquada, John M. and Billinge, Simon J. L.,
Phys. Rev. B 91, 054521 (2015). DOI: 10.1103/PhysRevB.91.054521

Frustrated fcc antiferromagnet Ba2YOsO6: Structural characterization, magnetic properties, and neutron scattering,
Kermarrec, E. and Marjerrison, C. A. and Thompson, C. M. and Maharaj, D. D. and Levin, K. and Kroeker, S. and Granroth, G. E. and Flacau, R. and Yamani, Z. and Greedan, J. E. and Gaulin, B. D.,
Phys. Rev. B 91, 075133 (2015). DOI: 10.1103/PhysRevB.91.075133

Understanding the Decreased Segmental Dynamics of Supported Thin Polymer Films Reported by Incoherent Neutron Scattering,
Ye, Changhuai and Wiener, Clinton G. and Tyagi, Madhusudan and Uhrig, David and Orski, Sara V. and Soles, Christopher L. and Vogt, Bryan D. and Simmons, David S.,
Macromolecules 48, 801 (2015). DOI: 10.1021/ma501780g

Symmetry and correlations underlying hidden order in URu2Si2,
Butch, Nicholas P. and Manley, Michael E. and Jeffries, Jason R. and Janoschek, Marc and Huang, Kevin and Maple, M. Brian and Said, Ayman H. and Leu, Bogdan M. and Lynn, Jeffrey W.,
Phys. Rev. B 91, 035128 (2015). DOI: 10.1103/PhysRevB.91.035128

Strong competition between orbital ordering and itinerancy in a frustrated spinel vanadate,
Ma, J. and Lee, J. H. and Hahn, S. E. and Hong, Tao and Cao, H. B. and Aczel, A. A. and Dun, Z. L. and Stone, M. B. and Tian, W. and Qiu, Y. and Copley, J. R. D. and Zhou, H. D. and Fishman, R. S. and Matsuda, M.,
Phys. Rev. B 91, 020407 (2015). DOI: 10.1103/PhysRevB.91.020407

Square-Planar Ruthenium(II) Complexes: Control of Spin State by Pincer Ligand Functionalization,
Askevold, Bjorn and Khusniyarov, Marat M. and Kroener, Wolfgang and Gieb, Klaus and Mueller, Paul and Herdtweck, Eberhardt and Heinemann, Frank W. and Diefenbach, Martin and Holthausen, Max C. and Vieru, Veacheslav and Chibotaru, Liviu F. and Schneider, Sven,
Chem.-Eur. J. 21, 579 (2015). DOI: 10.1002/chem.201404282

Unparalleled lithium and sodium superionic conduction in solid electrolytes with large monovalent cage-like anions,
Tang, Wan Si and Unemoto, Atsushi and Zhou, Wei and Stavila, Vitalie and Matsuo, Motoaki and Wu, Hui and Orimo, Shin-ichi and Udovic, Terrence J.,
Energy Environ. Sci. 8, 3637 (2015). DOI: 10.1039/c5ee02941d

Anomalous and anisotropic nanoscale diffusion of hydration water molecules in fluid lipid membranes,
Toppozini, Laura and Roosen-Runge, Felix and Bewley, Robert I. and Dalgliesh, Robert M. and Perring, Toby and Seydel, Tilo and Glyde, Henry R. and Sakai, Victoria Garcia and Rheinstaedter, Maikel C.,
Soft Matter 11, 8354 (2015). DOI: 10.1039/c5sm01713k

A series of tetraazalene radical-bridged M-2 (M = Cr-III, Mn-II, Fe-II, Co-II) complexes with strong magnetic exchange coupling,
DeGayner, Jordan A. and Jeon, Ie-Rang and Harris, T. David,
Chem. Sci. 6, 6639 (2015). DOI: 10.1039/c5sc02725j

Europium complexes with 1,2-bis(arylimino)acenaphthenes: a search for redox isomers,
Fedushkin, I. L. and Skatova, A. A. and Yambulatov, D. S. and Cherkasov, A. V. and Demeshko, S. V.,
Russ. Chem. Bull. 64, 38 (2015). DOI: 10.1007/s11172-015-0817-6

Effect of antimicrobial peptide on the dynamics of phosphocholine membrane: role of cholesterol and physical state of bilayer,
Sharma, V. K. and Mamontov, E. and Anunciado, D. B. and O'Neill, H. and Urban, V. S.,
Soft Matter 11, 6755 (2015). DOI: 10.1039/c5sm01562f

Heptacopper(II) and dicopper(II)-adenine complexes: synthesis, structural characterization, and magnetic properties,
Leite Ferreira, B. J. M. and Brandao, Paula and Dos Santos, A. M. and Gai, Z. and Cruz, C. and Reis, M. S. and Santos, T. M. and Felix, V.,
J. Coord. Chem. 68, 2770 (2015). DOI: 10.1080/00958972.2015.1061126

On the relaxation dynamics in active pharmaceutical ingredients: solid-state 1H NMR{,} quasi-elastic neutron scattering and periodic DFT study of acebutolol hydrochloride,
Pajzderska, A. and Druzbicki, K. and Kiwilsza, A. and Gonzalez, M. A. and Jarek, M. and Mielcarek, J. and Wasicki, J.,
RSC Adv. (2015). DOI: 10.1039/C5RA08937A

Painting biological low-frequency vibrational modes from small peptides to proteins,
Perticaroli, S. and Russo, D. and Paolantoni, M. and Gonzalez, M. A. and Sassi, P. and Nickels, J. D. and Ehlers, G. and Comez, L. and Pellegrini, E. and Fioretto, D. and Morresi, A.,
Phys. Chem. Chem. Phys. 17, 11423 (2015). DOI: 10.1039/c4cp05388e

Encapsulation of paclitaxel into a bio-nanocomposite. A study combining inelastic neutron scattering to thermal analysis and infrared spectroscopy,
Martins, Murillo L. and Orecchini, Andrea and Aguilera, Luis and Eckert, Juergen and Embs, Jan and Matic, Aleksander and Saeki, Margarida J. and Bordallo, Heloisa N.,
EPJ Web of Conferences 83, 02011 (2015). DOI: 10.1051/epjconf/20158302011

Protein and solvent dynamics of the water-soluble chlorophyll-binding protein (WSCP),
Leonid Rusevich, Jan Embs, Inga Bektas, Harald Paulsen, Gernot Renger and Jorg Pieper,
EPJ Web of Conferences 83, 02016 (2015). DOI: 10.1051/epjconf/20158302016

Pressure-induced molten globule state of human acetylcholinesterase: structural and dynamical changes monitored by neutron scattering,
Marion, J. and Trovaslet, M. and Martinez, N. and Masson, P. and Schweins, R. and Nachon, F. and Trapp, M. and Peters, J.,
Phys. Chem. Chem. Phys. 17, 3157 (2015). DOI: 10.1039/C4CP02992E

Square-Planar Ruthenium(II) Complexes: Control of Spin State by Pincer Ligand Functionalization,
B. Askevold, M.M. Khusniyarov, W. Kroener, K. Gieb, P. Muller, E. Herdtweck, F.W. Heinemann, M. Diefenbach, M.C. Holthausen, V. Vieru, L.F. Chibotaru and S. Schneider,
Chem. Eur. J. 21, 579 (2015). DOI: 10.1002/chem.201404282

Effect of nanocrystallinity on lattice dynamics in Bi2Te3 based thermoelectrics,
Klobes, B. and Bessas, D. and Juranyi, F. and Goerlitz, H. and Pacheco, V. and Hermann, R. P.,
Phys. Status Solidi-Rapid Res. Lett. 9, 57 (2015). DOI: 10.1002/pssr.201409479



2014 (51 publications)

Observation of distinct atomic relaxation process in a phase-separated metallic glass-forming melt,
Yuxiang Huang and Wong K. Kin and Si Lan and Jan P. Embs and Du Qing and Zhaoping Lu and Xun-Li Wang and Suresh M. Chathoth,
Europhysics Letters 108, 46001 (2014). DOI: 10.1209/0295-5075/108/46001

M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal–Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites, Matthew T. Kapelewski, Stephen J. Geier, Matthew R. Hudson, David Stück, Jarad A. Mason, Jocienne N. Nelson, Dianne J. Xiao, Zeric Hulvey, Elizabeth Gilmour, Stephen A. FitzGerald, Martin Head-Gordon, Craig M. Brown, and Jeffrey R. Long, J. Am. Chem. Soc. 136, 12119 (2014). DOI: 10.1021/ja506230r

Dynamics and structure of ionic liquids by means of neutron scattering, Tatsiana Burankova, Doctoral thesis, Universitat des Saarlandes (2014). DOI: http://scidok.sulb.uni-saarland.de/volltexte/2014/5817/

Hydrogen storage in light alkali-cluster intercalated fullerides, Mattia Gaboardi, Doctoral thesis, Universita degli studi di Parma. Dipartimento di Fisica e Scienze della Terra "Macedonio Melloni" (2014). DOI: http://hdl.handle.net/1889/2453

Neutron Scattering Studies of Unusual Spin Structure and Local Correlation in Complex Oxides , Dalgis Mesa, Doctoral thesis, Physics & Astronomy, Louisiana State University (2014). DOI: http://etd.lsu.edu/docs/available/etd-04092014-022214/

Lithium Based Ionogel as Solid State Electrolyte: Dynamics of Confined Ionic Liquid, a Neutron Diffusion Study, Carole Cerclier, Jean-Marc Zanotti, Jan Embs and Jean Le Bideau, ECS Trans. 64, 27 (2014). DOI: 10.1149/06404.0027ecst

High-pressure dynamics of hydrated protein in bioprotective trehalose environment, S. O. Diallo, Q. Zhang, H. O'Neill, and E. Mamontov, Phys. Rev. E 90, 042725 (2014). DOI: 10.1103/PhysRevE.90.042725

Collective Ion Diffusion and Localized Single Particle Dynamics in Pyridinium-Based Ionic Liquids, Tatsiana Burankova, Rolf Hempelmann, Andrew Wildes, and Jan P. Embs, J. Phys. Chem. B 118, 14452 (2014). DOI: 10.1021/jp5092416

Effect of nanocrystallinity on lattice dynamics in Bi2Te3 based thermoelectrics, B. Klobes, D. Bessas, F. Juranyi, H. Gorlitz, V. Pacheco, R. P. Hermann, Phys. Status Solidi PRL, 1-5 (2014). DOI: 10.1002/pssr.201409479

Mantid-Data analysis and visualization package for neutron scattering and mu SR experiments, O. Arnold, J.C. Bilheux, J.M. Borreguero, A. Buts, S.I. Campbell, L. Chapon, M. Doucet, N. Draper, R.F. Leal, M.A. Gigg, V.E. Lynch, A. Markyardsen, D.J. Mikkelson, R.L. Mikkelson, R. Miller, K. Palmen, P. Parker, G. Passos, T.G. Perring, P.F. Peterson, S. Ren, M.A. Reuter, A.T. Sayici, J.W. Taylor, R.J. Taylor, R. Tolchenoy, W. Zhou and J. Zikoysky, Nucl. Instr. Meth. Phys. Res. 764, 156 (2014). DOI: 10.1016/j.nima.2014.07.029

Observation of distinct atomic relaxation process in a phase-separated metallic glass-forming melt, Y.X. Huang, W.K. Kin, S. Lan, J.P. Embs, D. Qing, Z.P. Lu, X.L. Wang and S.M. Chathoth, Europhys. Lett. 108, 46001 (2014). DOI: 10.1209/0295-5075/108/46001

The influence of a hierarchical porous carbon network on the coherent dynamics of a nanoconfined room temperature ionic liquid: A neutron spin echo and atomistic simulation investigation, J.L. Banuelos, G. Feng, P.F. Fulvio, S. Li, G. Rother, N. Arend, A. Faraone, S. Dai, P.T. Cummings and D.J. Wesolowski, Carbon 78, 415 (2014). DOI: 10.1016/j.carbon.2014.07.020

Synthesis, crystal structures and magnetic behaviour of four coordination compounds constructed with a phosphinic amide-TEMPO radical and [M(hfac)2] (M = CuII, CoII and MnII), Samira G. Reis, Miguel A. del Aguila-Sanchez, Guilherme P. Guedes, Glaucio B. Ferreira, Miguel A. Novak, Nivaldo L. Speziali, Fernando Lopez-Ortiz and Maria G. F. Vaz, Dalton Trans. 43, 14889 (2014). DOI: 10.1039/C4DT01444H

Encapsulation of the 4-Mercaptobenzoate Ligand by Macrocyclic Metal Complexes: Conversion of a Metallocavitand to a Metalloligand, J. Lach, A. Jeremies, D. Breite, B. Abel, B. Mahns, M. Knupfer, V. Matulis, Q.A. Ivashkevich and B. Kersting, Inorg. Chem. 53, 10825 (2014). DOI: 10.1021/ic500683f

Direct measurement of the spin gap in a quasi-one-dimensional clinopyroxene: NaTiSi2O6, Harlyn J. Silverstein, Alison E. Smith, Cole Mauws, Douglas L. Abernathy, Haidong Zhou, Zhiling Dun, Johan van Lierop, and Christopher R. Wiebe, Phys. Rev. B 90, 140402(R) (2014). DOI: 10.1103/PhysRevB.90.140402

Temperature-Dependent Dynamics of Dry and Hydrated beta-Casein Studied by Quasielastic Neutron Scattering, G.K. Dhindsa, M. Tyagi and X.Q. Chu, J. Phys. Chem. B 118, 10821 (2014). DOI: 10.1021/jp504548w

Picosecond Dynamic Heterogeneity, Hopping, and Johari-Goldstein Relaxation in Glass-Forming Liquids, Marcus T. Cicerone, Qin Zhong, and Madhusudan Tyagi, Phys. Rev. Lett. 113, 117801 (2014). DOI: 10.1103/PhysRevLett.113.117801

From Spin Glass to Quantum Spin Liquid Ground States in Molybdate Pyrochlores, L. Clark, G.J. Nilsen, E. Kermarrec, G. Ehlers, K.S. Knight, A. Harrison, J.P. Attfield, and B.D. Gaulin, Phys. Rev. Lett. 113, 117201 (2014). DOI: 10.1103/PhysRevLett.113.117201

Diffusive and rotational dynamics of condensed n-H2 confined in MCM-41, T. R. Prisk, M. S. Bryan and P. E. Sokol, Phys. Chem. Chem. Phys. 16, 17960 (2014). DOI: 10.1039/C4CP02281E

Quasi-Elastic Neutron Scattering Reveals Fast Proton Diffusion in Ca-Doped LaPO4, A. al-Wahish, N. Jalarvo, Z.H. Bi, K.W. Herwig, C. Bridges, M.P. Paranthaman and D. Mandrus, J. Phys. Chem. C 118, 20112 (2014). DOI: 10.1021/jp5048425

Exchange Interactions at the Origin of Slow Relaxation of the Magnetization in {TbCu3} and {DyCu3} Single-Molecule Magnets, F.J. Kettles, V.A. Milway, F. Tuna, R. Valiente, L.H. Thomas, W. Wernsdorfer, S.T. Ochsenbein and M. Murrie, Inorg. Chem. 53, 8970 (2014). DOI: 10.1021/ic500885r

A chiral two-dimensional coordination polymer based on Cu-II and (S)-4,4 '-bis(4-carboxyphenyl)-2,2 '-bis(diphenylphosphinoyl)-1,1 '-binaphthyl: Synthesis, structure, and magnetic and optical properties, W.W. Lestari, P. Lonnecke, H.C. Streit, F. Schleife, C. Wickleder and E. Hey-Hawkins, Inorg. Chim. Acta 421, 392 (2014). DOI: 10.1016/j.ica.2014.06.006

Proton dynamics of two-dimensional oxalate-bridged coordination polymers, Satoshi Miyatsu, Maiko Kofu, Atsushi Nagoe, Takeshi Yamada, Masaaki Sadakiyo, Teppei Yamada, Hiroshi Kitagawa, Madhusudan Tyagi, Victoria Garcia Sakai and Osamu Yamamuro, Phys. Chem. Chem. Phys. 16, 17295 (2014). DOI: 10.1039/C4CP01432D

Anion Reorientations in the Superionic Conducting Phase of Na2B12H12, N. Verdal, T.J. Udovic, V. Stavila, W.S. Tang, J.J. Rush and A.V. Skripov, J. Phys. Chem. C 118, 17483 (2014). DOI: 10.1021/jp506252c

Kinetic Trapping of D-2 in MIL-53(Al) Observed Using Neutron Scattering, R.A. Pollock, J.H. Her, C.M. Brown, Y. Liu and A. Dailly, J. Phys. Chem. C 118, 18197 (2014). DOI: 10.1021/jp504870n

Correlation of the dynamics of native human acetylcholinesterase and its inhibited huperzine A counterpart from sub-picoseconds to nanoseconds, M. Trapp, M. Tehei, M. Trovaslet, F. Nachon, N. Martinez, M.M. Koza, M. Weik, P. Masson and J. Peters, J. R. Soc. Interface 11, issue 97, nos 20140372 (2014). DOI: 10.1098/rsif.2014.0372

Power spectrum, growth velocities and cross-correlations of longitudinal and transverse oscillations of individual Nicotiana tabacum pollen tube, A. Haduch-Sendecka, M. Pietruszka and P. Zajdel, Planta 240, 263 (2014). DOI: 10.1007/s00425-014-2083-5

Synthesis and characterization of 5-amino-1,3-di-tert-butyl-2H-tetrazol-1-ium bis[di-mu-chlorido-bis[dichloridocuprate(II)]], S.V. Voitekhovich, A.S. Lyakhov, L.S. Ivashkevich, F. Schleife, R. Schnorr, B. Kersting and P.N. Gaponik, Inorg. Chim. Acta 419, 124 (2014). DOI: 10.1016/j.ica.2014.05.008

Temperature and magnetic field dependence of spin-ice correlations in the pyrochlore magnet Tb2Ti2O7, K. Fritsch, E. Kermarrec, K. A. Ross, Y. Qiu, J. R. D. Copley, D. Pomaranski, J. B. Kycia, H. A. Dabkowska, and B. D. Gaulin, Phys. Rev. B 90, 014429 (2014). DOI: 10.1103/PhysRevB.90.014429

Dynamics of water in prussian blue analogues: Neutron scattering study, V. K. Sharma, S. Mitra, N. Thakur, S. M. Yusuf, Fanni Juranyi and R. Mukhopadhyay, J. Appl. Phys. 116, 034909 (2014). DOI: 10.1063/1.4890722

New Families of Hetero-tri-spin 2p-3d-4f Complexes: Synthesis, Crystal Structures, and Magnetic Properties, L.B.L. Escobar, G.P. Guedes, S. Soriano, N.L. Speziali, A.K. Jordao, A.C. Cunha, V.F. Ferreira, C. Maxim, M.A. Novak, M. Andruh, and M.G.F. Vaz, Inorg. Chem. 53, 7508 (2014). DOI: 10.1021/ic5008044

Resolving diffusion in clay minerals at different time scales: Combination of experimental and modeling approaches, S.V. Churakov, T. Gimmi, T. Unruh, L.R. Van Loon, and F. Juranyi, Appl. Clay Sci. 96, 36 (2014). DOI: 10.1016/j.clay.2014.04.030

Interrelationship between Number of Mobile Protons, Diffusion Coefficient, and AC Conductivity in Superprotonic Conductors, CsHSO4 and Rb3H(SeO4)2, Kazuya Kamazawa, Masashi Harada, Toru Araki, Yasumitsu Matsuo, Madhusudan Tyagi, and Jun Sugiyama, J. Phys. Soc. Jpn. 83, 074604 (2014). DOI: 10.7566/JPSJ.83.074604

Multiple high-temperature transitions driven by dynamical structures in NaI, M. E. Manley, J. R. Jeffries, H. Lee, N. P. Butch, A. Zabalegui, and D. L. Abernathy, Phys. Rev. B 89, 224106 (2014). DOI: 10.1103/PhysRevB.89.224106

Experimental and Solid-State Computational Study of Structural and Dynamic Properties in the Equilibrium Form of Temazepam, A. Pajzderska, K. Druzbicki, M.A. Gonzalez, J. Jenczyk, B. Peplinska, M. Jarek, J. Mielcarek, and J. Wasicki, J. Phys. Chem. B 118, 6670 (2014). DOI: 10.1021/jp502609b

Incoherent Quasielastic Neutron Scattering Study of the Relaxation Dynamics in Molybdenum-Oxide Keplerate-Type Nanocages, A. Faraone, E. Fratini, S. Garai, A. Muller, M. Tyagi, T. Jenkins, E. Mamontov, R.L. Paul, J.R.D. Copley and P. Baglioni, J. Phys. Chem. C 118, 13300 (2014). DOI: 10.1021/jp504547z

Rigidity, Secondary Structure, and the Universality of the Boson Peak in Proteins, S. Perticaroli, J.D. Nickels, G. Ehlers and A.P. Sokolov, Biophys. J. 106, 2667 (2014). DOI: 10.1016/j.bpj.2014.05.009

Boson Peak in Deeply Cooled Confined Water: A Possible Way to Explore the Existence of the Liquid-to-Liquid Transition in Water, Zhe Wang, Kao-Hsiang Liu, Peisi Le, Mingda Li, Wei-Shan Chiang, Juscelino B. Leao, John RD. Copley, Madhusudan Tyagi, Andrey Podlesnyak, Alexander I. Kolesnikov, Chung-Yuan Mou, and Sow-Hsin Chen, Phys. Rev. Lett. 112, 237802 (2014). DOI: 10.1103/PhysRevLett.112.237802

Magnetic ordering induced by interladder coupling in the spin-1/2 Heisenberg two-leg ladder antiferromagnet C9H18N2CuBr4, Tao Hong, K. P. Schmidt, K. Coester, F. F. Awwadi, M. M. Turnbull, Y. Qiu, J. A. Rodriguez-Rivera, M. Zhu, X. Ke, C. P. Aoyama, Y. Takano, Huibo Cao, W. Tian, J. Ma, R. Custelcean, H. D. Zhou, and M. Matsuda, Phys. Rev. B 89, 174432 (2014). DOI: 10.1103/PhysRevB.89.174432

Magnetic Interactions through Fluoride: Magnetic and Spectroscopic Characterization of Discrete, Linearly Bridged [Mn-2(III)(mu-F)F-4(Me(3)tacn)(2)](PF6), K. S. Pedersen, M. Sigrist, H. Weihe, A. D. Bond, C. A. Thuesen, K. P. Simonsen, T. Birk, H. Mutka, A-L. Barra, J. Bendix, Inorg. Chem. 53, 5013 (2014). DOI: 10.1021/ic500049w

Fragile antiferromagnetism in the heavy-fermion compound YbBiPt, B. G. Ueland, A. Kreyssig, K. Prokes, J. W. Lynn, L. W. Harriger, D. K. Pratt, D. K. Singh, T. W. Heitmann, S. Sauerbrei, S. M. Saunders, E. D. Mun, S. L. Bud'ko, R. J. McQueeney, P. C. Canfield, A. I. Goldman, Phys. Rev. B 89, 180403 (2014). DOI: 10.1103/PhysRevB.89.180403

The Effect of Water Content on Chain Dynamics in Nafion Membranes Measured by Neutron Spin Echo and Dielectric Spectroscopy, K. A. Page, B. W. Rowe, K. A. Masser, A. Faraone, J. Polym. Sci. B Polym. Phys. 52, 624 (2014). DOI: 10.1002/polb.23457

Phonon localization drives polar nanoregions in a relaxor ferroelectric, M. E. Manley, J. W. Lynn, D. L. Abernathy, E. D. Specht, O. Delaire, A. R. Bishop, R. Sahul, J. D. Budai, Nat. Commun. 5, 3683 (2014). DOI: 10.1038/ncomms4683

Solvent Effects on the Dynamics of Amyloidogenic Insulin Revealed by Neutron Spin Echo Spectroscopy, M. Erlkamp, S. Grobelny, A. Faraone, C. Czeslik, R. Winter, J. Phys. Chem. B 118, 3310 (2014). DOI: 10.1021/jp500530h

Multihydroxyl End Functional Polyethylenes: Synthesis, Bulk and Interfacial Properties of Polymer Surfactants, S. M. Kimani, R. L. Thompson, L. R. Hutchings, N. Clarke, S. M. R. Billah, V. G. Sakai, S. E. Rogers, MACROMOLECULES 47, 2062 (2014). DOI: 10.1021/ma402158b

Structure and Dynamics of Octamethyl-POSS Nanoparticles, N. Jalarvo, O. Gourdon, G. Ehlers, M. Tyagi, S. K. Kumar, K. D. Dobbs, R. J. Smalley, W. E. Guise, A. Ramirez-Cuesta, C. Wildgruber, M. K. Crawford, J. Phys. Chem. C 118, 5579 (2014). DOI: 10.1021/jp412228r

Dynamics of lysozyme and its hydration water under an electric field, P. M. Favi, Q. Zhang, H. O'Neill, E. Mamontov, S. O. Diallo, J. Biol. Phys. 40, 167 (2014). DOI: 10.1007/s10867-014-9343-2

Magnetic Excitations in Metalloporphyrins by Inelastic Neutron Scattering: Determination of Zero-Field Splittings in Iron, Manganese, and Chromium Complexes, S. C. Hunter, A. A. Podlesnyak, Z-L. Xue, Inorg. Chem. 53, 1955 (2014). DOI: 10.1021/ic4028354

Inelastic neutron scattering studies of YFeO3, S. E. Hahn, A. A. Podlesnyak, G. Ehlers, G. E. Granroth, R. S. Fishman, A. I. Kolesnikov, E. Pomjakushina, K. Conder, Phys. Rev. B 89, 014420 (2014). DOI: 10.1103/PhysRevB.89.014420

Ghost modes and continuum scattering in the dimerized distorted kagome lattice antiferromagnet Rb2Cu3SnF12, K. Matan, Y. Nambu, Y. Zhao, T.J. Sato, Y. Fukumoto, T. Ono, H. Tanaka, C. Broholm, A. Podlesnyak, G. Ehlers, Phys. Rev. B 89, 024414 (2014). DOI: 10.1103/PhysRevB.89.024414

Quasielastic Neutron Scattering Study on Polymer Nanocomposites, T. Masui, H. Kishimoto, T. Kikuchi, S. Ohira-Kawamura, Y. Inamura, T. Koga, K. Nakajima, J. Phys. Conf. Series 502, 012057 (2014). DOI: 10.1088/1742-6596/502/1/012057


2013 (48 publications)

Structure and spectroscopy of hydrogen adsorbed in a nickel metal-organic framework, C.M. Brown, A. J. Ramirez-Cuesta, J-H Her, P.S. Wheatley, R.E. Morris, Chem. Phys. 427, 3 (2013). DOI: 10.1016/j.chemphys.2013.08.010

Pressure-Induced Cell Wall Instability and Growth Oscillations in Pollen Tubes, Mariusz Pietruszka, Plos One 8, 11 (2013). DOI: 10.1371/journal.pone.0075803

Hydrogen Sorption in Li12C60, P. Mauron, M. Gaboardi, A. Remhof, A. Bliersbach, D. Sheptyakov, M. Aramini, G. Vlahopoulou, F. Giglio, D. Pontiroli, M. Ricco, A. Zuettelt, J. Phys. Chem. C 117, 22598 (2013). DOI: 10.1021/jp408652t

Correlation between Supercoiling and Conformational Motions of the Bacterial Flagellar Filament, A. M. Stadler, T. Unruh, K. Namba, F. Samatey, G. Zaccai, Biophys. J. 105, 2157 (2013). DOI: 10.1016/j.bpj.2013.09.039

Surface compression of light adsorbates inside microporous PFA-derived carbons, A. Qajar, M. Peer, R. Rajagopalan, Y. Liu, C. Brown, H. C. Foley, Carbon 60, 538-549 (2013). DOI: 10.1016/j.carbon.2013.04.001

Membrane formation by preferential solvation of ions in mixture of water, 3-methylpyridine, and sodium tetraphenylborate, K. Sadakane, M. Nagao, H. Endo, H. Seto, J. Chem. Phys. 139, 234905 (2013). DOI: 10.1063/1.4838795

Proton dynamics in La0.8Ba1.2GaO3.9 center dot nH(2)O studied by quasielastic incoherent neutron scattering, N. Jalarvo, L. Stingaciu, D. Gout, Z.H. Bi, M.P. Paranthaman, M. Ohl, Solid State Ion. 252 12-18 (2013). DOI: 10.1016/j.ssi.2013.07.015

Heptanuclear cobalt(II) dicubane compounds with single-molecule magnet behavior, G.P. Guedes, S. Soriano, N.M. Comerlato, N.L. Speziali, M.A. Novak, M.G.F. Vaz, Inorg. Chem. Commun. 37, 101 (2013). DOI: 10.1016/j.inoche.2013.09.034

Proton diffusivity in spark plasma sintered BaCe0.8Y0.2O3 (-) (delta): In-situ combination of quasi-elastic neutron scattering and impedance spectroscopy, Q.L. Chen, J. Banyte, X.Y. Zhang, J.P. Embs, A. Braun, Solid State Ion. 252 2-6 (2013). DOI: 10.1016/j.ssi.2013.05.009

Hydrogen dynamics in the low temperature phase of LiBH4 probed by quasielastic neutron scattering, A. Remhof, A. Zuttel, T.A.J. Ramirez-Cuesta, V. Garcia-Sakai, B. Frick, Chem. Phys. 427, 147 (2013). DOI: 10.1016/j.chemphys.2013.07.017

Magnetic relaxations in a Tb-based single molecule magnet studied by quasielastic neutron scattering, M. Kofu, T. Kajiwara, J.S. Gardner, G.G. Simeoni, M. Tyagi, A. Faraone, K. Nakajima, S. Ohira-Kawamura, M. Nakano, O. Yamamuro, Chem. Phys. 427, 147 (2013). DOI: 10.1016/j.chemphys.2013.10.004

Coherent Neutron Scattering and Collective Dynamics in the Protein, GFP, J.D. Nickels, S. Perticaroli, H. O'Neill, Q. Zhang, G. Ehlers, A.P. Sokolov, Biophys. J. 105 (9), 2182 (2013). DOI: 10.1016/j.bpj.2013.09.029

Pentanuclear Heterometallic {Ni(2)Ln(3)} (Ln = Gd, Dy, Tb, Ho) Assemblies. Single-Molecule Magnet Behavior and Multistep Relaxation in the Dysprosium Derivative, V. Chandrasekhar, P. Bag, W. Kroener, K. Gieb, P. Muller, Inorg. Chem. 52 (22), 13078 (2013). DOI: 10.1021/ic4019025

Efficient Parallel Levenberg-Marquardt Model Fitting towards Real-Time Automated Parametric Imaging Microscopy, X. Zhu, D.W. Zhang, PLOS ONE, 8 (10) (2013). DOI: 10.1371/journal.pone.0076665

Secondary structure and rigidity in model proteins, Perticaroli, S., Nickels, J.D., Ehlers, G., O'Neill, H., Zhang, Q., Sokolov, A.P., Soft Matter 9, 9548 (2013). DOI: 10.1039/C3SM50807B

Dynamics in protein powders on the nanosecond-picosecond time scale are dominated by localized motions, Nickels, J.D., Garcia Sakai, V., Sokolov, A.P, J. Phys. Chem. B 117 (39), pp 11548 (2013). DOI: 10.1021/jp4058884

Optical IFU observations of gas pillars surrounding the super star cluster NGC 3603, M. S. Westmoquette, J. E. Dale, B. Ercolano and L. J. Smith, Mon. Not. R. Astron. Soc. 435, 30 (2013). doi: 10.1093/mnras/stt1172

Probing the unusual anion mobility of LiBH4 confined in highly ordered nanoporous carbon frameworks via solid state NMR and quasielastic neutron scattering, Liu, X., Majzoub, E.H., Stavila, V., Bhakta, R.K., Allendorf, M.D., Shane, D.T., Conradi, M.S., Verdal, N, Udovic, T.J., Hwang, S.-J., J. Mater. Chem. A 1, 9935 (2013). DOI: 10.1039/C3TA12051A

Dynamical perturbations of tetrahydroborate anions in LiBH4 due to nanoconfinement in controlled-pore carbon scaffolds, Verdal, N., Udovic, T.J., Rush, J.J., Liu, X., Majzoub, E.H., Vajo, J.J., Gross, A.F., J. Phys. Chem. C 117 (35), 17983 (2013). DOI: 10.1021/jp4063737

New synthetic route toward heterometallic 3d-3d? and 3d-4f single-molecule magnets. the first CoII-MnIII heterometallic complex, Guedes, G.P., Soriano, S., Mercante, L.A., Speziali, N.L., Novak, M.A., Andruh, M., Vaz, M.G.F., Inorg. Chem. 52 (15), 8309 (2013). DOI: 10.1021/ic401479d

Investigation of an unusual low-temperature phase transformation in RbBH4 by neutron diffraction, Kitchen, B.B., Verdal, N., Udovic, T.J., Rush, J.J., Hartman, M.R., De Vries, D.J., J. Solid State Chem. 203, 51 (2013).

Two co-crystalline M(hfac)2(IPhIN)2.M(hfac)2(M = Mn, Co) compounds with a bis(iminoylnitroxide) biradical: structure and magnetism, M. G. F. Vaz, H. Akpinar, G. P. Guedes, S. Santos, M. A. Novake, P. M. Lahti, New J. Chem. 37, 1927 (2013). DOI: 10.1039/C3NJ00047H

Synthesis, Crystal Structure, Spectroscopic and Magnetically Study of Two Copper(II) Complexes with Pyrazole Ligand., Davydenko, Y. M., Demeshko, S., Pavlenko, V. A., Dechert, S., Meyer, F. and Fritsky, I. O., Z. anorg. allg. Chem. 639, 1472 (2013). DOI: 10.1002/zaac.201300078

New Synthetic Route toward Heterometallic 3d-3d ' and 3d-4f Single-Molecule Magnets. The First Co-II-Mn-III Heterometallic Complex, G.P. Guedes, S. Soriano, L.A. Mercante, N.L. Speziali, M.A. Novak, M. Andruh, M.G.F. Vaz, Inorg. Chem. 52, 8309 (2013). DOI: 10.1021/ic401479d

Atomic-Scale Picture of the Ion Conduction Mechanism in a Tetrahedral Network of Lanthanum Barium Gallate, N. Jalarvo, O. Gourdon, Z.H. Bi, D. Gout, M. Ohl, M.P. Paranthaman, Chem. Mater. 25, 2741-2748 (2013). DOI: 10.1021/cm400452n

Phases of superfluid helium in smooth cylindrical pores, T.R. Prisk, N.C. Das, S.O. Diallo, G. Ehlers, A.A. Podlesnyak, N. Wada, S. Inagaki, P.E. Sokol, Phys. Rev. B 88, 014521 (2013). DOI: 10.1103/PhysRevB.88.014521

Low-temperature water dynamics in an aqueous methanol solution, C.E. Bertrand, W.-S.Chiang, M. Tyagi, S.H. Chen, J. Chem. Phys. 139, 014505 (2013). DOI: 10.1063/1.4812286

Evolution of the Reorientational Motions of the Tetrahydroborate Anions in Hexagonal LiBH4-Lil Solid Solution by High-Q Quasielastic Neutron Scattering, N. Verdal, T.J. Udovic, J.J. Rush, H. Wu, A.V. Skripov, J. Phys. Chem. C 117, 12010-12018 (2013). DOI: 10.1021/jp403636k

Isotope Effect on Adsorbed Quantum Phases: Diffusion of H-2 and D-2 in Nanoporous Carbon, C.I. Contescu, H.X. Zhang, R.J. Olsen, E. Mamontov, J.R. Morris, N.C. Gallego, Phys. Rev. Lett. 110, Issue 23 (2013). DOI: 10.1103/PhysRevLett.110.236102

Dynamics in Anionic Micelles: Effect of Phenyl Ring, V.K. Sharma, S. Mitra, M. Johnson, R. Mukhopadhyay, J. Phys. Chem. B 117, 6250-6255 (2013). DOI: 10.1021/jp401831y

Li-ion Conduction in the LiBH4:Lil System from Density Functional Theory Calculations and Quasi-Elastic Neutron Scattering, J.S.G. Myrdal, D. Blanchard, D. Sveinbjornsson, T. Vegge, J. Phys. Chem. C 117, 9084 (2013). DOI: 10.1021/jp311980h

Proton Conductivity under Dry Conditions for Mesoporous Silica with Highly Dense Sulfonic Acid Groups, S. Fujita, K. Kamazawa, S. Yamamoto, M. Tyagi, T. Araki, J. Sugiyama, N. Hasegawa, M. Kawasumi, J. Phys. Chem. C 117, 8727-8736 (2013). DOI: 10.1021/jp307058s

Localized translational motions in semicrystalline poly(ethylene terephthalate) studied by incoherent quasielastic neutron scattering, A. Sanz, T.A. Ezquerra, M.C. Garcia-Gutierrez, I. Puente-Orench, J. Campo, A. Nogales, Eur. Phys. J. E 36, 1292 (2013). DOI: 10.1140/epje/i2013-13024-1

Redox systematics of martian magmas with implications for magnetite stability, K. Righter1, L. R. Danielson, K. Pando, R. V. Morris, T. G. Graff, D. G. Agresti, A. M. Martin, S. R. Sutton, M. Newville and A. Lanzirotti, Am. Mineral. 98, 616 (2013). DOI: 10.2138/?am.2013.4251

Toward a new polyethylene scattering law determined using inelastic neutron scattering, C.M. Lavelle, C.-Y. Liu, M.B. Stone, Nucl. Instrum. Meth. A 711, 166 (2013). DOI: 10.1016/j.nima.2013.01.048

A new family of trinuclear Nickel(II) complexes as single-molecule magnets , R. Biswas, Y. Ida, M.L. Baker, S. Biswas, P. Kar, H. Nojiri, T. Ishida, A. Ghosh, Chem. Eur. J. 19, 3943 (2013). DOI: 10.1002/chem.201202795

Hydrogen dynamics in nanoconfined lithiumborohydride , A. Remhof, P. Mauron, A. Zuttel, J.P. Embs, Z. Lodziana, A.J. Ramirez-Cuesta, P. Ngene, P. De Jongh, J. Phys. Chem. C 117, 3798 (2013). DOI: 10.1021/jp311064d

Antiferromagnetic spin ice correlations at (12,12,12) in the ground state of the pyrochlore magnet Tb2Ti2O7, K. Fritsch, K.A. Ross, Y. Qiu, R.R.D. Copley, T. Guidi, R.I. Bewley, H.A. Dabkowska, B.D. Gaulin, Phys, Rev. B 87, 094410 (2013). DOI: 10.1103/PhysRevB.87.094410

Heterogeneous slow dynamics of imidazolium-based ionic liquids studied by neutron spin echo , M. Kofu, M. Nagao, T. Ueki, Y. Kitazawa, Y. Nakamura, S. Sawamura, M. Watanabe, O. Yamamuro, J. Phys. Chem. B 117, 2773 (2013). DOI: 10.1021/jp312608r

Preparation and Characterization of Dinuclear Nickel(II) Complexes Containing N3Ni(1, 3-SO3R)2(-RCN4)NiN3 Cores: Crystal Structures and Magnetic Properties, J. Lach, E. Perlt, B. Kirchner, B. Kersting, Z. anorg. allg. Chem. 639, 524 (2013). DOI: 10.1002/zaac.201200501

The effects of ring expansion and N-methylation on the complexation behaviour of macrodinucleating hexaaza-dithiophenolate macrocycles: Destabilization of the CoIII oxidation level and lowering of the coordination number, U. Lehmann, J. Lach, F. Schleife, A. Jeremies, B. Kersting, Eur. J. Inorg. Chem. 2013(8), 1336 (2013). DOI: 10.1002/ejic.201201314

2-tert-Butyl-5-(2-pyridyl)-2H-tetrazole as a chelating ligand in the direct synthesis of novel Cu(ii) and heterobimetallic Cu(ii)/Mn(ii) complexes, A.P. Mosalkova, S.V. Voitekhovich, A.S. Lyakhov, L.S. Ivashkevich, J. Lach, B. Kersting, P.N. Gaponik, O.A. Ivashkevich, Dalton Trans. 42, 2985 (2013). DOI: 10.1039/c2dt32512h

Two new coordination polymers involving Mn(II), Co(II), dicyanamide anion and the nitrogen ligand 5,5?-dimethyl-2,2?-dipyridine: Crystal structures and magnetic properties, L.B. Lopes, C.C. Correa, G.P. Guedes, M.G.F. Vaz, R. Diniz, F.C. Machado, Polyhedron 50, 16 (2013).

Organization and flexibility of cyanobacterial thylakoid membranes examined by neutron scattering, M. Liberton, L.E. Page, W.B. O'Dell, H. O'Neill, E. Mamontov, V.S. Urban, H.B. Pakrasi, J. Biol. Chem. 288, 3632 (2013).

Tetranuclear complexes composed of dinickel(II) macrocyclic fragments bridged by 5,5 '-(1,3-phenylene)bis-1H-tetrazolato and N,N-bis(tetrazol-5-ato)amine coligands: Synthesis, structures and magnetic properties, J. Lach, A.P. Mosalkova, S.V. Voitekhovich, P.N. Gaponik, B. Kersting, Polyhedron 49, 183 (2013). DOI: 10.1016/j.poly.2012.09.027

Vibrational Spectroscopic Study of Subtle Phase Transitions in Alkali Borohydrides: Comparison with First-Principles Calculations, N. Verdal, T.J. Udovic, W. Zhou, J.J. Rush, D.J. De Vries, M.R. Hartman, J. Phys. Chem. C 117, 876 (2013). DOI: 10.1021/jp310853u

Binuclear nickel complexes with an edge sharing bis(square-pyramidal) N3Ni(mu-S-2)NiN3 core: synthesis, characterization, crystal structure and magnetic properties, U. Lehmann, J. Lach, C. Loose, T. Hahn, B. Kersting, J. Kortus, Dalton Trans. 42, 987 (2013). DOI: 10.1039/c2dt31973j


2012 (41 publications: 40 in text, 1 personal acknowledgments)

* Spectroscopic Identification of Hydrogen Spillover Species in Ruthenium-Modified High Surface Area Carbons by Diffuse Reflectance Infrared Fourier Transform Spectroscopy, J.L. Blackburn, C. Engtrakul, J.B. Bult, K. Hurst, Y.F. Zhao, Q. Xu, P.A. Parilla, L.J. Simpson, J.D.R. Rocha, M.R. Hudson, C.M. Brown, T. Gennett, J. Phys. Chem. C 116, 26744 (2012). 10.1021/jp305235p

* Hydrogen diffusion in potassium intercalated graphite studied by quasielastic neutron scattering, J. Purewal, J.B. Keith, C.C. Ahn, C.M. Brown, M. Tyagi, B. Fultz, J. Chem. Phys. 137, 224704 (2012). 10.1063/1.4767055

* Two Cobalt(II) Cubane Compounds: The Key Role of Small Ligand Changes on the Crystal Packing and Magnetic Properties, G.P. Guedes, S. Soriano, N.M. Comerlato, N.L. Speziali, P.M. Lahti, M.A. Novak, M.G.F. Vaz, Eur. J. Inorg. Chem., issue 34, 5642 (2012). 10.1002/ejic.201200615

* Magnetic order and fluctuations in the presence of quenched disorder in the kagome staircase system (Co1-xMgx)(3)V2O8, K. Fritsch, Z. Yamani, S. Chang, Y. Qiu, J.R.D. Copley, M. Ramazanoglu, H.A. Dabkowska, B.D. Gaulin, Phys. Rev. B 86, 174421 (2012). 10.1103/PhysRevB.86.174421

* Stabilization of Hypophosphite in the Binding Pocket of a Dinuclear Macrocyclic Complex: Synthesis, Structure, and Properties of [Ni2L(mu-O2PH2)]BPh4 (L = N6S2 Donor Ligand, J. Lach, A. Jeremies, V. Lozan, C. Loose, T. Hahn, J. Kortus, B. Kersting, Inorg. Chem. 51, 12380 (2012). 10.1021/ic301710b

* Cation Dynamics in the Pyridinium Based Ionic Liquid 1-N-Butylpyridinium Bis((trifluoromethyl)sulfonyl) As Seen by Quasielastic Neutron Scattering, J.P. Embs, T. Burankova, E. Reichert, R. Hempelmann, J. Phys. Chem. B 116, 13265 (2012). 10.1021/jp3070344

* Slow magnetic relaxation in mononuclear tetrahedral cobalt(II) complexes with 2-(1H-imidazol-2-yl)phenol based ligands, A. Buchholz, A.O. Eseola, W. Plass, C. R. Chim. 15, 929 (2012). 10.1016/j.crci.2012.07.005

* GMOS-IFU spectroscopy of the compact H II galaxies Tol 0104-388 and Tol 2146-391: the dependence on the properties of the interstellar medium, P. Lagos, E. Telles, A. Nigoche-Netro and E. R. Carrasco, Mon. Not. R. Astron. Soc. 427, 740 (2012). 10.1111/j.1365-2966.2012.21944.x

* Neutron Diffraction Investigations of Magnetism in BiFeO3 Epitaxial Films, W. Ratcliff II, D. Kan, W. Chen, S. Watson, S. Chi, R. Erwin, G. J. McIntyre, S. C. Capelli, I. Takeuchi, Advanced Functional Materials 21, 1567 (2012).

* Accurate determination of ferric iron in garnets by bulk Mossbauer spectroscopy and synchrotron micro-XANES, M.D. Dyar, E.A. Breves, E. Emerson, S.W. Bell, M. Nelms, M.V. Ozanne, S.E. Peel, M.L. Carmosino, J.M. Tucker, M.E. Gunter, J.S. Delaney, A. Lanzirotti, A.B. Woodland, Am. Mineral. 97, 1726 (2012). 10.2138/am.2012.4107

* Dynamical Features in Cationic Micelles of Varied Chain Length, V. K. Sharma, S. Mitra, V. Garcia Sakai, R. Mukhopadhyay, J. Phys. Chem. B 116, 9007 (2012).

* Metal-assisted hydrogen storage on Pt-decorated single-walled carbon nanohorns, Y. Liu, C. M. Brown, D. A. Neumann, D. B. Geohegan, A. A. Puretzky, C. M. Rouleau, H. Hu, D. Styers-Barnett, P. O. Krasnov, B. I. Yakobson, Carbon 50, 4953 (2012). 10.1016/j.carbon.2012.06.028

* Lattice dynamics reveals a local symmetry breaking in the emergent dipole phase of PbTe, Kirsten M. O. Jensen, Emil S. Bozin, Christos D. Malliakas, Matthew B. Stone, Mark D. Lumsden, Mercouri G. Kanatzidis, Stephen M. Shapiro, and Simon J. L. Billinge, Phys. Rev. B 86, 085313 (2012). 10.1103/PhysRevB.86.085313

* Coherent Dynamics of meta-Toluidine Investigated by QuasiElastic Neutron Scattering, Antonio Faraone, Kunlun Hong, Larry R. Kneller, Michael Ohl, and John Copley, J. Chem. Phys. 136, 104502 (2012).

* Design and operation of the wide angular-range chopper spectrometer ARCS at the Spallation Neutron Source, D.L. Abernathy, M.B. Stone, M.J. Loguillo, M.S. Lucas, O. Delaire, X. Tang, J.Y.Y. Lin, and B. Fultz, Rev. Sci. Instrum. 83, 015114 (2012). 10.1063/1.3680104

* Effect of charged lidocaine on static and dynamic properties of model bio-membranes, Z. Yi, M. Nagao, D.P. Bossev, Biophys. Chem. 160, 20 (2012).

* Restricted dynamics of molecular hydrogen confined in activated carbon nanopores, C.I. Contescu, D. Saha, N.C. Gallego, E. Mamontov, A.I. Koleshnikov, and V.V. Bhat, Carbon 50, 1071 (2012). 10.1016/j.carbon.2011.10.016

* Lipid Bilayers and Membrane Dynamics: Insight into Thickness Fluctuations, C. A. Woodka, P. D. Butler, L. Porcar, B. Farago, M. Nagao, Phys. Rev. Lett. 109, 058102 (2012). 10.1103/PhysRevLett.109.058102

* Proton Hopping and Long-Range Transport in the Protic Ionic Liquid [Im][TFSI], Probed by Pulsed-Field Gradient NMR and Quasi-Elastic Neutron Scattering, M. L. Hoarfrost, M. Tyagi, R. A. Segalman, J. A. Reimer, J. Phys. Chem. B 116, 8201 (2012). 10.1021/jp3044237

*Regular High-Nuclearity Species from Square Building Blocks: A Triangular 3 x [2 x 2] Ni-12 Complex Generated by the Self-assembly of Three [2 x 2] Ni-4 Molecular Grids, Y. S. Moroz, S. Demeshko, M. Haukka, A. Mokhir, U. Mitra, M. Stocker, P. Mueller, F. Meyer, I. O. Fritsky, Inorg. Chem. 51, 7445 (2012). 10.1021/ic300902z

* Characterization of Morphology and Active Agent Mobility within Hybrid Silica Sol-Gel Composites, H. O'Neill, S. M. Chathoth, M. B. Cardoso, G. A. Baker, E. Mamontov, V. S. Urban, J. Phys. Chem. C 116, 13972 (2012). 10.1021/jp3024028

* One dimensional inorganic oxovanadium polymers functionalized with manganese(II) complexes: Structural and magnetic characterization, M. Saldias, V. Paredes-Garcia, W. Canon-Mancisidor, E. Le Fur, D. Venegas-Yazigi, E. Spodine, EPOLYHEDRON 41, 120 (2012). 10.1016/j.poly.2012.04.031

* Copper Complexes of "Superpodal" Amine Ligands and Reactivity Studies towards Dioxygen, A. Jozwiuk, E. A. Uenal, S. Leopold, J. P. Boyd, M. Haryono, N. Kurowski, F. V. Escobar, P. Hildebrandt, J. Lach, F. W. Heinemann, D. Wiedemann, E. Irran, A. Grohmann, Eur. J. Inorg. Chem. 2012, 3000 (2012). 10.1002/ejic.201101265

* Dynamic Patterning in PEO-Based Single Ion Conductors for Li Ion Batteries, K. Sinha, W. Wang, K. I. Winey, J. K. Maranas, Macromolecules 45, 4354 (2012). (2012) 10.1021/ma300051y

* Synthesis, Structure, and Reactivity of Dinuclear Nickel Amino-Thiophenolate Complexes Bearing Bridging VO2(OH)(2)(-) and VO2(OR)(2)(-) Coligands, V. Lozan, J. Lach, B. Kersting, Inorg. Chem. 51, 5213 (2012). 10.1021/ic300085f

* Preparation and Characterisation of Dinuclear Nickel(II) Complexes Containing N3Ni(mu 1,3-SO3R)2(mu-O2CR)NiN3 Cores: Crystal Structures and Magnetic Properties of [Ni2(L2)(O2CCH3)]BPh4 and [Ni2(L2)(O2CPh)]BPh4 [H2L2=Macrocyclic Ligand with a N6(SO3)2 Donor Set], J. Lach, T. Hahn, B. Kersting, J. Kortus, Eur. J. Inorg. Chem. 2012, issue 14, 2381 (2012). 10.1002/ejic.201101402

* Effect of Confinement on Proton Transport Mechanisms in Block Copolymer/Ionic Liquid Membranes, M. L. Hoarfrost, M. S. Tyagi, R. A. Segalman, J. A. Reimer, Macromolecules 45, 3112 (2012). 10.1021/ma202741g

* Spin dynamics in the multiferroic materials (invited), F. Ye, R. S. Fishman, J. Haraldsen, B. Lorenz, C. W. Chu, T. Kimura, J. Appl. Phys. 111 (2012). 10.1063/1.3677863

* Hydrogen species motion in piezoelectrics: A quasi-elastic neutron scattering study, K. J. Alvine, M. Tyagi, C. M. Brown, T. J. Udovic, T. Jenkins, S. G. Pitman, J. Appl. Phys. 111, 053505 (2012). 10.1063/1.3691114

* A Pyrazole-Expanded EDTA Ligand and its Pentanuclear Iron(III) Complex, S. Fischer, S. Demeshko, S. Dechert, F. Meyer, Z. Anorg. Allg. Chem. 638, 621 (2012). 10.1002/zaac.201100534

* Dynamics of Water Absorbed in Polyamides, M. Laurati, P. Sotta, D. R. Long, L.-A. Fillot, A. Arbe, A. Alegria, J. P. Embs, T. Unruh, G. J. Schneider, J. Colmenero, Macromolecules 45, 1676 (2012). 10.1021/ma202368x

* Anharmonic phonons and magnons in BiFeO3, O. Delaire, M. B. Stone, J. Ma, A. Huq, D. Gout, C. Brown, K. F. Wang, Z. F. Ren, Phys. Rev. B. 85, 064405 (2012). 10.1103/PhysRevB.85.064405

* Double-Focusing Thermal Triple-Axis Spectrometer at the NCNR, J. W. Lynn, Y. Chen, S. Chang, Y. Zhao, S. Chi, W. Ratcliff II, B. G. Ueland, R. W. Erwin, J. Res. Natl. Inst. Stan. Technol. 117, 61 (2012). 10.6028/jres.117.002

* Hindered Rotational Energy Barriers of BH4- Tetrahedra in beta-Mg(BH4)(2) from Quasielastic Neutron Scattering and DFT Calculations, D. Blanchard, J. B. Maronsson, M. D. Riktor, J. Kheres, D. Sveinbjornsson, E. Gil Bardaji, A. Leon, F. Juranyi, J. Wuttke, K. Lefmann, B. C. Hauback, M. Fichtner, T. Vegge, J. Phys. Chem. C 116, 2013 (2012). 10.1021/jp208670v

* Dynamics of 1,3-Diphenylpropane Tethered to the Interior Pore Surfaces of MCM-41, E. J. Kintzel Jr., M. K. Kidder, A. C. Buchanan III, P. F. Britt, E. Mamontov, M. Zamponi, K. W. Herwig, J. Phys. Chem C 116, 923 (2012). 10.1021/jp209458a

* The Nature of BH4- Reorientations in Hexagonal LiBH4, N. Verdal, T. J. Udovic, J. J. Rush, J. Phys. Chem. C 116, 1614 (2012). 10.1021/jp211754g

* Microscopic insights into ion gel dynamics using neutron spectroscopy, M. Kofu, T. Someya, S. Tatsumi, K. Ueno, T. Ueki, M. Watanabe, T. Matsunaga, M. Shibayama, V. G. Sakai, M. Tyagi, O. Yamamuro, Soft Matter 8, 3888 (2012). 10.1039/c2sm25348h

* The dynamical landscape in CTAB micelles, V. K. Sharma, S. Mitra, V. G. Sakai, P. A. Hassan, J. P. Embs, R. Mukhopadhyay, Soft Matter 8, 3151 (2012). 10.1039/c2sm25515d

* Spatially resolved observations of warm ionized gas and feedback in local ULIRGs, M. S. Westmoquette, D. L. Clements, G. J. Bendo and S. A. Khan, Mon. Not. R. Astron. Soc. 424, 416 (2012). 10.1111/j.1365-2966.2012.21214.x

* A VLT VIMOS IFU study of the ionisation nebula surrounding the supersoft X-ray source CAL 83, P. Gruyters, K. Exter, T. P. Roberts, S. Rappaport, Astronomy and Astrophysics 544, A86 (2012). 10.1051/0004-6361/201219051

* Hydrogen adsorption in the metal-organic frameworks Fe2(dobdc) and Fe2(O2)(dobdc), Wendy L. Queen , Eric D. Bloch , Craig M. Brown , Matthew R. Hudson , Jarad A. Mason , Leslie J. Murray , Anibal Javier Ramirez-Cuesta , Vanessa K. Peterson and Jeffrey R. Long , Dalton Trans. 41, 4180 (2012). 10.1039/C2DT12138G


2011 (69 publications: 37 in text, 32 personal acknowledgments)

* UPDATED ANALYSIS OF THE UPWIND INTERPLANETARY HYDROGEN VELOCITY AS OBSERVED BY THE HUBBLE SPACE TELESCOPE DURING SOLAR CYCLE 23, V. E. Frédéric, B-J. Lotfi and M. H. Walter, The Astrophysical Journal 738, 135 (2011).

* Spatially resolved optical integral field unit spectroscopy of the inner superwind of NGC 253, M. S. Westmoquette1, L. J. Smith, J. S. Gallagher III, Mon. Not. R. Astron. Soc. 414, 37193739 (2011). 10.1111/j.1365-2966.2011.18675.x

* Molecular mobility in solid sodium dodecyl sulfate, S. Mitra, V.K. Sharma, V. García Sakai, J.P. Embs, and R. Mukhopadhyay, J. Phys. Chem. B 115, 9732 (2011).

* Lattice dynamics and anomolous softening in the YbFe4Sb12 skutterudite, A. Möchel, I. Sergueev, H.-C. Wille, J. Voigt, M. Prager, M.B. Stone, B.C. Sales, Z. Guguchia, A. Shengelaya, V. Keppens, and R.P. Hermann, Phys. Rev. B 84, 184306 (2011).

* Lattice dynamics in the thermoelectric Zintl compound Yb14MnSb11, A. Möchel, I. Sergueev, H.-C. Wille, F. Juranyi, H. Schober, W. Schweika, S.R. Brown, S.M. Kauzlarich, and R.P. Hermann, Phys. Rev. B 84, 184303 (2011).

* Diffusion of water in molecular magnet Cu0.75Mn0.75[Fe(CN)6].7H2O, V.K. Sharma, S. Mitra, A. Kumar, S.M. Yusuf, F. Juranyi, and R. Mukhopadhyay, J. Phys.: Condens. Matter 23, 446002 (2011).

* Thermal motion in the multi-subunit protein, apoferritin, as probed by high energy resolution neutron spectroscopy, M.T.F. Telling, C. Neylon, L. Clifton, S. Howells, L. van Eijck, anc V. García Sakai, Soft Matter 7, 6934 (2011).

* Direct observation of local Mn-Mn distances in the paramagnetic compound CsMnxMg1-xBr3, A. Furrer, Th. Strässle, J.P. Embs, F. Juranyi, V. Pomjakushin, M. Schneiderr, and K.W. Krä, Phys. Rev. Lett. 107, 115502 (2011).

* Water and polymer chains dynamics in chitosan hydrogels by quasielastic neutrons scattering, V. Tripadus, V. Garcia Zacai, M. Statescu, F. Mihai, L. Cracium, L. Tcacenco, V. Almasan, Rom. Rep. Phys. 63, 437 (2011).

* Hindered rotational energy barriers of BH4- tetrahedra in β-Mg(BH4)2 from quasielastic neutron scattering and DFT calculations, D. Blanchard, J.B. Marosson, M.D. Riktor, J. Kheres, D. Sveinbjörnsson, E.G. Bardaji, A.N. Leon, F. Juranyi, J. Wuttke, K. Lefman, B.C. Hauback, M. Fichtner, and T. Vegge, J. Phys. Chem. C. DOI: 10.1021/jp208670v (2011).

* Differences in Fe-redox for asbestiform and nonasbestiform amphiboles from the former vermiculite mine, near Libby, Montana, U.S.A., M.E. Gunter, M.D. Dyer, A. Lanzirotti, J.M. Tucker, and E.A. Speicher, American Mineralogist 96, 1414 (2011).

* Magnetic excitations in the geometric frustrated multiferroic CuCrO2, M. Frontzek, J.T. Haraldsen, A. Podlesnyak, M. Matsuda, A.D. Christianson, R.S. Fishman, A.S. Sefat, Y. Qiu, J.R.D. Copley, S. Barilo, S.V. Shiryaev, and G. Ehlers, Phys. Rev. B 84, 094448 (2011).

Dzyaloshinsky-Moriya interaction and long lifetime of the spin state in the Cu3 triangular spin cluster by inelastic neutron scattering, K. Lida, Y. Qiu, and T.J. Sato, Phys. Rev. B 84, 094449 (2011).

Quantum Spin Fluctuations in the Spin Liquid State of Tb2Ti2O7, H. Takatsu, H. Kadowaki, T.J. Sato, J.W. Lynn, Y. Tabata, T. Yamakaki, and K. Matsuhira, J. Phys. Cont. Matr. 24, 052201 (2011).

* Dynamics of thermodynamically stable, kinetically trapped, and inhibitor-bound states of pepsin, D.R. Dee, B. Myers, and R.Y. Yada, Biophys. J. 101, 1699 (2011).

Hydrogen dynamics in Ce2Fe17H5: inelastic and quasielastic neutron scattering studies, A.V. Skripov, N.V. Mushnikov, P.B. Terent'ev, V.S. Gaviko, T.J. Udovic, and J.J. Rush, J. Phys.: Condens. Matter 23, 405402 (2011).

Structural Collapse and 45 K Superconductivity in Electron-doped CaFe2As2, S.R. Saha, N.P. Butch, T. Drye, J. Magill, S. Ziemak, K. Kirshenbaum, P. Y. Zavalij, J. W. Lynn, and J. Paglione, Phys. Rev. B 85, 024525 (2011).

* The dynamics of unfolded versus folded tRNA: the role of electrostatic interactions, J.H. Roh, M. Tyagi, R.M. Briber, S.A. Woodson, and A.P. Sokolov, J. Am. Chem. Soc. 133, 16406 (2011).

* Segmental dynamics and ion association in PEO-based single ion conductors, K. Sinha and J.K. Maranas, Macromolecules 44, 5381 (2011).

Evolution of the Commensurate and Incommensurate Magnetic Phases of S=3/2 Kagome Staircase Co3V2O8 in an Applied Field, J.S. Helton, Y. Chen, S.N. Barilo, N. Rogado, R.J. Cava, and J.W. Lynn, J. Phys. Cont. Matr. 24, 016003 (2011).

* Interlayer distance dependence of thickness fluctuations in a swollen lamellar phase, M. Nagao, S. Chawang, and T. Hawa, Soft Matter 7, 6598 (2011).

Common Origin of the two types of Magnetic Fluctuations in Iron Chalcogenides, S. Chi, J.A. Rodriguez, J. W. Lynn, Chenglin Zhang, D. Phelan, D. K. Singh, R. Paul, and P. Dai, Phys. Rev. B 84 (2011).

* Hierarchical structure and dynamics of an ionic liquid 1-octyl-3-methylimidazolium chloride, O. Yamamuro, T. Yamada, M. Kofu, M. Nakakoshi, and M. Nagao, J. Chem. Phys. 135, 054508 (2011).

* Temperature and scattering contrast dependencies of thickness fluctuations in surfactant membranes, M. Nagao, J. Chem. Phys. 135, 074704 (2011).

Magnetic Field Tuning of Antiferromagnetic Yb3Pt4, L. S. Wu, Y. Janssen, C. Marques, M. C. Bennett, M. S. Kim, K. S. Park, Songxue Chi, J. W. Lynn, G. Lorusso, G. Biasiol, and M. C. Aronson, Phys. Rev. B 84, 134409 (2011).

* Light-controlled protein dynamics observed with neutron spin echo measurements, S.-C. Wang, P. Mirarefi, A. Faraone, C.T. Lee, Jr., Biochemistry 50, 8150 (2011).

* Quasi-elastic neutron scattering studies on dynamics of water confined in nanoporous copper rubeanate hydrates, Ta. Yamada, R. Yonamine, Te. Yamada, H. Kitagawa, M. Tyagi, M. Nagao, and O. Yamamuro, J. Phys. Chem. B 115, 13563 (2011).

Neutron Diffraction Study of the Mn Spin Correlations in Bi0.46Ca0.54Mn0.95Cr0.05O3, C.-H. Lee, C.-M. Wu, D. Hsu, C.-W. Wang, C.-J. Wang, W.-H. Li, C.-C. Yang, J. Sun, and J.W. Lynn, J. Phys. Soc. Japan 80, SB013 (2011).

Antiferromagnetic Order and Superlattice Structure in Nonsuperconducting and Superconducting RbyFe1.6+xSe2, M. Wang, M. Wang, G. N. Li, Q. Huang, C. H. Li, G. T. Tan, C. L. Zhang, H. B. Cao, W. Tian, Y. Zhao, Y. C. Chen, X. Y. Lu, B. Sheng, H. Q. Luo, S. L. Li, M. H. Fang, J. L. Zarestky, W. Ratcliff, M. D. Lumsden, J. W. Lynn, and P. Dai, Phys. Rev. B 84, 094504 (2011).

* Low-temperature tunneling and rotational dynamics of the ammonium cations in (NH4)2B12H12, N. Verdal, T.J. Udovic, J.J. Rush, V. Stavila, H. Wu, W. Zhou, and T. Jenkins, J. Chem. Phys. 135, 094501 (2011).

* Phloroglucinol-bridged trinuclear complexes with three paramagnetic octahedral nickel(II) ions: Syntheses, crystal structures, and magnetic properties, D. Plaul and W. Plass, Inorg. Chim. Acta 374, 341 (2011).

Response of Acoustic Phonons to Charge and Orbital Order in the 50% doped Bilayer Manganite LaSr2Mn2O7, F. Weber, S. Rosenkranz, J.P. Castellan, R. Osborn, D. Reznik, H. Zheng, J. F. Mitchell, Y. Chen, and J. W. Lynn, Phys. Rev. Lett. 107, 207202 (2011).

* Iron(III)-pivalate-based complexes with tetranuclear {Fe43-O)2}8+ cores and n-donor ligands: Formation of cluster and polymeric architectures, S.G. Baca, I.G. Filippova, T.D. Keene, O. Botezat, I.L. Malaestean, H. Stoeckli-Evans, V.C. Kravtsov, I. Chumacov, S.-X. Liu, and S. Decurtins, Eur. J. Inorg. Chem. 2011, 356 (2011).

* Re-examining high abundance SDSS mass-metalliciry outliers: High N/O evolved Wolf-Rayet galaxies?, D.A. Berg, E.D. Skillman, A.R. Marble, Astrophys. J. 738,2 (2011).

Antiferromagnetic Spin Excitations in Single Crystals of Nonsuperconducting Li1?xFeAs, M. Wang, X.C. Wang, D.L. Abernathy, L.W. Harriger, H. Q. Luo, Yang Zhao, J. W. Lynn, Q. Q. Liu, C. Q. Jin, C. Fang, J. Hu, and P. Dai, Phys. Rev. B 83, 220515(R) (2011).

Local Weak Ferromagnetism in Single-Crystalline Ferroelectric BiFeO3, M. Ramazanoglu, M. Laver, W. Ratcliff II, S. M. Watson, W. C. Chen, A. Jackson, K. Kothapalli, S. Lee, S.-W. Cheong, and V. Kiryukhin, Phys. Rev. Lett. 107, 207206 (2011).

* A study of out-of-plane cation dynamics in a bis-thiourea pyridinium chloride inclusion compound, A. Pajzderska, P. Czarnecki, J.P. Embs, M.A. Gonzalez, F. Juranyi, J. Krawczyk, B. Peplińska, and. J. Wąsicki, Phys. Chem. Chem. Phys. 13, 8908 (2011).

* Pore with gate: modulating hydrogen storage in metal-oganic framework materials via cation exchange, S. Yang, S.K. Callear, A.J. Ramirez-Cuestra, W.I.F. David, J. Sun, A.J. Blake, N.R. Champness, and M. Schröder, Faraday Discussions, DOI: 10.1039/c1fd00006c (2011).

Coupling Between Field-induced Spin Fluctuations and Spin Density Wave in Intermetallic CeAg2Ge2, D. K. Singh, A. Thamizhavel, S. Chang, J.W. Lynn, D. Joshi, S.K. Dhar, and S. Chi, Phys. Rev. B 84, 052401 (2011).

* Effects of carrier doping on the formation and collapse of magnetic polarons in ligtly hole-doped La1-xSrxCoO3, A. Podlesnyak, G. Ehlers, M. Frontzek, A.S. Sefat, A. Furrer, T. Strässle, E. Pomjakushina, K. Conder, F. Demmel, and D.I. Khomskii, Phys. Rev. B 83, 134430 (2011).

* Redox-promoting protein motors in rubredoxin, J.M. Borreguero, J. He, F. Meilleur, K.L. Weiss, C.M. Brown, D.A. Myles, K.W. Herwig, and P.K. Agarwal, J. Phys. Chem. B 115, 8925 (2011).

Short range ordering in the modified honeycomb lattice compound SrHo2O4, S. Ghosh, H.D. Zhou, L. Balicas, S. Hill, J.S. Gardner, Y. Qiu, and C.R. Wiebe, J. Phys. Condens. Matter 23, 164203 (2011).

Dzyaloshinskii-Moriya Interaction and Spin Reorientation Transition in the Frustrated Kagome Lattice Antiferromagnet, K. Matan, B. M. Bartlett, J. S. Helton, Y. Sikokenko, S. Matas, K. Prokes, Y. Chen, J. W. Lynn, D. Grohol, T. J. Sato, M. Tokunaga, D. G. Nocera, and Y. S. Lee, Phys. Rev. B 83, 214406 (2011).

Mechanism of exchange striction of ferroelectricity in multiferroic orthorhombic HoMnO3, N. Lee, Y.J. Choi, M. Ramazanoglu, W. Ratcliff II, V. Kiryukhkin, and S-W. Cheong, Phys. Rev. B 84, 020101(R) (2011).

* Low-energy magnetic excitations in Co/CoO core/chell nanoparticles, M. Feygenson, X. Teng, S.E. Inderhees, Y. Yiu, W. Du, W. Han, J. Wen, Z. Xu, A.A. Podlesnyak, J.L. Niedziela, M. Hagen, Y. Qiu, C.M. Brown, L. Zhang, and M.C. Aronson, Phys. Rev. B 83, 174414 (2011).

Spin liquid state in the S=1/2 triangular lattice Ba3CuSb2O9, H.D. Zhou, E.S. Choi, G. Li, L. Balicas, C.R. Wiebe, Y. Qiu, J.R.D. Copley, and J.S. Gardner, Phys. Rev. Lett. 106, 147204 (2011).

HfFeGa2 and HfMnGa2: Transition-metal-based Itinerant Ferromagnets with low Curie Temperatures, C. Marques, Y. Janssen, M. S. Kim, L. Wu, S. X. Chi, J. W. Lynn, and M. C. Aronson, Phys. Rev. B 83, 184435 (2011).

* Dynamics of small-molecule glass formers confined in nanopores, T.R. Prisk, M. Tyagi, and P.E. Sokol, J. Chem. Phys. 134, 114506 (2011).

Quantum critical behavior in the heavy Fermion single crystal Ce(Ni0.935Pd0.065)2Ge2, J. M. Lawrence, A. D. Christianson, S. Chang, E. D. Bauer, K. Gofryk, F. Ronning, J. D. Thompson, K. J. McClellan, J. A. Rodriguez, and J. W. Lynn, J. Phys.: Conf. Series 273,012018 (2011).

Temperature-dependent properties of the magnetic order in single-crystal BiFeO3, M. Ramazanoglu, W. Ratcliff II, Y.J. Choi, Seongsu Lee, S-W. Cheong, V. Kiryukhin, Phys. Rev. B 83, 174434 (2011).

A neutron scattering study of hydrogen dynamics in coarse-grained and nanostructured ZrCr2H3, A.V. Skripov, T.J. Udovic, J.J. Rush, and M.A. Uimin, J. Phys. Condens. Matter 23, 65402 (2011).

Molecular Spin-Orbit Excitations in the Jeff = 1/2 Frustrated Spinel GeCo2O4, K. Tomiyasu, M. K. Crawford, D. T. Adroja, P. Manuel, A. Tominaga, S. Hara, H. Sato, T. Watanabe, S. I. Ikeda, J. W. Lynn, K. Iwasa, and K. Yamada, Phys. Rev. B 84, 054405 (2011).

Nanoconfinement and catalytic dehydrogenation of ammonia borane by magnesium-metal-organic-framework-74, S. Gadipelli, J. Ford, W. Zhou, H. Wu, T.J. Udovic, and T. Yildirim, Chem. Eur. J. 17, 6043 (2011).

* Hydrogen storage properties and neutron scattering studies of Mg2(dobcd)-a metal-organic framework with open Mg2+ adsorption sites, K. Sumida, C.M. Brown, Z.R. Herm, S. Chavan, S. Bordiga, and J.R. Long, Chem. Commun. 47, 1157 (2011).

Sodium magnesium amidoborane: the first mixed-metal amidoborane, H. Wu, W. Zhou, F.E. Pinkerton, M.S. Meyer, Q. Yao, S. Gadipelli, T.J. Udovic, T. Yildirim, and J.J. Rush, Chem. Commun. 47, 4102 (2011).

Soft Phonons and Structural Phase Transition in Superconducting Ba0.59K0.41BiO3, H. J. Kang, Y.S. Lee, J. W. Lynn, S. V. Shiryaev and S. N. Barilo, Physica C 471, 303 (2011).

* Reorientational dynamics of Dodecahydro-closo-dodecaborate anion in Cs2B12H12, N. Verdal, T.J. Udovic, J.J. Rush, R.L. Cappelletti, and W. Zhou, J. Phys. Chem. A 115, 2933 (2011).

Incommensurate Magnetism in FeAs Strips: Neutron Scattering from CaFe4As3, Y. Nambu, L. L. Zhao, E. Morosan, K. Kim, G. Kotliar, P. Zajdel, M. A. Green, W. Ratcliff, J. A. Rodriguez-Rivera, and C. Broholm, Phys. Rev. Lett. 106, 037201 (2011).

Nanoscale hydride formation at disloocations in palladium: Ab initio theory and inelastic neutron scattering measurements, D.R. Trinkle, H. Ju, B.J. Heuser, and T.J. Udovic, Phys. Rev. B 83 174116 (2011).

Neutron scattering studies of spin excitations in hole-doped Ba0.67K0.33Fe2As2 superconductor, C. Zhang, M. Wang, H. Luo, M. Wang, M. Liu, J. Zhao, D. L. Abernathy, T. A. Maier, K. Marty, M. D. Lumsden, S. Chi, S. Chang, J. A. Rodriguez-Rivera, J. W. Lynn, T. Xiang, J. Hu, P. Dai, Scientific Reports 1, 115 (2011).

Inelastic neutron scattering study of hydrogenated (Zr55Cu30Ni5Al10)99Y1 bulk metallic glass, A. C.-P. Chuang, Y. Liu, T.J. Udovic, P.K. Liaw, G.-P. Yu, and J.-H. Huang, Phys. Rev. B 83, 174206 (2011).

Alkali and alkaline-earth metal dodecahydro-closo-dodecaborates: Probing structural variations via neutron vibrational spectroscopy, N. Verdal, W. Zhou, V. Stavila, J.-H. Her, M. Yousufuddin, T. Yildirim, T.J. Udovic, J. Alloys Compds. 509, S694 (2011).

Nitrogen Contamination in Elastic Neutron Scattering, S. Chi, J. W. Lynn, Y. Chen, W. Ratcliff II, B. G. Ueland, N. P. Butch, S. R. Saha, K. Kirshenbaum, and J. Paglione, Meas. Sci. Technol. 22, 047001 (2011).

* Neutron scattering and spectroscopic studies of hydrogen adsorbtion in Cr3(BTC)2-A metal-organic framework with exposed Cr2+ sites, K. Sumida, J.-H. Her, M. Dincă, L.J. Murray, J.M. Schloss, C.J. Pierce, B.A. Thompson, S.A. Fitzgerald, C.M. Brown, and J.R. Long, J. Phys. Chem. C 115, 8414 (2011).

* Vibrational density of states of hydration water at biomolecular sites: Hydrophobicity promotes low density amorphous ice behavior, D. Russo, J. Teixeira, L. Kneller, J.R.D. Copley, J. Ollivier, S. Perticaroli, E. Pellegrini, and M.A. Gonzalez, J. Am. Chem. Soc. 133, 4882 (2011).

Magnetic field effect on the static antiferromagnetic order and spin excitations in the underdoped iron arsenide superconductor BaFe1.92Ni0.08As2, M Wang, H. Luo, M. Wang, S. Chi, J. A. Rodriguez-Rivera, D. Singh, S. Chang, J. W. Lynn, and P. Dai, Phys. Rev. B 83, 094516 (2011).

* Micro-channel development and hydrogen absorption properties in templated microporous carbons containing platinum nanoparticles, Y. Yang, C.M. Brown, C. Zhao, A.L. Chaffee, B. Nick, D. Zhao, P.A. Webley, J. Schalch, J.M. Simmons, Y. Liu, J.-H. Her, C.E. Buckley, and D.A. Sheppard, Carbon 49, 1305 (2011).

* Interrelationship between Li+ diffusion, charge, and magnetism in 7LiMn2O4 and 7Li1.1Mn1.9O4 spinels: Elastic, inelastic, and quasielastic neutron scattering, K. Kamazawa, H. Nozaki, M. Harada, K. Kazuhiko, Y. Ikedo, K. Iida, T.J. Sato, Y. Qiu, M. Tyagi, and J. Sugiyama, Phys. Rev. B 83, 094401 (2011).

* Molecular dynamics and neutron scattering study of glucose solutions confined in MCM-41, A. Lerbret, G. Lelong, P.E. Mason, M.-L. Saboungi, and J.W. Brady, J. Phys. Chem. B 115, 910 (2011).


2010 (49 publications: 22 in text, 27 personal acknowledgments)

* Neutron scattering study of a quasi-two-dimansional spin-1/2 dimer system: Piperazinium hexachlorodicuprate under hydrostatic pressure, T. Hong, C. Stock, I. Cabrera, C. Broholm, Y. Qiu, J.B. Leão, S.J. Poulton, and J.R.D. Copley, Phys. Rev. B. 82, 184424 (2010).

* Localized diffusive motion on two different time scales in solid alkane nanoparticles, S.-K. Wang, E. Mamontov, M. Bai, F.Y. Hansen, H. Taub, J.R.D. Copley, V. García Sakai, G. Gasparovic, T. Jenkins, M. Tyagi, K.W. Herwig, D.A. Neumann, W. Montfrooij, and U.G. Volkmann, Europhys. Lett. 91, 66007 (2010).

* VLT/FLAMES-ARGUS observations of stellar wind-ISM cloud interactions in NGC 6357, M.S. Westmoquette, J.D. Slavin, L.J. Smith, and J.S. Gallagher III, Mon. Not. R. Astron. Soc. 402, 152-160 (2010).

* Low-temperature spin dynamics in the kagome system Pr3Ga5SiO14, L.L. Lumata, T. Besara, P.L. Kuhns, A.P. Reyes, H.D. Zhou, C.R. Wiebe, L. Balicas, Y.J. Jo, J.S. Brooks, Y. Takano, M.J. Case, Y. Qiu, J.R.D. Copley, J.S. Gardner, K.Y. Choi, N.S. Dalal, and M.J.R. Hoch, Phys. Rev. B 81, 224416 (2010).

* A low-temperature crossover in water dynamics in an aqueous LiCl solution: Diffusion probed by Neutron Spin-Echo and NMR, E. Mamontov, A. Faraone, E.W. Hagaman, K.S. Han, and E. Fratini, J. Phys. Chem. B 114, 16737 (2010).

* Hydrated {Mo72Fe30} clusters: Low-frequency hydrogen modes and self-aggregation, E. Fratini, A. Faraone, A.M. Todea, and P. Baglioni, Inorganica Chimica Acta 363, 4234 (2010).

* Phase separation and suppression of the structural and and magnetic transitions in superconducting doped iron tellurides: Fe1+xTe1-ySy, P. Zajdel, P.-Y. Hsieh, E.E. Rodriguez, N.P. Butch, J.D. Magill, J. Paglione, P. Zavalij, M.R. Suchomel, and M.A. Green, J. Am. Chem. Soc. 132, 13000 (2010).

* A VLT VIMOS integral-field spectroscopic study of perturbed bluecompact galaxies: UM 420 and UM462, B.L. James, Y.G. Tsamis, and M.J. Barlow, Mon. Not. R. Astron. Soc. 401, 759 (2010).

High-resolution neutron scattering study of Tb2Mo2O7: A geometrically frustrated spin glass, G. Ehlers, J.E. Greedan, J.R. Stewart, K.C. Rule, P. Fouquet, A.L. Cornelius, C. Adriano, P.G. Pagliuso, Y. Qiu, J.S. Gardner, (2010).

Inter- and intratrimer excitations in the multiferroic Ba3NbFe3Si2O14, H.D. Zhou, Y. Barlas, C.R. Wiebe, Y. Qiu, J.R.D. Copley, and J.S. Gardner, Phys. Rev. B 82, 132408 (2010).

Neutron scattering and scaling behavior in URu2Zn2O, C.H. Wang, A.D. Christianson, J.M. Lawrence, E.D. Bauer, E.A. Goremychkin, A.I. Kolesnikov, F. Trouw, F. Ronning, J.D. Thompson, M.D. Lumsden, N. Ni, E.D. Mun, S. Jia, P.C. Canfield, Y. Qiu, and J.R.D. Copley, Phys. Rev. B 82, 184407 (2010).

Ferromagnetically coupled Shastry-Sutherland quantum spin singlets in (CuCl)LaNb2O7, C. Tassel, J. Kang, C. Lee, O. Hernandez, Y. Qiu, W. Paulus, E. Collet, B. Lake, T. Guidi, M.-H. Whangbo, C. Ritter, H. Kageyama, and S.-H. Lee, Phys. Rev. Lett. 105, 167205 (2010).

Dynamic scaling in the susceptibility of the spin 1/2 Kagome lattice Antiferromagnet Herbertsmithite, J.S. Helton, K. Matan, M.P. Shores, E.A. Nytko, B.M. Bartlett, Y. Qiu, D.G. Nocera, and Y.S. Lee, Phys. Rev. Lett. 104, 147201 (2010).

Orbital order and partial electronic delocalization in a triangular magnetic metal Ag2MnO2, S. Ji, E.J. Kan, M.-H. Whangbo, J.-H. Kim, Y. Qiu, M. Matsuda, H. Yoshida, Z. Hiroi, M.A. Green, T. Ziman, and S.-H. Lee, Phys. Rev. B 81, 094421 (2010).

Coexisting Magnetic Order and Cooperative Paramagnetism in the Stuffed Pyrochlore Tb2+xTi2-2xNbxO7, B.G. Ueland, J.S. Gardner, A.J. Williams, M.L. Dahlberg, J.G. Kim, Y. Qiu, J.R.D. Copley, P. Schiffer, and R.J. Cava, Phys. Rev. B 81, 060408 (2010).

Spin fluctuations and orbital ordering in quasi-one-dimensional α-Cu(dca)2(pyz) {dca=dicyanamide=N(CN)2; pyz=pyrazine}, a molecular analogue of KCuF3, J.L. Manson, T. Lancaster, S.J. Blundell, Y. Qiu, J. Singleton, P. Sengupta, F.L. Pratt, J. Kang, C. Lee, and M.-H. Whangbo, Polyhedron 29, 514 (2010).

* Identifying the Specific Nanostructures Responsible for the High Thermoelectric Performance of (Bi,Sb)2Te3 Nanocomposites, W. Xie, J. He, H.J. Kang, X. Tang, S. Zhu, M. Laver, S. Wang, J.R.D. Copley, C.M. Brown, Q. Zhang, and T.M. Tritt, Nano Lett. 10, 3283 (2010).

* Experimental evidence of logarithmic relaxation in single-particle dynamics of hydrated protein molecules, X.-q. Chu, M. Lagi, E. Mamontov, E. Fratini, P. Baglioni, and S.-H. Chen, Soft Matter, 6, 2623 (2010).

* Effect of pH and Ibuprofen on the phospholipid bilayer bending modulus, M.B. Boggara, A. Faraone, and R. Krishnamoorti, J. Phys. Chem. B 114, 8061 (2010).

Doping dependence of spin dynamics in electron-doped Ba(Fe1-xCox)2As2, K. Matan, S. Ibuka, R. Morinaga, S.X. Chi, J.W. Lynn, A.D. Christianson, M.D. Lumsden, and T.J. Sato, Phys. Rev. B 82, 054515 (2010).

Antiferromagnetic crucial fluctuations in BaFe2As2, S.D. Wilson, Z. Yamani, C.R. Rotundu, B. Freelon, P.N. Valdivia, E. Bourret-Courchesne, J.W. Lynn, S. Chi, T. Hong, and R.J. Birgeneau, Phys. Rev. B 82, 144502 (2010).

Interplay between Fe and Nd magnetism in NdFeAsO single crystals, W. Tian, W. Ratcliff II, J.W. Lynn, J.-Q. Yan, M.G. Kim, B. Jensen, K. Dennis, R.W. McCallum, T.A. Lograsso, R.J. McQueeney, A.I. Goldman, A. Kreyssig, Phys. Rev. B 82, 060514(R) (2010).

Antiferromagnetic critical pressure in Uru2Si2 under hydrostatic conditions, N.P. Butch, J.R. Jeffries, S.X. Chi, J.B. Leao, J.W. Lynn, and M.B. Maple, Phys. Rev. B 82, 060408(R) (2010).

The pressure-temperature phase diagram of Uru2Si2 under hydrostatic conditions, N.P. Butch, J.R. Jeffries, W.J. Evans, S. Chi, J.B. Leao, J.W. Lynn, S.V. Sinogeikin, J.J. Hamlin, D.A. Zocco, and M.B. Maple, Mater. Res. Soc. Symp. Proc. 1264, Z10-03 (2010).

* Hydrogen storage and carbon dioxide capture in an iron-based sodalite-type metal-organic framework (Fe-BTT) discovered via high-throughput methods, K. Sumida, S. Hiroke, S.S. Kaye, Z.R. Herm, W.L. Queen, C.M. Brown, F. Grandjean, G.J. Long, A. Dailly, and J.R. Long, Chem. Sci. 1, 184 (2010).

A new family of metal borohydride ammonia borane complexes: Synthesis, structures, and hydrogen storage properties, H. Wu, W. Zhou, F.E. Pinkerton, M.S. Meyer, G. Srinivas, T. Yildirim, T.J. Udovic, and J.J. Rush, J. Mater. Chem. 20, 6550 (2010).

* Analysis of the vibrational spectrum of dihydrazinium 5,5'-azotetrazolate dihydrate by electronic structure calculations, J.A. Ciezak and S.F. Trevino, J. Mol. Struct. 975, 23 (2010).

Probing the structure, stability and hydrogen storage properties of calcium dodecahydro-closo-dodecaborate, V. Stavila, J.-H. Her, W. Zhou, S.-J. Hwang, C. Kim, L.A.M. Ottley, T.J. Udovic, J. Sol. State Chem. 183, 1133 (2010).

Determination of the magnetic structure of Yb3Pt4 :k=0 local-moment antiferromagnet, Y. Janssen, M.S. Kim, K.S. Park, L.S. Wu, C. Marques, M.C. Bennett, Y. Chen, J. Li, Q. Huang, J.W. Lynn, and M.C. Aronson, Phys. Rev. B 81, 064401 (2010).

Absence of the hyperfine magnetic field at the Ru site in ferromagnetic rare-earth intermetallics, D. Coffey, M. DeMarco, P.C. Ho, M.B. Maple, T. Sayles, J.W. Lynn, Q. Huang, S. Toorongian, and M. Haka, Phys. Rev. B 81, 184404 (2010).

Effect of magnetic field on the spin resonance in FeTe0.5Se0.5 as seen via inelastic neutron scattering, J. Wen, G. Xu, Z. Xu, Z.W. Lin, Q. Li, Y. Chen, S. Chi, G. Gu, and J.M. Tranquada, Phys. Rev. B 81, 100513(R) (2010).

Interplay between the crystalline and magnetic structures in lightly Cr-Doped Bi0.37Ca0.63Mn0.96Cr0.04O2.99, C.-C. Yang, W.-H. Li, C.-M. Wu, C.H.C. Li, J. Sun, and J.W. Lynn, Inorg. Chem 49, 3297 (2010).

Cd-doping effects in Ce2MIn8 (M = Rh and Ir) heavy fermion compounds, C. Adriano, C. Giles, E.M. Bittar, L.N. Coelho, F. de Bergevin, C. Mazzoli, L. Paolasini, W. Ratcliff, R. Bindel, J.W. Lynn, Z. Fisk, and P.G. Pagliuso, arxiv:0912.4467v1 (2010).

Magnetic form factor of SrFe2As2: Neutron diffraction measurements, W. Ratcliff II, P.A. Kienzle, J.W. Lynn, S. Li, P. Dai, G.F. Chen, and N.L. Wang, Phys. Rev. B 81, 140502(R) (2010).

Electron-doping evolution of the low-energy spin excitations in the iron arsenide superconductor BaFe2?xNixAs2, M. Wang, H. Luo, J. Zhao, C. Zhang, M. Wang, K. Marty, S. Chi, J.W. Lynn, A. Schneidewind, S. Li, and P. Dai, Phys. Rev. B 81, 174524 (2010).

Lattice distortion and magnetic quantum phase transition in CeFeAs1-xPxO, C. de la Cruz, H.Z. Hu, S. Li, Q. Huang, J.W. Lynn, M.A. Green, G.F. Chen, N.L. Wang, H.A. Mook, Q. Si, and P. Dai, Phys. Rev. Lett. 104, 017204 (2010).

Neutron diffraction in a model itinerant metal near a quantum critical point, D.A. Sokolov, M.C. Aronson, R. Erwin, J.W. Lynn, M.D. Lumsden, and S.E. Nagler, arxiv:0807.3586v2 (2010).

Magnetic and structural properties of Ca(Fe1-xCox)2 and Ca(Ni1-xCox)2, S. Jia, S. Chi, J.W. Lynn, and R.J. Cava, Phys. Rev. B 81, 214446 (2010).

Short range magnetic correlations induced by La substitution in Ho1-xLaxMn2O5, C.-W. Wang, C.-M. Wu, C.-Y. Li, S.K. Karna, C.-K. Hsu, C.H.C. Li, W.-H. Li, C.-C. Yu, C.-P. Wu, H. Chou, and J.W. Lynn, J. Phys.: Condens. Matter 22, 246002 (2010).

Magnetic structure, magnetization, and magnetotransport properties of (Ba,Sr)M2+/-xT4-/+xO11 (M=Fe,Co; T=Ru,Ti), L. Shlyk, B.G. Ueland, J.W. Lunn, Q. Huang, L.E. De Long, and S. Parkin, Phys. Rev. B 81, 184415 (2010).

* Ionized gas in the starburst core and halo of NGC 1140, M.S. Westmoquette, J.S. Gallagher III, and L. De Poitiers, Mon. Not. R. Astron. Soc. 403, 1719 (2010).

* A molecular picture of motion in polyolefins, E.K. Boland, J. Liu, and J.K. Maranas, J. Chem. Phys. 132, 144901 (2010).

* Investigation of the behavior of ehtylene molecular films using high resolution adsorption isotherms and neutron scattering, A.M. Barbour, M.T.F. Telling, and J.Z. Larese, Langmuir 26, 8113 (2010).

* Reorientational dynamics of NaBH4 and KBH4, N. Verdal, M.R. Hartman, T. Jenkins, D.J. DeVries, J.J. Rush, and T.J. Udovic, J. Phys. Chem. C 114, 10027 (2010).

* Structure and mobility of PEO/LiClO4 solid polymer electrolytes filled with Al2O3 nanoparticles, S.K. Fullerton-Shirey, and J.K. Maranas, J. Phys. Chem. C 114, 9196 (2010).

* Introduction to Quasielastic Neutron Scattering, J.P. Embs, F. Juranyi, and R. Hempelmann, Z. Phys. Chem. 224, 5 (2010).

* Electronic structure and photophysics of pseudo-octahedral vanadium(III) oxo complexes, K.R. Kittilstved and A. Hauser, Coordination Chemistry Reviews 254, 2663 (2010).

* On the behaviour of water hydrogen bonds at biomolecular sites: Dependences on temperature and on network dimensionality, D. Russo, J.R.D. Copley, J. Ollivier, and J. Teixeira, J. Mol. Struct. 972, 81 (2010).

* Structure and water dynamics of aqueous peptide solutions in the presence of co-solvents, C. Malardier-Jugroot, D.T. Bowron, A.K. Soper, M.E. Johnson, and T. Head-Gordon, Phys. Chem. Chem. Phys. 12, 382 (2010).


2009 (60 publications: 26 in text, 34 personal acknowledgments)

* The optical structure of the starburst galaxy M82. I. Dynamics of the disk and inner-wind, M.S. Westmoquette, L.J. Smith, J.S. Gallagher III, G. Trancho, N. Bastian, and I.S. Konstantopoulos, Astrophys. J. 696, 92 (2009).

* The internal kinematics of the HII galaxy II Zw 40, V. Bordalo, H. Plana, and E. Telles, Astrophys. J. 696, 1668 (2009).

* Two-dimensional Kagome correlations and field induced order in the ferromagnetic XY pyrochlore Yb2Ti2O7, K.A. Ross, J.P.C. Ruff, C.P. Adams, J.S. Gardner, H.A. Dabkowska, Y. Qiu, J.R.D. Copley, and B.D. Gaulin, Phys. Rev. Lett. 103, 227202 (2009).

* DAVE: A comprehensive software suite for the reduction, visualization, and analysis of low energy neutron spectroscopic data, R.T. Azuah, L.R. Kneller, Y. Qiu, P.L.W. Tregenna-Piggott,C.M. Brown, J.R.D. Copley, and R.M. Dimeo, J. Res. Natl. Inst. Stan. Technol. 114,341 (2009).

* Simple quantum visualizations using IDL, R. Dimeo, NIST Special Publication 1098 (2009).

* Neutron scattering evidence for isolated spin-1/2 ladders in (C5D12N)2CuBr4, A.T. Savici, G.E. Granroth, C.L. Broholm, D.M. Pajerowski, C.M. Brown, D.R. Talham, M.W. Meisel, K.P. Schmidt, G.S. Uhrig, and S.E. Nagler, Phys. Rev. B 80,094411 (2009).

* Observation of local thickness fluctuations in surfactant membranes using neutron spin echo, M. Nagao, Phys. Rev. E 80, 031606 (2009).

* Ferromagnetism in Co7(TeO3)4Br6: A byproduct of complex antiferromagnetic order and single-ion anisotropy, M. Prester, I. Živković, O. Zaharko, D. Pajić, P. Tregenna-Piggott, and H. Berger, (2009).

* Full fitting analysis of the relative intermediate form factor measured by neutron spin echo, M. Nagao and H. Seto, Physica B 404, 2603 (2009).

* Dynamics in multicomponent polyelectrolyte solutions, S. Lee, V.R. Tirumala, M. Nagao, T. Tominaga, E.K. Lin, J.P. Gong, and W.-l. Wu, Macromolecules 42, 1293 (2009).

* Time-of-flight spectroscopy at the NIST Center for Neutron Research, J.R.D. Copley, C.M. Brown, and Y. Qiu, Neutron News 20, Issue2, 28 (2009).

* Dynamics of polyrotaxane investigated by neutron spine echo, K. Mayumi, M. Nagao, H. Endo, N. Osaka, M. Shibayama, and K. Ito, Physica B 404, 2600 (2009).

Hydrogen in nonstoichiometric cubic niobium carbides: neutron vibrational spectroscopy and neutron diffraction studies, A.V. Skripov, H. Wu, T.J. Udovic, Q. Huang, R. Hempelmann, A.V. Soloninin, A.A. Rempel, and A.I. Gusev, J. Alloys Compds. 478, 68 (2009).

* Dynamics of water in voids between well-defined and densely packed spherical nanocages acting as polyprotic inorganic acids, A. Faraone, E. Fratini, A.M. Todea, B. Krebs, A. Müller, and P. Baglioni, J. Phys. Chem. C 113, 8635 (2009).

Hydration water dynamics near biological interfaces, M.E. Johnson, C. Malardier-Jugroot, R.K. Murarka, and T. Head-Gordon, J. Phys. Chem. B 113, 4082 (2009).

A molecular view of dynamic responses when mixing poly(ethylene oxide) and poly(methyl methacrylate), C. Chen and J.K. Maranas, Macromolecules 42, 2795 (2009).

Reassessment of the Burns temperature and its relationship to diffuse scattering, lattice dynamics, and thermal expansion in relaxor PbMg1/3Nb2/3O3, P.M. Gehring, H. Hiraka, C. Stock, S.-H. Lee, W. Chen, Z.-G. Ye, S.B. Vakrushev, and Z. Chowdhuri, Phys. Rev. B 79, 224109 (2009).

* The impact of hydration water on the dynamics of side chains of hydrophobic peptides: From dry powder to highly concentrated solutions, D. Russo, J. Teixeira, and J. Ollivier, J. Chem. Phys. 130, 235101 (2009).

* Single particle dynamics of water confined in a hydrophobically modified MCM-41-S nanoporous matrix, A. Faraone, K.-H. Liu, C.-Y. Mou, Y. Zhang, and S.-H. Chen, J. Chem. Phys. 130, 134512 (2009).

* Direct analysis of the ion-hopping process associated with the α-relaxation in perfluorosulfonate ionomers using quasielastic neutron scattering, K.A. Page, J.K. Park, R.B. Moore, and V. García Sakai, Macromolecules 42, 2729 (2009).

* Effect of LiClO4 on the structure and mobility of PEO-based solid polymer electrolytes, S.K. Fullerton-Shirey, and J.K. Maranas, Macromolecules 42,2142 (2009).

* Bending elasticity of saturated and unsaturated phospholipid membranes studied by the neutron spin echo technique, Z. Yi, M. Nagao, and D.P. Bossev, J. Phys.:Condens. Matter 21, 155104 (2009).

* Adsorption and melting of hydrogen in potassium-intercalated graphite, J.J. Purewal, J.B. Keith, C.C. Ahn, and B. Fultz, Phys. Rev. B 79, 054305 (2009).

* Single-ion anisotropy and exchange interactions in the cyano-bridged trimers MnM(CN) (M = Co, Cr, Fe) species incorporating [Mn(5-Brsalen)] units: An inelastic neutron scattering and magnetic susceptibility study, P.L.W. Tregenna-Piggott, D. Sheptyakov, L. Keller, S.I. Klokishner, S.M. Ostrovsky, A.V. Palii, O.S. Reu, J. Bendix, T. Brock-Nannestad, K. Pederson, H. Weihe, and H. Mutka, Inorg. Chem. 48, 128 (2009).

* A VLT VIMOS study of the anamolous BCD Mrk 996: mapping the ionised gas kinematics and abundances, B.L. James, Y.G. Tsamis, M.J. Barlow, M.S. Westmoquette, J.R. Walsh, F. Cuisinier, and K.M. Exter, Mon. Not. R. Astron. Soc. 398, 2 (2009).

* Neutron scattering measurements of the phonon density of states of FeSe1-x superconductors, D. Phelan, J.N. Millican, E.L. Thomas, J.B. Leão, Y. Qiu, and R. Paul, Phys. Rev. B. 79, 014519 (2009).

* Study of hydrogen diffusion in superprotonic ionic conductors, MHXO4, by µ+SR and QENS, Y. Ikedo, H. Nozaki, M. Harada, J. Sugiyama, T.J. Sato, Y. Matsuo, K. Nishiyama, J.S. Lord, Y. Qiu, J.R.D. Copley, Nucl. Instrum. Meth. A 600, 316 (2009).

* Revisiting static and dynamic spin-ice correlations in Ho2Ti2O7 with neutron scattering, J.P. Clancy, J.P.C. Ruff, S.R. Dunsiger, Y. Zhao, H.A. Dabkowska, J.S. Gardner, Y. Qiu, J.R.D. Copley, T. Jenkins, and B.D. Gaulin, Phys. Rev. B 79, 14408 (2009).

Role of cation size on the structural behavior of the alkali-metal dodecahydro-closo-dodecaborates, J.-H. Her, W. Zhou, V. Stavila, C.M. Brown, and T.J. Udovic, J. Phys. Chem. C 113, 11187 (2009).

Crystal chemistry and dehydrogenation/rehydrogenation properties of Perovskite hydrides RbMgH3 and RbCaH3, H. Wu, W. Zhou, T.J. Udovic, J.J. Rush, and T. Yildirim, J. Phys. Chem. C 113, 15091 (2009).

Quasielastic neutron scattering study of hydrogen motion in NbC0.71H0.28, A.V. Skripov, T.J. Udovic, J.C. Cook, R. Hempelmann, A.A. Rempel, and A.I. Gusev, J. Phys.: Condens. Matter 21, 175410 (2009).

Tunable (δπ,δπ)-type antiferromagnetic order in α-Fe(Te,Se) superconductors, W. Bao, Y. Qiu, Q. Huang, M.A. Green, P. Zajdel, M.R. Fitzsimmons, M. Zhernenkov, S. Chang, M. Fang, B. Qian, E.K. Vehstedt, J. Yang, H.M. Pham, L. Spinu, and Z.Q. Mao, Phys. Rev. Lett. 102, 247001 (2009).

Temperature, magnetic field, and pressure dependence of the crystal and magnetic structures of the magnetocaloric compound Mn1.1Fe0.9(P0.8Ge0.2), D.M. Liu, Q.Z. Huang, M. Yue, J.W. Lynn, L.J. Liu, Y. Chen, Z.H. Wu, and J.X. Zhang, Phys. Rev. B 80, 174415 (2009).

Magnetic-field control of charge structures in the magnetically disordered phase of multiferroic LuFe2O4, J. Wen, G. Xu, G. Gu, and S.M. Shapiro, Phys. Rev. B 80, 020403 (2009).

Neutron studies of the iron-based family of high TC magnetic superconductors, J.W. Lynn and P. Dai, Physica C 469, 469 (2009).

Neutron diffraction in a model itinerant metal near a quantum critical point, D.A. Sokolov, M.C. Aronson, R. Erqin, J.W. Lynn, M.D. Lumsden, and S.E. Nagler, 25th International Conference on Low Temperature Physics Journal of Physics: Conference Series 150, 042189 (2009).

3:1 magnetization plateau and suppression of ferroelectric polarization in an Ising chaing multiferroic, Y.J. Jo, S. Lee, E.S. Choi, H.T. Yi, W. Ratcliff II, Y.J. Choi, V. Kiryukhin, S.W. Cheong, and L. Balicas, Phys. Rev. B 79, 012407 (2009).

Chemical pressure induced spin freezing phase transition in Kagome Pr langasites, H.D. Zhou, C.R. Wiebe, Y.-J. Jo, L. Balicas, R.R. Urbano, L.L. Lumata, J.S. Brooks, P.L. Kuhns, A.P. Reyes, Y. Qiu, J.R.D. Copley, and J.S. Gardner, Phys. Rev. Lett. 102, 067203 (2009).

Soft phonon columns on the edge of the Brillouin zone in the relaxor PbMg1/3Nb2/3O3, I.P. Swainson, C. Stock, P.M. Gehring, G. Xu, K. Hirota, Y. Qiu, H. Luo, X. Zhao, J.-F. Li, and D. Viehland, Phys. Rev. B 79, 224301 (2009).

Proteins remain soft at lower temperatures under pressure, X.-q. Chu, A. Faraone, C. Kim, E. Fratini, P. Baglioni, J.B. Leão, and S.-H. Chen, J. Phys. Chem. B Letters 113, 5001 (2009).

Fast dynamics of semiflexible chain networks of self-assembled peptides, M.C. Branco, F. Nettesheim, D.J. Pochan, J.P. Schneider, and N.J. Wagner, Biomacromolecules 10, 1374 (2009).

* The optical structure of the starburst galaxy M82. II. Nebular properties of the disk and inner wind, M.S. Westmoquette, J.S. Gallagher, L.J. Smith, G. Trancho, N. Bastian, and I.S. Konstantopoulos, Astrophys. J. 706, 1571 (2009).

Commensurate magnetic structure of CeRhIn4.85Hg0.15, W. Bao, Y.C. Gasparovic, J.W. Lynn, F. Ronning, E.D. Bauer, J.D. Thompson, and Z. Fisk, Phys. Rev. B 79, 092415 (2009).

Rotational bands in open antiferromegnetic rings: A neutron spectroscopy study of Cr8Zn, A. Bianchi, S. Caretta, P. Santini, G. amoretti, T. Guigi, Y. Qiu, J.R.D. Copley, G. Timco, C. Muryn, and R.E.P. Winpenny, Phys. Rev. B 79, 144422 (2009).

Synthesis and magnetic characterization of TmCo2B2C, M. ElMassalami, R.E. Rapp, F.A.B. Chaves, R. Moreno, H. Takeya, B. Ouladdiaf, J.W. Lynn, Q. Huang, R.S. Freitas, and N. F. Oliveria Jr., J. Phys.: Condens. Matter 21, 046007 (2009).

Lattice collapse and quenching of magnetism in CaFe2As2 under pressure: A single-crystal neutron and x-ray diffraction investigation, A.I. Goldman, A. Kreyssig, K. Prokeš, D.K. Pratt, D.N. Argyriou, J.W. Lynn, S. Nandi, S.A.J. Kimber, Y. Chen, Y.B. Lee, G. Samolyuk, J.B. Leão, S.J. Poulton, S.L. Bud'ko, N. Ni, P.C. Canfield, B.N. Harmon, and R.J. McQueeney, Phys. Rev. B 79, 024513 (2009).

Spin gap and magnetic resonance in superconducting BaFe1.9Ni0.1As2, S. Li, Y. Chen, S. Chang, J.W. Lynn, L. Li, Y. Luo, G. Cao, Z. Xu, and P. Dai, Phys. Rev. B 79, 174527 (2009).

First-order magnetic and structureal phase transitions in Fe1+ySexTe1-x, S. Li, C. de la Cruz, Q. Huang, Y. Chen, J.W. Lynn, J. Hu, Y.-L. Huang, F.-C. Hsu, K.-W. Yeh, M.-K. Wu, and P. Dai, Phys. Rev. B 79, 054503 (2009).

Antiferromagnetism in the magnetoelectric effect single crystal LiMnPO4, J. Li, W. Tian, Y. Chen, J.L. Zaretsky, J.W. Lynn, and D. Vaknin, Phys. Rev. B 79, 144410 (2009).

Tweaking the spin-wave disperson and suppressing the incommensurate phase in LiNiPO4 by iron substitution, J. Li, T.B.S. Jensen, N.H. Andersen, J.L. Zarestky, R.W. McCallum, J.-H. Chung, J.W. Lynn, and D. Vaknin, Phys. Rev. B 79, 174435 (2009).

Origin and tuning of the magnetocaloric effect in the magnetic refrigerant Mn1.1Fe0.9(P0.8Ge0.2), D. Liu, M. Yue, J. Zhang, T.M. McQueen, J.W. Lynn, X. Wang, Y. Chen, J. Li, R.J. Cava, X. Liu, Z. Altounian, and Q. Huang, Phys. Rev. B 79, 014435 (2009).

Intrinsic localized modes observed in the high-temperature vibrational spectrum of NaI, M.E. Manley, A.J. Sievers, J.W. Lynn, S.A. Kiselev, N.I. Agladze, Y. Chen, A. Llobet, and A. Alatas, Phys. Rev. B 79, 134304 (2009).

Phonon softening and anamolous mode near the xc=0.5 quantum critical point in Ca2-xSrxRuO4, R.G. Moore, M.D. Lumsden, M.B. Strone, J. Zhang, Y. Chen, J.W. Lynn, R. Jin, D. Mandrus, and E.W. Plummer, Phys. Rev. B 79, 172301 (2009).

Magnetic structure of the high-density single-valent eg Jahn-Teller system LaMn7O12, A. Prodi, E. Gilioli, R. Cabassi, F. Bolzoni, F. Licci, Q. Huang, J.W. Lynn, M. Affronte, A. Gauzzi, and M. Marezio, Phys. Rev. B 79, 085105 (2009).

Hydrogen trapping at dislocations in palladium at low temperature: Results from inelastic neutron scattering and advanced computations, B.J. Heuser, H. Ju, D.R. Trinkle, and T.J. Udovic, Proceedings of the 2008 International Hydrogen Conference (B. Somerday, P. Sofronis, and R. Jones, eds.) ASM International, p. 464-468 (2009).

Crystal chemistry and dehydrogenation/rehydrogrenation properties of perovskite hydrides RbMgH3, H. Wu, W. Zhou, T.J. Udovic, J.J. Rush, and T. Yildirim, J. Phys. Chem. C 113, 15091 (2009).

Characterization of fly ash reactivity in hydrating cement by neutron scattering, W. Bumrongjaroen, R.A. Livingston, D.A. Neumann, and A.J. Allen, J. Mater. Res. 24, 2435 (2009).

Role of cation size on the structural behavior of the alkali-metal dodecahydro-closo-dodecaborates, J.-H. Her, W. Zhou, V. Stavila, C. M. Brown, and T. J. Udovic, J. Phys. Chem. C 113, 11187 (2009).

Crystal structure, neutron vibrational spectroscopy, and DFT calculations of Li2B12H12-4H2O, M. Yousufuddin, J.-H. Her, W. Zhou, S. S. Jalisatgi, and T. J. Udovic, Inorg. Chim. Acta 362, 3155 (2009).

* Hydrogen absorption in HKUST-1: A combbined inelstic neutron scattering and first-principles study, C. M. Brown, Y. Liu, T. Yildirim, V. K. Peterson, and C. J. Kepert, Nanotechnology 20, 204025 (2009).


2008 (66 publications: 21 in text, 45 personal acknowledgments)

* "Spectral Fingerprint Identification for Whole Cube Identification", Imaging Spectroscopy XIII, C.C. Wamsley and P.G. Raeth, Edited by S.S. Shen and P.E. Lewis, Proceedings of SPIE Vol. 7086, 70860Q-1 (2008).

* Reduction of data from inverted-geometry time-of-flight instruments, P.L.W. Tregenna-Piggott, F. Juranyi, P. Christiansen, P.K. Willendrup, and K. Leffmann, J. Neutron Res. 16, 13 (2008).

* Introducing the inverted-geometry time-of-flight backscattering instrument, MARS at SINQ, P.L.W. Tregenna-Piggott, F. Juranyi, and P. Allenspach, J. Neutron Res. 16, 1 (2008).

Polaron formation in the optimally doped ferromagnetic manganites La0.7Sr0.3MnO3 and La0.7Ba0.3MnO3, Y. Chen, B.G. Ueland, J.W. Lynn, G.L. Bychkov, S.N. Barilo, and Y.M. Muskovskii, Phys. Rev. B 78, 212301 (2008).

Spin correlations in the geometrically frustrated pyrochlore Tb2Mo2O7, D.K. Singh, J.S. Helton, S. Chu, T. Han, C. Bonnoit, S. Chang, H.J. Kang, J.W. Lynn, and Y.S. Lee, Phys. Rev. B 78 220405 (2008).

Spin dynamics in the magnetoelectric effect LiCoPO4 compoint, W. Tian, J. Li, J.W. Lynn, J.L. Zarestky, and D. Vaknin, Phys. Rev. B 78, 184429 (2008).

Quasi-free methyl rotation in zeolytic imadazolate framework-8, W. Zhou, H. Wu, T.J. Udovic, J.J. Rush, and T. Yildirim, J. Phys. Chem. A 112, 12602 (2008).

Molecular H2 trapped in AlH3 solid, L. Senadheera, E.M. Carl, T.M. Ivancic, M.S. Conradi, R.C. Bowman Jr., S.-J. Hwang and T.J. Udovic, J. Alloys Compounds 463,1 (2008).

Vibrational density of states measurement of hydrogen trapped at islocations in deformed PdH0.0008, B.J. Heuser, T.J. Udovic, H. Ju, Phys. Rev. B 78, 214101 (2008).

* Inelastic neutron scattering from confined molecular oxygen, D. Kilburn, P.E. Sokol, and C.M. Brown, Phys. Rev. B 78, 132410 (2008).

* Spin waves and quantum criticality in the frustrated XY pyrochlore antiferromagnet Er2Ti207, J.P.C. Ruff, J.P. Clancy, A. Bourque, M.A. White, M/ Ramazanoglu, J.S. Gardner, Y. Qiu, J.R.D. Copley, M.B. Johnson, H.A. Dabkowska, and B.D. Gaulin, Phys. Rev. Lett. 101, 147205 (2008).

* Neutron scattering study of the excitation spectrum of solid helium at ultra-low temperatures, E. Blackburn, J.M. Goodkind, S.K. Sinha, C. Broholm, J.R.D. Copley, and R.W. Erwin, Journal of Physics 71, 673 (2008).

* Molecular dynamics in DTGS(ND3) by quasielastic and inelastic neutron scattering, V. Tripadus, D. Aranghel, M. Statescu, and A. Buchsteiner, Chem. Phys. 353, 59 (2008).

* Bending modulus of lipid bilayers in a liquid-crystalline phase including an anomolous swelling regime estimated by neutron spin echo experiments, H. Seto, N.L. Yamada, M. Nagao, M. Hishida, and T. Takeda, Eur. Phys. J. E 26, 217 (2008).

Impact of oxygen annealing on the heat capacity and magnetic resonance of superconducting Pr0.88LaCe0.12CuO4-δ, S. Li, S. Chi, J. Zhao, H.-H. Wen, M. B. Stone, J. W. Lynn, and P. Dai, Phys. Rev. B 78, 014520 (2008).

Raman, FTIR, photoacoustic-FTIR and inelastic neutron scattering spectra of alkaline earth and lanthanide salts of hexahydridoruthenate(II), A2RuH6, (A=Ca, Sr, Eu) and their deuterides, M. Barsan, D. Gilson, I. Butler, R. Moyer Jr., W. Zhou, H. Wu, and T.J. Udovic, J. Phys. Chem. A 112,6936 (2008).

Dynamic spin ice: Pr2Sn2O7, H.D. Zhou, C.R. Wiebe, J.A. Janik, L. Balicas, Y.J. Yo, Y. Qiu, J.R.D. Copley, and J.S. Gardner, Phys. Rev. Lett. 101, 227204 (2008).

Specific heat and magnetic susceptibility of the spinels GeNi2O4 and GeCo2O4, J.C. Lashley, R. Stevens, M.K. Crawford, J. Boerio-Goates, B.F. Woodffield, Y. Qiu, J.W. Lynn, P.A. Goddard, and R.A. Fisher, Phys. Rev. B. 78, 104406 (2008).

External magnetic field effects on a distorted kagome antiferromagnet, J.-H. Kim, S. Ji, S.-H. Lee, B. Lake, T. Yildirim, H. Nojiri, H. Kikuchi, K. Habicht, Y. Qiu, and K. Kiefer, Phys. Rev. Lett. 101, 107201 (2008).

Quantum oscillations of the total spin in a heterometallic antiferromagnetic ring, T. Guigi, S. Carretta, P. Santini, G. Amoretti, R. Caciuffo, A. Hiess, J.R.D. Copley, Y. Qiu, G. Timco, and R.E.P. Winpenny, Notiziario Neutroni e Luce di Sincrotrone 13 (2),4 (2008).

Inelastic neutron scattering investigations of molecular nanomagnets, G. Amoretti, R. Caciuffo, S. Carretta, T. Guidi, N. Magnani, and P. Santini, Inorganica Chimica Acta 361, 3771 (2008).

Crystal structure of Li2B12H12: a possible intermediate species in the decompoition of LiBH4, J.-H. Her, M. Yousufuddin, W. Zhou, S. S. Jalisatgi, J. G. Kulleck, J. A. Zan, S.-J. Hwang, R. C. Bowman, Jr., and T. J. Udovic, Inorg. Chem. 47,9757 (2008).

A reversible structure transition of MIL-53 with temperature hysteresis, Y. Liu, J.-H. Her, A. Dailly, A.J. Ramirez-Cuesta, D.A. Neumann, and C.M. Brown, J. Am. Chem. Soc. 130, 11813 (2008).

* Aqueous peptides as experimental models for hydration water dynamics near protein surfaces, C. Malardier-Jugroot, M.E. Johnson, R.K. Murarka, and T. Head-Gordon, Phys. Chem. Chem. Phys. 10, 4903 (2008).

Structural studies of decomposition in Fe-x at.%Ga alloys, H. Cao, F. Bai, J.F. Li, D.D. Viehland, T.A. Lograsso, and P.M. Gehring, J. Alloys Compounds 465,244 (2008).

Single ferroelectric and chiral magnetic domain of single-crystalline BiFeO3 in an electric field, S. Lee, T. Choi, W. Ratcliff II, R. Erwin, S.-W. Cheong, and V. Kiryukhin, Phys. Rev. B 78, 100101(R) (2008).

Observation of a continuous phse transition in a shape-memory alloy, J.C. Lashley, S.M. Shapiro, B.L. Winn, C.P. Opeil, M.E. Manley, A. Alatas, W. Ratclisff, T. Park, R.A. Fisher, B. Mihaila, P. Riseborough, E.K.H. Salje, and J.L. Smith, Phys. Rev. Lett. 101, 135703 (2008).

Formation of pancakelike Ising domains and giant magnetic coercivity in ferrimagnetic LuFe2O4, W. Wu, V. Kiryukhin, H.-J. Noh, K. -T. Ko, J.-H. Park, W. Ratcliff II, P.A. Sharma, N. Harrison, Y.J. Choi, Y. Horibe, S. Lee, S. Park, H.T. Yi, C.L. Zhang, and S.-W. Cheong, Phys. Rev. Lett. 101, 137203 (2008).

Electric field control, of the magnetic state in BiFeO3 single crystals, S. Lee, W. Ratcliff, S.W. Cheong, et al., Appl. Phys. Lett. 92, 192906 (2008).

Low energy spin waves and magnetic interactions in SrFe2As2, J. Zhao, D.-X. Yao, S. Li, T. Hong, Y. Chen, S. chang, W. Ratcliff II, J.W. Lynn, H.A. Mook, G.F. Chen, J.L. Luo, N.L. Wang, E.W. Carlson, J. Hu and P. Dai, Phys. Rev. Lett. 101, 167203 (2008).

Neutron powder diffraction study of the magnetic and crystal structures of SrFe2(PO4)2, A. A. Belik, Q. Huang, E. Takayama-Muromachi, and J. W. Lynn, J. Solid State Chem. 181, 2292 (2008).

Quantum phase transition in the itinerant antiferromagnet (V0.9Ti0.1)2O3, H. Kadowaki, K. Motoya, T.J. Sato, J. W. Lynn, J.A. Fernandez-Baca, and J. Kikuchi, Phys. Rev. Lett. 101, 096406 (2008).

Signature of magnetic phase separation in the ground state of Pr1-xCaxMnO3, H. Sha, F. Ye, P. Dai, J. A. Fernandez-Baca, D. Mesa, J.W. Lynn, Y. Tomioka, Y. Tokura, and J. Zhang, Phys. Rev. B 78, 052410 (2008).

Doping evolution of antiferromagnetic order and structural distortion in LaFeAsO1-xFx, Q. Huang, J. Zhao, J. W. Lynn, G. F. Chen, J. L. Lou, N.L. Wang, and P. Dai, Phys. Rev. B 78,054529 (2008).

Magnetic switching and phase competition in the multiferroic antiferromagnet Mn,sub>1-xFexWO4, F. Ye, Y. Ren, J.A. Fernandez-Baca, H.A. Mook, J.W. Lynn, R.P. Chaudhury, Y.-Q. Wang, B. Lorenz, and C.W. Chu, Phys. Rev. B 78, 193101 (2008).

The crystalline electric field as a probe for long range antiferromagnetic order and superconductivity in CeFeAsO1-xFx, S. Chi, D.T. Adroja, T. Guidi, R. Bewley, S. Li, J. Zhao, J.W. Lynn, C.M. Broen, Y. Qiu, G.F. Chen, J.L. Lou, N.L. Wang, and P. Dai, Phys. Rev. Lett. 101, 217002 (2008).

Structural and magnetic phase diagram of CeFeAsO1-xFx and its relationship to high-temperature superconductivity, J. Zhao, Q. Huang, C. de la Cruz, S. Li, J.W. Lynn, Y. Chen, M.A. Green, G.F. Chen, G. Li, Z.C. Li, J.L. Luo, N.L. Wang, and P. Dai, Nature Materials 7, 953 (2008).

Pressure-induced colume-collapsed tetragonal phase of CaFe2As2 as seen via neutron scattering, A. Kreyssig, M.A. Green, Y.B. Lee, G.D. Samolyuk, P. Zajdel, J.W. Lynn, S.L. Bud'ko, M.S. Torikachvili, N. Ni, S. Nandi, J. Leão, S.J. Poulton, D.N. Argyriou, B.N. Harmon, P.C. Canfield, R.J. Mcqueeney, and A.I. Goldman, Phys. Rev. B 78,184517 (2008).

Unconventional spin order in the triangular lattice system NaCrO2: A neutron scattering study, D. Hsieh, D. Qian, R.F. Berger, R.J. Cava, J.W. Lynn, Q. Huang, and M.Z. Hasan, Physica B 403, 1341 (2008).

The pressure effect on the magnetic commensurability and ferroelectricity in multiferroic HoMn2O5, C. R. dela Cruz, B. Lorenz, W. Ratcliff, J. Lynn, M. M. Gospodinov, and C. W. Chu, Physica B 403, 1359 (2008).

Intrinsically localized mode in α-uranium as a precursor to a solid-state phase transition, M. E. Manley, J. W. Lynn, Y. Chen, and G. H. Lander, Phys. Rev. B 77, 052301 (2008).

Inelastic neutron scattering study of crystal field levels in PrOs4As12, S. Chi, P. Dai, T. Barnes, H. J. Kang, J. W. Lynn, R. Bewley, F. Ye, M. B. Maple, Z. Henkie, and A. Pietraszko, Phys. Rev. B 77, 094428 (2008).

Active creation of intrinsically localized vibrations in uranium using x-ray and neutron scattering, M. E. Manley, A. Alatas, F. Trouw, W. L. Hults, B. Leu, J. W. Lynn, and Y. Chen, Phys. Rev. B 77, 214305 (2008).

Structural and magnetic properties of the Ho2Ge2O7 pyrogermanate, E. Morosan, J. A. Fleitman, Q. Huang, J. W. Lynn, Y. Chen, X. Ke, M. L. Dahlberg, P. Schiffer, C. R. Craley and R. J. Cava, Phys. Rev. B 77, 224423 (2008).

Origin of the spin-valve effect and magnetoresistivity in single crystalline Ca3Ru2O7, W. Bao, Z. Q. Mao, Z. Qu, and J. W. Lynn, Phys. Rev. Lett. 100, 247203 (2008).

Neutron-scattering study of the oxypnictide superconductor LaFeAsO0.87F0.13, Y. Qiu, M. Kofu, W. Bao, S.-H. Lee, Q. Huang, T. Yildirim, J.R.D. Copley, J.W. Lynn, T. Wu, G. Wu, and X.H. Chen, Phys. Rev. B 78, 052508 (2008).

Field-induced antiferromagnetism and competition in the metamagnetic state of terbium gallium garnet, K. Kamazawa, D. Louca, R. Morinaga, T.J. Sato, Q. Huang, J.R.D. Copley, and Y. Qiu, Phys. Rev. B 78, 064412 (2008).

Structure variations and hydrogen storage properties of Ca5Si3 with Cr5B3-type structure, H. Wu, W. Zhou, T. J. Udovic, and J. J. Rush, Chem. Phys. Lett. 460,432 (2008).

The design of a bismuth-based auxiliary filter for the removal of spurious backgroudd scattering associated with filter-analyzer neutron spectrometers, T.J. Udovic, C.M. Brown, J.B. Leão, P.C. Brand, R.D. Jiggetts, R. Zeitoun, T.A. Pierce, I. Peral, J.R.D. Copley, Q. Huang, D.A. Neumann, and R.J. Fields, Nucl. Instr. Meth. A588, 406 (2008).

Structures and crystal chemistry of Li2BNH6 and Li4BN3H10, H. Wu, W. Zhou, T.J. Udovic, J.J. Rush and T. Yildirim, Chem. Mater. 20, 1245 (2008).

Crystal chemistry of Perovskite-type hydride NaMgH3: Implications for hydrogen storage, H. Wu, W. Zhou, T.J. Udovic, J.J. Rush and T. Yildirim, Chem. Mater. 20, 2335 (2008).

Increasing the density of adsorbed hydrogen with coordinatively unsaturated metal centers in metal-organic frameworks, Y. Liu, H. Kabbour, C.M. Brown, D.A. Neumann, and C.C. Ahn, Langmuir 24, 4772 (2008).

Hydrogen adsorption in MOF-74 studied by inelastic neutron scattering, Y. Liu, C.M. Brown, D.A. Neumann, H. Kabbour, and C.C. Ahn, Life Cycle Analysis for New Energy Conversion and Storage Systems, edited by V.M. Fthenakia, A.C. Dillon, and N. Savage (Mater. Res. Soc. Symp. Proc. Vol. 1041E, Warrendale, PA, 2008), 1040-R2_03 (2008).

* Concentration dependence of shape and structure fluctuations of droplet microemulsions investigated by neutron spin echo spectroscopy, M. Nagao and H. Seto, Phys. Rev. E 78, 011507 (2008).

* The impact of kosmotropes and chaotropes on bulk and hydration shell water dynamics in a model peptide solution, D. Russo, Chem. Phys. 345, 200 (2008).

* The origin of the dynamic transition in proteins, S. Khodadadi, S. Pawlus, J.H. Roh,V. García Sakai, E. Mamontov, and A.P. Sokolov, J. Chem. Phys. 128, 195106 (2008).

* Comparison of explicit atom, united atom, and course-grained simulations of poly(methyl methacrylate), C. Chen, P. Depa, V. García Sakai, and J.K. Maranas, J. Chem. Phys. 128, 124906 (2008).

* Quasielastic neutron scattering of -NH3 and -BH3 rotational dynamics in orthorhombic ammonia borane, N.J. Hess, M.R. Hartman, C.M. Brown, E. Mamontov, A. Karkamkar, D.J. Heldebrant, L.L. Daemen, T. Autrey, Chem. Phys. Lett. 459, 85 (2008).

* Dynamics of PEO in blends with PMMA: study of the effects of blend composition via quasi-elastic neutron scattering, V. García Sakai, J.K. Maranas, I. Peral, and J.R.D. Copley, Macromolecules 41, 3701 (2008).

* Microlensing in binary systems, D. Ricci, Proceedings of the Manchester Microlensing Conference: The 12th International Conference and ANGLES Microlensing Workshop, PoS(GMC8)031 (2008).

Magnetic order close to superconductivity in the iron-based layered LaO1-xFxFeAs systems, C. de la Cruz, Q. Huang, J.W. Lynn, J. Li, W. Ratcliff II, J.L. Zarestky, H.A. Mook, G.F. Chen, J.L. Luo, N.L. Wang and P. Dai, Nature 453, 899 (2008).

* Role of hydration water in dynamics of biological macromolecules, A.P. Sokolov, J.H. Roh, E. Mamontov, V. García Sakai, Chem. Phys. 345, 212 (2008).

* Local polymer dynamics in polymer-C60 mixtures, J.M. Kropka, V. García Sakai and P.F. Green, Nanoletters 8, 1061 (2008).

* Spectroscopic and theoretical study of a mononuclear manganese(III) complex exhibiting a tetragonally compressed geometry, Q. Scheifele, C. Riplinger, F. Neese, H. Weihe, A.-L. Barra, F. Juranyi, A. Podlesnyak, and P.L.W. Tregenna-Piggott, Inog. Chem. 47, 439 (2008).

* Studying the galactic outflow in NGC 1569, M.S. Westmoquette, L.J. Smith, and J.S. Gallagher III, Mon. Not. R. Astron. Soc. 383,864-878 (2008).

* Introducing the time-of-flight backscattering instrument, MARS at SINQ, P.L.W. Tregenna-Piggott, F. Juranyi, and P. Allenspach, Neutron News 19, 20 (2008).


2007 (32 publications: 24 in text, 8 personal acknowledgments)

* Gemini/IFU observations of galactic outflows in starburst galaxies, L.J. Smith and M.S. Westmoquette, Proceedings of the International Astronomical Union 3, 379 (2007).

* A Java-based science portal for neutron scattering experiments, S.S. Vazhkudai, J.A. Kohl, and J. Schwidder, ACM International Conference Proceeding Series; Vol. 272 Proceedings of the 5th international symposium on Principles and practice of programming in Java, 21 (2007).

* Gemini GMOS/integral field unit spectroscopy of NGC 1569 ? II:Mapping the roots of the galactic outflow, M.S. Westmoquette, L.J. Smith, J.S. Gallagher III and K.M. Exter, Mon. Not. R. Astron. Soc. 381, 913-931 (2007).

* Hubble Space Telescope space telescope imaging spectrograph spectroscopy of the environment in the starburst core of M82, M.S. Westmoquette, L.J. Smith, J.S. Gallagher III, R.W. O'Connell, D.J. Rosario, and R. de Grijs, Astrophys. J. 461, 358-373 (2007).

* Molecular dynamics in ammonium dihydrogen phosphate using incoherent neutron scattering, V. Tripadus, M. Gugiu, M. Statescu, and A. Podlesnyak, Chem. Phys 335, 233-241 (2007).

* Introducing the inverted time-of-flight backscattering instrument, MARS at SINQ, P. Allenspach, F. Juranyi, and P.L.W. Tregenna-Piggott, Swiss Neutron News 31, 16-27 (2007).

* Multitier portal acrhitecture for thin- and thick-neutron scattering experiment support, M. Green and S.D. Miller, Grid Computing Environments Conference Proceedings, http://library.rit.edu/oajournals/index.php/gce/article/view/102/80 (2007).

Quantum-spin-liquid states in the two-dimensional kagome antiferromgnets ZnxCu4-x(OD)6Cl2, S.-H. Lee, H. Kikuchi, Y. Qiu, B. Lake, Q. Huang, K. Habicht and K. Kiefer, Nature Materials 6, 853-857 (2007).

Dynamics of quantum spin liquid and spin solid phases in IPA-CuCl3 under an applied magnetic field studied with neutron scattering, A. Zheludev, V.O. Garlea, T. Masuda, H. Manaka, L.-P. Regnault, E. Ressouche, B. Grenier, J.-H. Chung, Y. Qiu, K. Habicht, K. Kiefer and M. Boehm, Phys. Rev. B 76, 054450 (2007).

Magnetic interactions in the geometrically frustrated triangular lattice antiferromagnet CuFeO2, F. Ye, J.A. Fernandez-Baca, R.S. Fishman, Y. Ren, H.J. Kang, Y. Qiu and T. Kimura, Phys. Rev. Lett. 99, 157201 (2007).

Neutron vibrational spectroscopy of the Pr2Fe17-based hydrides, T.J. Udovic, W. Zhou, H. Wu, C.M. Brown, J.J. Rush, T. Yildirim, E. Mamontov and O. Isnard, J. All. Com. 446-447, 504-507 (2007).

Inelastic neutron scattering of H2 adsorbed in HKUST-1, Y. Liu, C.M. Brown, D. A. Neumann, V.K. Peterson, and C.J. Kepert, J. All. Com. 446-447, 385-388 (2007).

Inelastic neutron scattering of H2 adsorbed on boron substituted single walled carbon nanotubes, Y. Liu, C.M. Brown, J.L. Blackburn, D. A. Neumann, T. Gennett, L. Simpson, P. Parilla, A.C. Dillon, and M.J. Heben, J. All. Com. 446-447, 368-372 (2007).

* Gapped itinerant spin excitations account for missing entropy in the hidden-order state of URu2Si2, C.R. Wiebe, J.A. Janik, G.J. MacDougall, G.M. Luke, J.D. Garrett, H.D. Shou, Y.,-J. Jo, L. Balicas, Y. Qiu, J.R.D. Copley, Z. Yamani and J.L. Buyers, Nature Physics 3, 96-100 (2007).

* Studies of intrinsic exchange interactions in Zn(Mn)O, Zn(Mn)S and Zn(Mn)Te at 4 kbar by inelastic neutron scattering, Z.Q. Wiren, H. Kepa, C.M. Brown, J. Leão, S. Kolesnik, B. Dabrowski, J.K. Furdyna, and T.M. Giebultowicz, Physics of Semiconductors: 28th International Conference on the Physics of Semiconductors, W. Jantsch and F.Schaffler, eds., AOP Conference Proceedingd Volume 893, pp. 1197-1198 (2007).

* Gemini GMOS/IFU spectroscopy of NGC 1569 ? I:Mapping the properties of a young star cluster and its environment, M.S. Westmoquette, K.M. Exter, L.J. Smith, and J.S. Gallagher III, Mon. Not. R. Astron. Soc. 381, 894 (2007).

* Separable cooperative and localized translational motions of water confined by a chemically heterogeneous environment, C. Malardier-Jugroot and T. Head-Gordon, Chem. Phys. Phys. Chem. 9, 1962 (2007).

* The origin of persistent spin dynamics and residual entropy in the stuffed spin ice Ho2.3Ti1.7O7−δ, H.D. Zhou, C.R. Wiebe, Y.J. Jo, L. Balicas, Y. Qiu, J.R.D. Copley, G. Ehlers, P. Fouquet, and J.S. Gardner, J. Phys.: Condens. Matter 19, 342201 (2007).

* Winds from super star clusters: The interstellar environment in the starburst core of M82, L.J. Smith and M.S. Westmoquette, New Astron. Rev. 51, 135?140 (2007).

* Effects of hydration water on protein methyl group dynamics in solution, D. Russo, G.L. Hura, and J.R.D. Copley, Phys. Rev. E 75, 040902(R) (2007).

* Neutron Spin-Echo measurements on the dynamics of surfactant membranes, M. Nagao, H. Seto and A. Faraone, Quasi-Elastic Neutron Scattering Conference 2006 (QENS 2006), edited by Paul E. Sokol, H. Kaiser, D.Baxter, R. Pynn, D. Bossev, and M. Leuschner (Mater. Res. Soc., Warrendale, PA, 2007), 101 (2007).

Studies of dynamical layering in adsorbed organic films, A.Diama, M.Simpson, H.Taub, F.Y.Hansen, R.M.Dimeo, D.A.Neumann, K.W.Herwig and U.G.Volkmann, Quasi-Elastic Neutron Scattering Conference 2006 (QENS 2006), edited by Paul E. Sokol, H. Kaiser, D.Baxter, R. Pynn, D. Bossev, and M. Leuschner (Mater. Res. Soc., Warrendale, PA, 2007), 89 (2007).

* Mobility of water on oxide surfces studied by QENS, E. Mamontov, Quasi-Elastic Neutron Scattering Conference 2006 (QENS 2006), edited by Paul E. Sokol, H. Kaiser, D.Baxter, R. Pynn, D. Bossev, and M. Leuschner (Mater. Res. Soc., Warrendale, PA, 2007), 13 (2007).

* The effect of the unsaturated double bond on the bending elasticity of lipid membranes studied by Neutron Spin Echo, Zheng Yi and D. Bossev, Quasi-Elastic Neutron Scattering Conference 2006 (QENS 2006), edited by Paul E. Sokol, H. Kaiser, D.Baxter, R. Pynn, D. Bossev, and M. Leuschner (Mater. Res. Soc., Warrendale, PA, 2007), 123 (2007).

* Comparative study of normal and branched alkane monolayer films adsorbed on a solid surface: II. Dynamics, A.D. Enevoldsen, F.Y. Hansen, A. Diama, H. Taub, R.M. Dimeo, D.A. Neumann, and J.R.D. Copley, J. Chem. Phys. 126, 104704 (2007).

* Dynamics of water in a porous phophate glass, C. M. Brown, Y. Liu, S.-P. Tung, W.-R. Chen, and B.-J. Hwang, Quasi-Elastic Neutron Scattering Conference 2006 (QENS 2006), edited by Paul E. Sokol, H. Kaiser, D.Baxter, R. Pynn, D. Bossev, and M. Leuschner (Mater. Res. Soc., Warrendale, PA, 2007), 45 (2007).

* A quasi-elastic neutron scattering study of the dynamics of alkane and ether molecules tethered to the surface of MCM-41, E. J. Kintzel Jr., K. W. Herwig, M. K. Kidder, P. F. Britt, A. C. Buchanan III, and A. L. Chaffee, Quasi-Elastic Neutron Scattering Conference 2006 (QENS 2006), edited by Paul E. Sokol, H. Kaiser, D.Baxter, R. Pynn, D. Bossev, and M. Leuschner (Mater. Res. Soc., Warrendale, PA, 2007), 31 (2007).

* Dynamics and structure of hydration water on rutile and cassiterite nanopowders studied by quasielastic neutron scattering and molecular dynamics simulations, E. Mamontov, L. Vlcek, D. J. Wesolowski, P. T. Cummings, W. Wang, L. M. Anovitz, J. Rosenqvist, C. M. Brown, and V. García Sakai, J. Phys. Chem. C. 111, 4328 (2007).

* A comparative study of normal and branched alkane monolayer films on a solid surface: II. Dynamics, A.D. Enevoldsen, F.Y. Hansen, A. Diama, H. Taub, R.M. Dimeo, D.A. Neumann, and J.R.D. Copley, J. Chem. Phys. 126, 104704 (2007).

Diffusion of water in the Na0.3CoO2·1.4H2O superconductor, V. García Sakai, E. Mamontov, J. W. Lynn, L. Viciu and R. J. Cava, Phys. Rev. B, 75, 014505 (2007).

* Spin dynamics of Fe7M (M=Zn, Mn) heterometallic rings probed by neutron spectroscopy, T. Guidi, J.R.D. Copley, Y.Qiu, S. Carretta, P. Santini, G. Amoretti, G. Timco, R.E.P. Winpenny, C.L. Dennis, and R. Caciuffo, Phys. Rev. B. 75, 014408 (2007).

* A molecular view of melting in anhydrous phospholipidic membranes, M. Doxastakis, V. García Sakai, S. Ohtake, J.K. Maranas, and J.J. de Pablo, Biophys. J. 92, 147 (2007).


2006 (23 publications: 15 in text, 8 personal acknowledgments)

* Dynamics of ammonia borane using neutron scattering, C.M. Brown, T.L. Jacques, N.J. Hess, L.L. Daemen, E. Mamontov, J.C. Linehan, A.C. Stowe, and T. Autrey, Physica B 385-386, 266 (2006).

* Local dynamics of syndiotactic poly(methyl methacrylate) using molecular dynamics simulation, C. Chen, J.K. Maranas, and V. García Sakai, Macromolecules 39, 9630 (2006).

* Diffusive hydrogen motion in ZrBe2H0.56: A quasielastic neutron scattering study, R.L. Cappelletti, T.J. Udovic, Z. Chowdhuri, B.C. Hauback, A.J. Maeland, R.M. Dimeo, Physica B 385-386, 208 (2006).

* The boson peak in melt-formed and damage-formed glasses: a defect signature?, H. Bhat, I. Peral, J.R.D. Copley, and C.A. Angell, J. Non-Cryst. Solids 352, 4517 (2006).

Neutron scattering from a coordination polymer quantum paramagnet, T. Hong, M. Kenzelmann, M.M. Turnbull, C.P. Landee, B.D. Lewis, K.P. Schmidt, G.S. Uhrig, Y. Qiu, C. Broholm, and D. Reich, Phys. Rev. B 74, 094434 (2006).

Local order and frustration in the geometrically frustrated spinels Cd1-xZnxV2O4, Z. Zhang, D. Louca, A. Visinoiu, S.-H. Lee, J.D. Thompson, T. Proffen, A. Llobet, Y. Qiu, S. Park, and Y. Ueda, Phys. Rev. B 74, 014108 (2006).

* Isomeric and concentration effects of C4-cosurfactants on four-component microemulsions investigated by neutron spin-echo and small-angle scattering, E. Zambrano, M. Kotlarchyk, A. Langner and A. Faraone, J. Phys.: Condens. Matter 18, S2451 (2006).

* Vibrational analysis of the inelastic neutron scattering spectra of electron donor-acceptor complexes II. Tetracyanoethylene-perylene by electronic structure calculations, J.A. Ciezak, J.B. Leão, and B.S. Hudson, J. Molec. Struct:THEOCHEM 23, 767 (2006).

* Influence of hydration on the dynamics of lysozyme, J.H. Roh, J.E. Curtis, S. Azzam, V.N. Novikov, I. Peral, Z. Chowdhuri, R.B. Gregory, and A.P. Sokolov, Biophys. J. 91, 2573 (2006).

* Inelastic neutron scattering investigation of hydrating tricalcium and dicalcium silicate mixtures, V.K. Peterson, D.A. Neumann, and R.A. Livingston, J. Mater. Res. 21, 1836 (2006).

* Quasielastic neutron scattering study of diffusive hydrogen motion in ZrBe2H0.56, R.L. Cappelletti, Z. Chowdhuri, T.J. Udovic, R.M. Dimeo, B.C. Hauback, and A.J. Maeland, Phys. Rev. B 73, 224109 (2006).

* A comparison of united atom, explicit atom and coarse-grained simulation models for poly(ethylene oxide), C. Chen, P. Depa, V. García Sakai, J.K. Maranas, J.W. Lynn, I. Peral, and J.R.D. Copley, J. Chem. Phys. 124, 234901 (2006).

* The inelastic neutron scattering spectrum of 1,4-Dinitroimidazole and the reproduction of its solid-state features by periodic DFT methods, J.A. Ciezak and S.F. Trevino, Mater. Res. Soc. Symp. Proc. 896-H05-02.1 (2006).

* Inleastic neutron scattering spectrum of cyclotrimethylenetrinitamine: A comparison with solid-state electronic structure calculations, J.A. Ciezak and S.F. Trevino, J. Phys. Chem. A 110, 5149 (2006).

* Structural and vibrational characterization of tetracyanoethylene-hexamethylbenzene as a function of pressure, J.A. Ciezak and J.B. Leão, J. Phys. Chem. A 110, 3759 (2006).

* The composition dependence of segmental dynamics of poly(methyl methacrylate) in miscible blends with poly(ethylene oxide), J. Liu, V. García Sakai, J.K. Maranas and Z. Chowdhuri, Macromolecules 39, 2866 (2006).

* Dynamics of hydrogen in Pr2Fe17H4 and Pr2Fe17H5, E. Mamontov, T.J. Udovic, J.J. Rush, and O. Isnard, Mater. Res. Soc. Symp. Proc. 885E, 0885-A08-07.1-5 (2006).

Temperature dependent bilayer ferromagnetism in Sr3Ru2O7, M.B. Stone, M.D. Lumsden, R. Jin, B.C. Sales, D. Mandrus, S.E. Nagler, and Y.Qiu, Phys. Rev. B 73, 174426 (2006).

Field-induced order and spin waves in the pyrochlore antiferromagnet, K.C. Rule, J.P.C. Ruff, B.D. Gaulin, S.R. Dunsiger, J.S. Gardner, J.P. Clancy, M.J. Lewis, H.A. Dabkowska, I. Mirebeau, P. Manuel, Y. Qiu, and J.R.D. Copley, Phys. Rev. Lett. 96, 177201 (2006).

Dynamics of composite Haldane spin chains in IPA-CuCl3, T. Masuda, A. Zheludev, H. Manaka, L.-P. Regnault, J.-H. Chung, and Y. Qiu, Phys. Rev. Lett. 96, 047210 (2006).

Probing spin frustration in high-symmetry magnetic nanomolecules by inelastic neutron scattering, V.O. Garlea, S.E. Nagler, J.L. Zarestky, C. Stassis, D. Vaknin, P. Kögerler, D.F. McMorrow, C. Niedermayer, D.A. Tennant, B. Lake, Y. Qiu, M. Exler, J.Schnack, and M. Luban, Phys. Rev. B 73, 024414 (2006).

Nanomagnetic droplets and implications to orbital ordering in La1-xSrxCoO3, D. Phelan, D. Louca, S. Rosenkranz, S.-H. Lee, Y. Qiu, P.J. Chupas, R. Osborn, H. Zheng, J.F. Mitchell, J.R.D. Copley, J.L. Sarrao and Y. Moritomo, Phys. Rev. Lett. 96, 027201 (2006).

Dynamic transition in tRNA is solvent induced, G. Caliskan, R. M. Briber, D. Thirumalai, V. García Sakai, S. A. Woodson, and A. P. Sokolov, J. Am. Chem. Soc.128, 32-33 (2006).


2005 (18 publications: 18 in text, 0 personal acknowledgments)

* Data reduction on time-of-flight instruments, P.L.W. Tregenna-Piggott, Swiss Neutron News 28, 4 (2005).

* Diffusion of benzene confined in the oriented nanochannels of chrysotile asbestos fibers, E. Mamontov, Yu A. Kumzerov, and S.B. Vakhrushev, Phys. Rev. E 72, 051502 (2005).

* Observation of fragile-to-strong liquid transition in surface water in CeO2, E. Mamontov, J. Chem. Phys. 123, 171101 (2005).

* Theoretical and experimental study of the inelastic neutron scattering spectra of B-5-Nitro-2,4-dihydro-3H-1,2,4-triazol-3-one, J.A. Ciezak and S.F. Trevino, J. Molec. Struct.:THEOCHEM 732, 211 (2005).

* Miscible blend dynamics and the length scale of local Compositions, V. García Sakai, J.K. Maranas, Z. Chowdhuri, I. Peral, and J.R.D. Copley, J. Polym. Sci. Part B: Polym. Phys. 43,2914 (2005).

* High-resolution neutron scattering study of slow dynamics of surface water molecules in zirconium oxide, E.Mamontov, J. Chem.Phys., 123, 024706 (2005).

* Onset of anharmonicity in protein dynamics, J.H. Roh, V.N. Novikov, R.B. Gregory, J.E. Curtis, Z. Chowdhuri, and A.P. Sokolov, Phys. Rev. Lett. 95, 038101 (2005).

* Hydration of tricalcium and dicalcium silicate mixtures studied using quasielastic neutron scattering, V.K. Peterson, D.A. Neumann, and R.A. Livingston, J. Phys. Chem. B 109, 14449 (2005).

* Molecular view of water dynamics near model peptides, D. Russo, R.K. Murarka, J.R.D. Copley, and T. Head-Gordon, J. Phys. Chem. B 109, 12966 (2005).

* Translational dynamics of water in the nanochannels of oriented chrysotile asbestos fibers, E.Mamontov, Yu A. Kumzerov, and S.B. Vakhrushev, Phys. Rev. E 71, 061502 (2005).

* Structure and dynamics of propylene oxide and trimethylene oxide clathrate hydrates, I. Peral, J.E. Curtis,B.C. Chakoumakos and C.Y. Jones, Proceedings of the Materials Research Society 2004 Fall Meeting: Neutron and X-Ray Scattering as Probes of Multiscale Phenomena. Volume 840, (Warrendale, PA, 2005), paper Q2.1, Editors: S.R.Bhatia, P.G.Khalifah,D.Pochan, P.Radaelli. ISBN: 1-55899-788-1. (2005).

* Molecular dynamics of confined glucose solutions, G. Lelong, D.L. Price, A. Douy, S. Kline, J.W. Brady, and M.-L. Saboungi, J. Chem. Phys. 122, 164504 (2005).

* Spin dynamics and tunneling of the Neel vector in the Fe10 magnetic wheel, P. Santini, S. Carretta, G. Amoretti, T. Guidi, R.Caciuffo, A. Caneschi, D. Rovai, Y. Qiu, and J.R.D. Copley, Phys. Rev. B 71, 184405 (2005).

* The molecular structure and inelastic neutron scattering spectra of 2,6-diamino-3,5-dinitropyrazine, J.A. Ciezak and S.F. Trevino, J. Molec. Struct.:THEOCHEM 723, 241 (2005).

* Translational dynamics of water in nanoporous layered silicate, S. Nair, Z. Chowdhuri, I. Peral, D.A. Neumann, L.Charles Dickinson, H.-K. Jeong, and M. Tsapatsis, Phys. Rev. B 71, 104301 (2005).

* The inelastic neutron scattering spectra of a-2-amino-5-nitro-1,2,4-2H-triazole: Experiment and DFT calculations, J.A. Ciezak and S.F. Trevino, Chem. Phys. Lett. 403, 329 (2005).

* Magnetic order and spin dynamics in ferroelectric HoMnO3, O.P. Vajk, M. Kenzelmann, J.W. Lynn, S.B. Kim, and S.-W. Cheong, Phys. Rev. Lett. 94, 087601 (2005).

* Rotational dynamics of methyl groups in m-xylene, O. Kirstein, M. Prager, R.M. Dimeo, and A. Desmedt, J. Chem. Phys. 122, 014502 (2005).


2004 (9 publications: 9 in text, 0 personal acknowledgments)

* Vibrations of micro-eV energies in nanocrystallilne microstructures, A.F. Yue, A.B. Papandrew, O. Delaire, B. Fultz, Z. Chowdhuri, R.M. Dimeo and D.A. Neumann, Phys. Rev. Lett. 93, 205501 (2004).

* Methyl rotational tunneling dynamics of p-xylene confined in a crystalline zeolite host, S. Nair, R.M. Dimeo, D.A. Neumann, A.J. Horsewill, and M. Tsapatsis, J. Chem. Phys. 121, 4810 (2004).

* Molecular dynamics of glucose in solution: a quasielastic neutron scattering study, L.J. Smith, D.L. Price, Z. Chowdhuri, J.W. Brady, and M.-L. Saboungi, J. Chem. Phys. 120, 3527 (2004).

* Dynamics of surface water in ZrO2 studied by quasielastic neutron scattering, E. Mamontov, J. Chem. Phys. 121, 9087 (2004).

* Evidence for anomalous hydration dynamics near a model hydrophobic peptide, D. Russo, R.K. Murarka, G. Hura, E. Verschell, J.R.D. Copley and T. Head-Gordon, J. Phys. Chem. B 108, 19885 (2004).

* Dynamics of water molecules in glucose solutions, C. Talon, L.J. Smith, J.W. Brady, B.A. Lewis, J.R.D. Copley, D.L. Price, and M.-L. Saboungi, J. Phys. Chem. B 108, 5120 (2004).

* Effect of blending with poly(ethylene oxide) on the dynamics of poly(methyl methacrylate): a quasielastic neutron scattering approach, V. García-Sakai, C. Chen, J.K. Maranas, and Z. Chowdhuri, Macromolecules 37, 9975 (2004).

* Dynamics of trimethylene oxide in a structure II clathrate hydrate, C.Y. Jones and I. Peral, American Mineralogist 89, 1176 (2004).

* Hydration dynamics near a model protein surface, D. Russo, G. Hura and T. Head-Gordon, Biophys. J. 86, 1852 (2004).


2003 (1 publications: 1 in text, 0 personal acknowledgments)

* Diffusion of H2 adsorbed on single walled carbon nanotubes, D.G. Narehood, J.V. Pearce, P.C. Eklund, P.E. Sokol, R.E. Lechner, J. Pieper, J.R.D. Copley and J.C. Cook, Phys. Rev. B 67, 205409 (2003).