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Publications from Research Conducted at POWGEN

The following 371 publications were retrieved from PuSH (Publications of SNS and HFIR)

2019 5 Publications

Hona R.K., Huq A., Ramezanipour F., "Electrical properties of the ordered oxygen-deficient perovskite Ca2Fe0.5Ga1.5O5", Ionics, (2019).
Kirsch A., Murshed M.M., Kirkham M.J., Huq A., Litterst F.J., Gesing T.M., "Temperature-dependent Structural and Spectroscopic Studies of (Bi1–xFex)FeO3", Journal of Physical Chemistry C, (2019).
Lee S.H., Huq A., Yang W., Kim J., "Analysis of local sites of deuterium in Ti53Zr27Ni20 alloys", Physica B: Condensed Matter, (2019).
Trickett C.A., Osborn Popp T.M., Su J., Yan C., Weisberg J., Huq A., Urban P., Jiang J., Kalmutzki M.J., Liu Q., Baek J., Head-Gordon M.P., Somorjai G.A., Reimer J.A., Yaghi O.M., "Identification of the strong Brønsted acid site in a metal–organic framework solid acid catalyst", Nature Chemistry, (2019).
Xue Z., Ramirez-Cuesta A.J., Brown C.M., Calder S., Cao H.B., Chakoumakos B.C., Daemen L.L., Huq A., Kolesnikov A.I., Mamontov E., Podlesnyak A.A., Wang X.P., "Neutron Instruments for Research in Coordination Chemistry", European Journal of Inorganic Chemistry, (2019).

2018 54 Publications

Allen J.L., Allen J.L., Delp S.A., Wolfenstine J., Jow T.R., "LiCoPO4 V Li-ion Cathode", 726 Innovations in Army Energy and Power Materials Technologies Materials Research Forum (2018).
Brady A., "Structural Investigations of Lithium Battery Anode and Cathode Materials", Ph.D. Dissertation, State University of New York at Stony Brook (2018).
Calder S., An K., Boehler R., dela Cruz C., Frontzek M., Guthrie M., Haberl B., Huq A., Kimber S.A., Liu J., Molaison J.J., Neuefeind J., Page K., dos Santos A.M., Taddei K.M., Tulk C.A., Tucker M.G., "A suite-level review of the neutron powder diffraction instruments at Oak Ridge National Laboratory", Review of Scientific Instruments, 89, 9, 092701 (2018).
Chamorro J.R., Ge L., Flynn J., Subramanian M.A., Mourigal M., McQueen T.M., "Frustrated spin one on a diamond lattice in NiRh2O4", Physical Review Materials , 2, 034404 (2018).
Cladek B., Everett S.M., McDonnell M.T., Tucker M.G., Keffer D.J., Rawn C.J., "Guest-Host Interactions in Mixed CH4 – CO2 Hydrates: Insights from Molecular Dynamic Simulations", Journal of Physical Chemistry C, 122, 34, 19575-19583 (2018).
Cochrane C., Daymond M.R., "Phase Transformation Temperatures and Solute Redistribution in a Quaternary Zirconium Alloy", Metallurgical and Materials Transactions A, 44, 542, 1-18 (2018).
Dashjav E., Ma Q., Xu Q., Tsai C.L., Giarola M., Mariotto G., Tietz F., "The influence of water on the electrical conductivity of aluminum-substituted lithium titanium phosphates", Solid State Ionics, 321, 83-90 (2018).
Fabini D.H., "Main-Group Halide Perovskites: Structural & Dynamical Insights for Photovoltaic Performance", Ph.D. Dissertation, University of California Santa Barbara (2018).
Fanah S.J., Yu M., Huq A., Ramezanipour F., "Insight into Lithium-Ion Mobility in Li2La(TaTi)O7", Journal of Materials Chemistry A, 6, 44, 22152-22160 (2018).
Gaudet J., Hallas A.M., Kolesnikov A.I., Gaulin B.D., "Effect of chemical pressure on the crystal electric field states of erbium pyrochlore magnets", Physical Review B, 97, 024415, (2018).
Granroth G.E., An K., Smith H.L., Whitfield P., Neuefeind J., Lee J., Zhou W., Sedov V.N., Peterson P.F., Parizzi A., Skorpenske H.D., Hartman S.M., Huq A., Abernathy D.L., "Event-based processing of neutron scattering data at the Spallation Neutron Source", Journal of Applied Crystallography, 51, 1-14 (2018).
Grins J., Wardecki D., Jansson K., Carlson S., Biendicho J.J., Svensson G., "A structural study of Ruddlesden–Popper phases Sr3−xYx(Fe1.25Ni0.75)O7−δ with x ≤ 0.75 by neutron powder diffraction and EXAFS/XANES spectroscopy", Journal of Materials Chemistry A, 6, 5313-5323 (2018).
Gurieva G., Rios L.E., Franz A., Whitfield P., Schorr S., "Intrinsic point defects in off-stoichiometric Cu2ZnSnSe4: A neutron diffraction study", Journal of Applied Physics, 123, 16, 161519 (2018).
Harwell J.R., Payne J.L., Sajjad M.T., Heutz F.J., Dawson D.M., Whitfield P., Irvine J.T., Samuel I.D., Carpenter M.A., "Role of lattice distortion and A site cation in the phase transitions of methylammonium lead halide perovskites", Physical Review Materials , 2, 6, 065404 (2018).
Hona R.K., Huq A., Ramezanipour F., "Magnetic structure of CaSrFeCoO<inf>6–δ</inf>: Correlations with structural order", Materials Research Bulletin, 106, 131-136 (2018).
James A., Esfahani M.M., Woerner W.R., Sinclair A., Ehm L., Oganov A.R., Parise J.B., "Theoretical and Experimental Investigations into Novel Oxynitride Discovery in the GaN-TiO2 System at High Pressure", Crystals, 8, 2, 15 (2018).
Jiang P., Huang Q., Avdeev M.V., Tao F., Zhou L., Gao W., Cong R., Yang T., "Substitution-Induced Structure Evolution and Zn2+/Ga3+ Ordering in “114” Oxides MAZn2Ga2O7 (M = Ca2+, Sr2+; A = Sr2+, Ba2+)", Inorganic Chemistry, 57, 13, 7770-7779 (2018).
Kan W.H., Chen D., Papp J.K., Shukla A.K., Huq A., Brown C.M., McCloskey B., Chen G., "Unravelling Solid-State Redox Chemistry in Li1.3Nb0.3Mn0.4O2 Single-Crystal Cathode Material", Chemistry of Materials, 30, 5, 1655–1666 (2018).
Kan W.H., Deng B., Xu Y., Shukla A.K., Bo T., Zhang S., Liu J., Pianetta P., Wang B.T., Liu Y., Chen G., "Understanding the Effect of Local Short-Range Ordering on Lithium Diffusion in Li1.3Nb0.3Mn0.4O2 Single-Crystal Cathode", Chem, 4, 9, 2108-2123 (2018).
Kaup K., Lalere F., Huq A., Shyamsunder A., Adermann T., Hartmann P., Nazar L.F., "Correlation of structure and fast ion conductivity in the solid solution series Li1+2xZn1-xPS4", Chemistry of Materials, 30, 3, 592-596 (2018).
Keshavarz S., Kontos S., Wardecki D., Kvashnin Y.O., Pereiro M., Panda S.K., Sanyal B., Eriksson O., Grins J., Svensson G., Gunnarsson K., Svedlindh P., "Magnetic properties of Ruddlesden-Popper phases Sr 3 − x Y x ( Fe 1.25 Ni 0.75 ) O 7 − δ : A combined experimental and theoretical investigation", Physical Review Materials , 2, 4, 044005 (2018).
Kirkham M.J., Heroux L., Ruiz-Rodriguez M., Huq A., "AGES: Automated Gas Environment System for in situ neutron powder diffraction", Review of Scientific Instruments, 89, 9, 092904 (2018).
Kumar N., Patterson E., Fromling T., Gorzkowski E.P., Eschbach P., Love I., Mueller M.P., de Souza R., Tucker J., Reese S.R., Cann D.P., "Defect Mechanisms in BaTiO3-BiMO3 Ceramics", Journal of the American Ceramic Society, 101, 6, 2376-2390 (2018).
Li M.R., Stephens P.W., Croft M., Deng Z., Li W., Jin C., Retuerto M., Hodges J.P., Frank C.E., Wu M., Walker D., Greenblatt M., "Mn2(Fe0.8Mo0.2)MoO6: A Double-Perovskite with Multiple Transition Metal Sublattice Magnetic Effects", Chemistry of Materials, 30, 14, 4508-4514 (2018).
Li Z.Y., Cho Y., Li X., Li X.Y., Aimi A., Inaguma Y., Alonso J.A., Fernandez-Diaz M.T., Yan J.Q., Downer M.C., Henkelman G., Goodenough J.B., Zhou J.S., "New mechanism for ferroelectricity in the perovskite Ca2-xMnxTi2O6 synthesized by spark plasma sintering", Journal of the American Chemical Society, 146, 6, 2214–2220 (2018).
Lussier J.A., Simon F.J., Whitfield P., Singh K., Thangadurai V., Bieringer M., "Structure Evolution and Reactivity of the Sc(2–x)VxO3+δ (0 ≤ x ≤ 2.0) System", Inorganic Chemistry, 57, 9, 5607-5614 (2018).
Lussier J.A., Souza D.H., Whitfield P., Bieringer M., "Structural Competition and Reactivity of Rare-Earth Oxide Phases in YxPr2–xO3 (0.05 ≤ x ≤ 0.80)", Inorganic Chemistry, 57, 22, 14106–14115 (2018).
Mao J., Niedziela J., Wang Y., Xia Y., Ge B., Liu Z., Zhou J., Ren Z., Liu W., Chan M.K., Chen G., Delaire O., Zhang Q., Ren Z.F., "Self-compensation induced vacancies for significant phonon scattering in InSb", Nano Energy, 48, 189-196 (2018).
McQuade R., Rowe T., Manjon-Sanz A., Puente L.d., Dolgos M., "An investigation into group 13 (Al, Ga, In) substituted (Na0.5Bi0.5)TiO3-BaTiO3 (NBT-BT) lead-free piezoelectrics", Journal of Alloys and Compounds, 762, 378-388 (2018).
Moller A., George J., Dronskowski R., "First full structural characterization of chloro formamidinium salts", Zeitschrift fur Anorganische und Allgemeine Chemie, 644, 22, 1485-1491 (2018).
Morrow R., McGuire M.A., Yan J.Q., Woodward P.M., "The Crystal Structure and Magnetic Behavior of Quinary Osmate and Ruthenate Double Perovskites LaABB′O6 (A = Ca, Sr; B = Co, Ni; B′ = Ru, Os)", Inorganic Chemistry, 57, 6, 2989-3001 (2018).
Murshed M.M., Zhao P., Huq A., Gesing T.M., "Thermal expansion behaviors of Li3AsW7O25: a case study for comparative Debye temperature for a large polyatomic unit cell", Zeitschrift fur Anorganische und Allgemeine Chemie, 644, 4, 253-259 (2018).
Olds D., Saunders C.N., Peters M., Proffen T., Neuefeind J., Page K., "Precise implications for real‐space pair distribution function modeling of effects intrinsic to modern time‐of‐flight neutron diffractometers", Acta Crystallographica Section A, 74, 4, (2018).
Peterson P.F., Olds D., Savici A.T., Zhou W., "Advances in utilizing event based data structures for neutron scattering experiments", Review of Scientific Instruments, 89, 9, 093001 (2018).
Pokharel G., May A.F., Parker D.S., Calder S., Ehlers G., Huq A., Kimber S.A., Suriya Arachchige H., Poudel L., McGuire M.A., Mandrus D., Christianson A.D., "Negative thermal expansion and magnetoelastic coupling in the breathing pyrochlore lattice material LiGaCr4S", Physical Review B, 97, 134117 (2018).
Ryll B., Schmitz A., de Boor J., Franz A., Whitfield P., Reehuis M., Hoser A., Mueller E., Habicht K., Fritsch K., "Structure, Phase Composition and Thermoelectric Properties of YbxCo4Sb12 and Their Dependence on Synthesis Method", ACS Applied Energy Materials, 1, 1, 113–122 (2018).
Sala G., Maharaj D.D., Stone M.B., Dabkowska H.A., Gaulin B.D., "Crystal field excitations from Yb3+ ions at defective sites in highly stuffed Yb2Ti2 O7", Physical Review B, 97, 224409 (2018).
Sarno C., Yang T., Di Bartolomeo E., Huq A., Huang K., McIntosh S., "Oxygen vacancy localization and anisotropic oxygen anion transport in Sr1−xYxCoO3−δ (x = 0.1, 0.2) under solid oxide fuel cell cathode conditions", Solid State Ionics, 321, 34-42, (2018).
Self E.C., Zou L., Zhang M.J., Opfer R., Ruther R.E., Veith G.M., Song B., Wang C., Wang F., Huq A., Nanda J., "Synthesis, Electrochemical, and Structural Investigations of Oxidatively Stable Li2MoO3 and xLi2MoO3•(1-x)LiMO2 Composite Cathodes", Chemistry of Materials, 30, 15, 5061-5068 (2018).
Shanmugam R., Chen Q., Lai W., "Structural study of Na2/3[Ni1/3Ti2/3]O2 using neutron diffraction and atomistic simulations", Solid State Ionics, 314, 17-24 (2018).
Sharma N., Mbarki M., Zhang Y., Huq A., Fokwa B.T., "Structural‐Distortion‐Driven Magnetic Transformation from Ferro‐ to Ferrimagnetic Iron Chains in B6‐based Nb6FeIr6B8", Angewandte Chemie International Edition, 57, 32, 10323-10327 (2018).
Somaily H.M., "Tuning Structural and Physical Properties via A-Site Doping in Perovskite-Type Transition Metal Oxides", Ph.D. Dissertation, Northern Illinois University (2018).
Somaily H.M., Kolesnik S., Mais J., Brown D.E., Chapagain K., Dabrowski B., Chmaissem O., "Strain-induced tetragonal distortions and multiferroic properties in polycrystalline Sr 1 − x B a x Mn O 3 ( x = 0.43 − 0.45 ) perovskites", Physical Review Materials , 2, 5, 054408 (2018).
Surta T.W., Manjon-Sanz A., Qian E.K., Tran T.T., Dolgos M., "Low Temperature Synthesis Route and Structural Characterization of (Bi0.5A0.5)(Sc0.5Nb0.5)O3 (A = K+ and Na+) Perovskites", Inorganic Chemistry Frontiers, 5, 1033-1044 (2018).
Svensson G., Samain L., Biendicho J.J., Mahmoud A., Hermann R.P., Istomin S., Grins J., "Crystal Structure and Coordination of B-Cations in the Ruddlesden–Popper Phases Sr3−xPrx(Fe1.25Ni0.75)O7−δ (0 ≤ x ≤ 0.4)", Inorganics, 6, 3, 89 (2018).
Tan X., Tener Z.P., Shatruk M., "Correlating Itinerant Magnetism in RCo2Pn2 Pnictides (R = La, Ce, Pr, Nd, Eu, Ca; Pn = P, As) to Their Crystal and Electronic Structures", Accounts of Chemical Research, 51, 2, 230–239 (2018).
Tang J.N., Li J., Subramanian M.A., "Structural investigation and selected properties of Zn2.5−xCoxVMoO8 lyonsites", Journal of Solid State Chemistry, 266, 155-160 (2018).
Tumurugoti P., Sundaram S.K., Misture S.T., "Cesium immobilization in (Ba,Cr)-hollandites: Effects on structure", Journal of Solid State Chemistry, 258, Supplement C, 72-78 (2018).
Wang J., Dolyniuk J.A., Kovnir K., "Unconventional Clathrates with Transition Metal–Phosphorus Frameworks", Accounts of Chemical Research, 5f, 1, 31–39 (2018).
Wang J., He Y., Mordvinova N.E., Lebedev O.I., Kovnir K., "The Smaller the Better: Hosting Trivalent Rare-Earth Guests in Cu–P Clathrate Cages", Chem, 4, 6, 1465-1475 (2018).
Windmueller A., Bridges C.A., Tsai C.L., Lobe S., Dellen C., Veith G.M., Finsterbusch M., Uhlenbruck S., Guillon O., "Impact of Fluorination on Phase Stability, Crystal Chemistry, and Capacity of LiCoMnO4 High Voltage Spinels", ACS Applied Energy Materials, 1, 2, 715–724 (2018).
Zhang F., Tong Y., Jin K., Bei H., Weber W., Huq A., Lanzirotti A., Newville M., Pagan D.C., Ko J.Y., Zhang Y., "Chemical complexity induced local structural distortion in nicofemncr high-entropy alloy", Materials Research Letters, 6, 8, 450-455 (2018).

2017 47 Publications

al-Wahish A.B., al-Binni U., Tetard L., Bridges C.A., Kharel K., Guenaydın-Sen O., Huq A., Musfeldt J.L., Paranthaman M.P., Mandrus D., "Structure and Dynamics Investigations of Sr/Ca-Doped LaPO4 Proton Conductors", Journal of Physical Chemistry C, 121, 22, 11991-12002 (2017).
Aman A., Jordan R., Chen Y., Stadelmann R., Lugovy M., Orlovskaya N., Payzant E.A., dela Cruz C., Reece M.J., Graule T., Kuebler J., "Non-congruence of high-temperature mechanical and structural behaviors of LaCoO3 based perovskites", Journal of the European Ceramic Society, 37, 4, 1563-1576 (2017).
Ball M.R., "First Principles Study of Electronic and Magnetic Structures in Double Perovskites", Ph.D. Dissertation, Ohio State University (2017).
Bansal D., Niedziela J., May A.F., Said A.H., Ehlers G., Abernathy D.L., Huq A., Kirkham M.J., Zhou H.D., Delaire O., "Lattice dynamics and thermal transport in multiferroic CuCrO 2", Physical Review B, 95, 5, 054306 (2017).
Buffon M.L., Laurita G., Lamontagne L., Levin E.E., Mooraj S., Lloyd D.L., White N., Pollock T.M., Seshadri R., "Thermoelectric performance and the role of anti-site disorder in the 24-electron Heusler TiFe2Sn", Journal of Physics: Condensed Matter, 29, 40, 405702 (2017).
Dolyniuk J.A., Whitfield P., Lee K., Lebedev O.I., Kovnir K., "Controlling superstructural ordering in the clathrate-I Ba8M16P30 (M = Cu, Zn) through the formation of metal–metal bonds", Chemical Science, 8, 5, 3650-3659 (2017).
Dolyniuk J.A., Zaikina J.V., Kaseman D.C., Sen S., Kovnir K., "Breaking the Tetra-Coordinated Framework Rule: New Clathrate Ba8M24P28+δ (M=Cu/Zn)", Angewandte Chemie International Edition, 56, 9, 2418-2422 (2017).
Faber J., Kabekkodu S., Blanton J., Blanton T., Fawcett T., "New neutron time-of-flight (TOF) capability in PDF-4+ relational databases: digitized diffraction patterns and I/I c for quantitative phases analysis", Powder Diffraction, 32, 2, 107-111 (2017).
Figueiras F.G., Karpinsky D.V., Tavares P.B., Santos Goncalves J.N., Yanez-Vilar S., Tovar M., Franz A., dos Santos A.M., Moreira J.A., Amaral V.S., "Novel multiferroic state and ME enhancement by breaking the AFM frustration in LuMn1-xO3", Physical Chemistry Chemical Physics, 19, 2, 1335-1341 (2017).
Ge L., Flynn J., Paddison J., Stone M.B., Calder S., Subramanian M.A., Ramirez A.P., Mourigal M., "Spin order and dynamics in the diamond-lattice Heisenberg antiferromagnets CuRh 2 O 4 and CoRh 2 O 4", Physical Review B, 96, 6, 064413 (2017).
Giampaoli G., Li J., Ramirez A.P., Sleight A.W., Subramanian M.A., "Bi2–xCaxIr2O6+y Pyrochlore Phases: Structure and Properties with Varied Ir Oxidation State from 3.9+ to 4.3+", Inorganic Chemistry, 56, 8, 4706–4715 (2017).
Guin M., Dashjav E., Kumar C.M., Tietz F., Guillon O., "Investigation of crystal structure and ionic transport in a scandium-based NASICON material by neutron powder diffraction", Solid State Sciences, 67, 30-36 (2017).
Hester B.R., Hancock J.C., Lapidus S., Wilkinson A.P., "Composition, Response to Pressure and Negative Thermal Expansion in MIIBIVF6; M – Ca, Mg, B – Zr, Nb", Chemistry of Materials, 29, 2, 823-831 (2017).
Hona R.K., Huq A., Mulmi S., Ramezanipour F., "Transformation of Structure, Electrical Conductivity, and Magnetism in AA′Fe2O6−δ, A = Sr, Ca and A′ = Sr", Inorganic Chemistry, 56, 16, 9716–9724 (2017).
Jacobs P., Houben A., Schweika W., Tchougreeff A.L., Dronskowski R., "Instrumental resolution as a function of scattering angle and wavelength as exemplified for the POWGEN instrument", Journal of Applied Crystallography, 50, 3, 866-875 (2017).
John J., "Structural Chemistry of Functional Nano-Materials for Environmental Remediation", Ph.D. Dissertation, State University of New York at Stony Brook (2017).
Kan W.H., Kuppan S., Cheng L., Doeff M., Nanda J., Huq A., Chen G., "Crystal Chemistry and Electrochemistry of LixMn1.5Ni0.5O4 Solid Solution Cathode Materials", Chemistry of Materials, 29, 16, 6818–6828 (2017).
Kaveevivitchai W., Huq A., Manthiram A., "Microwave-assisted chemical insertion: A rapid technique for screening cathodes for Mg-ion batteries", Journal of Materials Chemistry A, 5, 5, 2309-2318 (2017).
Kaveevivitchai W., Huq A., Wang S., Park M.J., Manthiram A., "Rechargeable Aluminum-Ion Batteries Based on an Open-Tunnel Framework", Small, 13, 34, 1701296 (2017).
Kumar D., Chen S.Y., Lee M.K., Kumar C.M., Aldus R., Chang L.J., "Low temperature magnetic properties of frustrated pyrochlore ferromagnet Ho 2 Ir 2 O 7", Journal of Physics: Conference Series, 828, 1, 012008 (2017).
Lin C.C., Tsai Y.T., Johnston H.E., Fang M.H., Yu F., Zhou W., Whitfield P., Li Y., Wang J., Liu R.S., Attfield J.P., "Enhanced Photoluminescence Emission and Thermal Stability from Introduced Cation Disorder in Phosphors", Journal of the American Chemical Society, 139, 34, 11766–11770 (2017).
Liu H., Liu H., Lapidus S., Meng Y.S., Chupas P.J., Chapman K.W., "Sensitivity and Limitations of Structures from X-ray and Neutron-Based Diffraction Analyses of Transition Metal Oxide Lithium-Battery Electrodes", Journal of the Electrochemical Society, 164, 9, A1802-A1811 (2017).
Liu J., Whitfield P., Saccomanno M.R., Bo S.H., Hu E., Yu X., Bai J., Grey C.P., Yang X.Q., Khalifah P.G., "In situ Neutron Diffraction Studies of Ion Exchange Synthesis Mechanism of Li2Mg2P3O9N: Evidence for Hidden Phase Transition", Journal of the American Chemical Society, 139, 27, 9192–9202 (2017).
McAuliffe R.D., Miller C.A., Zhang X., Hulbert B.S., Huq A., dela Cruz C., Schleife A., Shoemaker D.P., "Structural, Electronic, and Optical Properties of K2Sn3O7 with an Offset Hollandite Structure", Inorganic Chemistry, 205, 31-49 (2017).
McGuire M.A., Garlea V.O., KC S., Cooper V.R., Yan J.Q., Cao H.B., Sales B.C., "Antiferromagnetism in the van der Waals layered spin-lozenge semiconductor CrTe 3", Physical Review B, 95, 14, 144421 (2017).
Mohanty D., Mazumder B., Devaraj A., Sefat A.S., Huq A., David L.A., Payzant E.A., Li J., Wood III D.L., Daniel C., "Resolving the Degradation Pathways in High-Voltage Oxides for High-Energy-Density Lithium-Ion Batteries; Alternation in Chemistry, Composition and Crystal structures", Nano Energy, 36, 76–84 (2017).
Mozur E.M., Maughan A.E., Cheng Y.Q., Huq A., Jalarvo N., Daemen L.L., Neilson J.R., "Orientational Glass Formation in Substituted Hybrid Perovskites", Chemistry of Materials, 29, 23, 10168–10177 (2017).
Pierce E.M., Lilova K.I., Missimer D.M., Lukens W.W., Wu L., Fitts J.P., Rawn C.J., Huq A., Leonard D.N., Eskelsen J.R., Woodfield B.F., Jantzen C.M., Navrotsky A., "Structure and Thermochemistry of Perrhenate Sodalite and Mixed Guest Perrhenate/Pertechnetate Sodalite", Environmental Science & Technology, 51, 2, 997-1006 (2017).
Rickert K., Harris J., Sedefoglu N., Kavak H., Ellis D.E., Poeppelmeier K.R., "Site Identity and Importance in Cosubstituted Bixbyite In2O3", Crystals, 7, 2, 47 (2017).
Sheckelton J.P., Plumb K.W., Trump B.A., Broholm C., McQueen T.M., "Rearrangement of van der Waals stacking and formation of a singlet state at T = 90 K in a cluster magnet", Inorganic Chemistry Frontiers, 4, 3, 481-490 (2017).
Skiadopoulou S., "Spin and Lattice Excitations in Multiferroics", Ph.D. Dissertation, Academy of Sciences of the Czech Republic (2017).
Somaily H.M., Kolesnik S., Dabrowski B., Chmaissem O., "Thermoelectric and structural correlations in (Sr1−x−yCaxNdy) TiO3 perovskites", Physical Review B, 96, 064105 (2017).
Spanjers C.S., Dasgupta A., Kirkham M.J., Burger B.A., Kumar G., Janik M.J., Rioux R.M., "Determination of Bulk and Surface Atomic Arrangement in Ni-Zn Gamma Brass Phase at Different Ni to Zn Ratios", Chemistry of Materials, 29, 2, 504-512 (2017).
Su X., Bromberg L., Martis V., Simeon F., Huq A., Hatton T.A., "Postsynthetic Functionalization of Mg-MOF-74 with Tetraethylenepentamine: Structural Characterization and Enhanced CO2 Adsorption", ACS Applied Materials & Interfaces, 9, 12, 11299-11306 (2017).
Sun X., Tripathi R., Popov G., Balasubramanian M., Nazar L.F., "Stabilization of Lithium Transition Metal Silicates in the Olivine Structure", Inorganic Chemistry, 56, 16, 9931–9937 (2017).
Surta T.W., Manjon-Sanz A., Qian E.K., Mansergh R.H., Tran T.T., Fullmer L.B., Dolgos M., "Dielectric and Ferroelectric Properties in Highly Substituted Bi2Sr(A)TiNb2O12 (A = Ca2+, Sr2+, Ba2+) Aurivillius Phases", Chemistry of Materials, 29, 18, 7774–7784 (2017).
Taddei K.M., Allred J.M., Bugaris D.E., Lapidus S., Krogstad M.J., Claus H., Chung D.Y., Kanatzidis M.G., Osborn R., Rosenkranz S., Chmaissem O., "Observation of the magnetic C 4 phase in Ca 1 − x Na x Fe 2 As 2 and its universality in the hole-doped 122 superconductors", Physical Review B, 95, 6, 064508 (2017).
Taylor A.E., Calder S., Morrow R., Feng H.L., Upton M.H., Lumsden M.D., Yamaura K., Woodward P.M., Christianson A.D., "Spin-Orbit Coupling Controlled J = 3 / 2 Electronic Ground State in 5 d 3 Oxides", Physical Review Letters, 118, 20, 207202 (2017).
Tchougreeff A.L., Stoffel R.P., Houben A., Jacobs P., Dronskowski R., Pregelj M., Zorko A., Arcon D., Zaharko O., "Atomic motions in the layered copper pseudochalcogenide CuNCN indicative of a quantum spin-liquid scenario", Journal of Physics: Condensed Matter, 29, 23, 235701 (2017).
Wang D., Kou R., Ren Y., Sun C.J., Zhang M.J., Li Y., Huq A., Ko J.Y., Pan F., Sun Y., Yang Y., Amine K., Bai J., Chen Z., Chen Z., Wang F., "Synthetic Control of Kinetic Reaction Pathway and Cationic Ordering in High-Ni Layered Oxide Cathodes", Advanced Materials, 29, 39, 1606715 (2017).
Wang J., Yang T., Lei L., Huang K., "Ta-Doped SrCoO3-δ as a Promising Bifunctional Oxygen Electrode for Reversible Solid Oxide Fuel Cells: A Focused Study on Stability", Journal of Materials Chemistry A, 5, 19, 8989-9002 (2017).
Xu X., Zhang X., Yin Y., Balasubramanian B., Das B., Liu Y., Huq A., Sellmyer D.J., "Anti-site mixing and magnetic properties of Fe3Co3Nb2 studied via neutron powder diffraction", Journal of Physics D: Applied Physics, 50, 2, 025002 (2017).
Zhang F.X., Zhao S., Jin K., Bei H., Popov D., Park C., Neuefeind J., Weber W., Zhang Y., "Pressure-induced fcc to hcp phase transition in Ni-based high entropy solid solution alloys", Applied Physics Letters, 110, 1, 011902 (2017).
Zhao J., Zhang W., Huq A., Misture S.T., Zhang B., Guo S., Wu L., Zhu Y., Chen Z., Amine K., Pan F., Bai J., Wang F., "In Situ Probing and Synthetic Control of Cationic Ordering in Ni-Rich Layered Oxide Cathodes", Advanced Energy Materials, 7, 3, 1601266 (2017).
zur Loye H.C., Chance W.M., Morrison G., "Synthesis and crystal structure of iron zeolitic frameworks", (2017).

2016 68 Publications

Abreu Sepulveda M., Williams D.E., Huq A., Dhital C., Li Y., Paranthaman M.P., Zaghib K., Manivannan A., "Synthesis and characterization of substituted garnet and perovskite-based lithium-ion conducting solid electrolytes", Ionics, 22, 3, 317–325 (2016).
Abreu-Sepulveda M.A., "Investigation of Electrode Materials Based on Perovskite and Pyrochlore Structures for the Oxygen Evolution Reaction", Ph.D. Dissertation, University of Rochester (2016).
Abreu-Sepulveda M.A., Dhital C., Huq A., Li L., Bridges C.A., Paranthaman M.P., Narayanan S.R., Quesnel D.J., Tryk D.A., Manivannan A., "The Influence of Fe Substitution in Lanthanum Calcium Cobalt Oxide on the Oxygen Evolution Reaction in Alkaline Media", Journal of the Electrochemical Society, 163, 9, F1124-F1132 (2016).
al-Wahish A.B., al-Binni U., Bridges C.A., Tang S., Bi Z., Paranthaman M.P., Huq A., Mandrus D., "In Situ X-ray and Neutron Diffraction of the Rare-Earth Phosphate Proton Conductors Sr/Ca-Doped LaPO4 at Elevated Temperatures", Chemistry of Materials, 28, 20, 7232–7240 (2016).
Allen J.L., Allen J.L., Thompson T., Delp S.A., Wolfenstine J., Jow T.R., "Cr and Si Substituted-LiCo0.9Fe0.1PO4: Structure, full and half Li-ion cell performance", Journal of Power Sources, 327, 229-234 (2016).
Allred J.M., Taddei K.M., Bugaris D.E., Krogstad M.J., Lapidus S., Chung D.Y., Claus H., Kanatzidis M.G., Brown D.E., Kang J.Y., Fernandes R.M., Eremin I., Rosenkranz S., Chmaissem O., Osborn R., "Double-Q spin-density wave in iron arsenide superconductors", Nature Physics, 12, 493–498 (2016).
Balasubramanian B., Das B., Nguyen M.C., Xu X., Zhang J., Zhang X., Liu Y., Huq A., Valloppilly S.R., Jin Y., Wang C.Z., Ho K.M., Sellmyer D.J., "Structure and magnetism of new rare-earth-free intermetallic compounds: Fe3+xCo3−xTi2 (0 ≤ x ≤ 3)", APL Materials, 4, 11, 116109 (2016).
Banerjee A., Bridges C.A., Yan J.Q., Aczel A.A., Li L., Stone M.B., Granroth G.E., Lumsden M.D., Yiu Y., Knolle J., Bhattacharjee S., Kovrizhin D.L., Moessner R., Tennant D.A., Mandrus D., Nagler S.E., "Proximate Kitaev quantum spin liquid behaviour in a honeycomb magnet", Nature Materials, 15, 733–740 (2016).
Black D.R., Mendenhall M.H., Windover D., Henins A., Filliben J., Cline J.P., "Certification of standard reference material 1878b respirable α-quartz", Powder Diffraction, 31, 3, 211-215 (2016).
Bozin E.S., Huq A., Shen B., Claus H., Kwok W.K., Tranquada J.M., "Charge-screening role of c-axis atomic displacements in YBa2Cu3O6+x and related superconductors", Physical Review B, 93, 054523 (2016).
Bridges C.A., Rios O., Allard L.F., Meyer H., Huq A., Jiang Y., Wang J.P., Brady M.P., "The impact of carbon coating on the synthesis and properties of a’’-Fe16N2 powders ", Physical Chemistry Chemical Physics, 18, 13010-13017 (2016).
Buffon M.L., Laurita G., Verma N., Lamontagne L., Ghadbeigi L., Lloyd D.L., Sparks T.D., Pollock T.M., Seshadri R., "Enhancement of thermoelectric properties in the Nb–Co–Sn half-Heusler/Heusler system through spontaneous inclusion of a coherent second phase", Journal of Applied Physics, 120, 7, 075104 (2016).
Chatterjee S., Conroy M., Smith F., Jung H.J., Wang Z., Peterson R.A., Huq A., Burtt D.G., Ilton E.S., Buck E.C., " Can Cr(III) substitute for Al(III) in the structure of Boehmite?", RSC Advances, 6, 107628-107637 (2016).
Cizmar E., Risset O.N., Wang T., Botko M., Ahir A.R., Andrus M.J., Park J.H., Abboud K.A., Talham D.R., Meisel M.W., Brown S.E., "Antiferromagnetic ordering in MnF(salen)", Journal of Physics: Condensed Matter, 28, 23, 236003 (2016).
Duan B., Yang J., Salvador J.R., He Y., Zhao B., Wang S., Wei P., Ohuchi F.S., Zhang W., Hermann R.P., Gourdon O.A., Mao S.X., Cheng Y., Wang C., Liu J., Zhai P., Tang X., Zhang Q., Yang J., "Electronegative Guests in CoSb3", Energy & Environmental Science, 9, 6, 2090-2098 (2016).
Fabini D.H., Laurita G., Bechtel J.S., Stoumpos C.C., Evans H.A., Kontos A.G., Raptis Y.S., Falaras P., Van der Ven A., Kanatzidis M.G., Seshadri R., "Dynamic Stereochemical Activity of the Sn2+ Lone Pair in Perovskite CsSnBr3", Journal of the American Chemical Society, 138, 36, 11820-11832 (2016).
Flynn J., Li J., Sleight A.W., Ramirez A.P., Subramanian M.A., "Structure and Properties of Ir-Containing Oxides with Large Spin–Orbit Coupling: Ba2In2–xIrxO5+δ", Inorganic Chemistry, 55, 6, 2748–2754 (2016).
Gorne A.L., George J., van Leusen J., Duck G., Jacobs P., Chogondahalli Muniraju N.K., Dronskowski R., "Ammonothermal Synthesis, Crystal Structure, and Properties of the Ytterbium(II) and Ytterbium(III) Amides and the First Two Rare-Earth-Metal Guanidinates, YbC(NH)3 and Yb(CN3H4)3", Inorganic Chemistry, 55, 12, 6161–6168 (2016).
He G., Huq A., Kan W.H., Manthiram A., "β-NaVOPO4 Obtained by a Low-temperature Synthesis Process: A New 3.3 V Cathode for Sodium-ion Batteries", Chemistry of Materials, 28, 5, 1503-1512 (2016).
Hermus M., Mansouri Tehrani A., Brgoch J., "Determining a Structural Distortion and Anion Ordering in La2Si4N6C via Computation and Experiment", Inorganic Chemistry, 55, 18, 9454–9460 (2016).
Hood Z.D., Kates C., Kirkham M.J., Adhikari S., Liang C., Holzwarth N.A., "Structural and electrolyte properties of Li4P2S6", Solid State Ionics, 284, 61–70 (2016).
Kan W.H., Huq A., Manthiram A., "Exploration of a Metastable Normal Spinel Phase Diagram for the Quaternary Li-Ni-Mn-Co-O System", Chemistry of Materials, 28, 6, 1832–1837 (2016).
Kan W.H., Lai K.Y., Huq A., Manthiram A., "Unravelling the low thermal expansion coefficient of cation-substituted YBaCo4O7+d", Journal of Power Sources, 307, 454-461 (2016).
Kelly Z.A., Gallagher M.J., McQueen T.M., "Electron Doping a Kagome Spin Liquid", Physical Review X, 6, 041007 (2016).
Kobayashi G., Hinuma Y., Matsuoka S., Watanabe A., Iqbal M., Hirayama M., Yonemura M., Kamiyama T., Tanaka I., Kanno R., "Pure H– conduction in oxyhydrides", Science, 351, 6279, 1314-1317 (2016).
Latshaw A.M., Chance W.M., Morrison G., zur Loye K.D., Wilkins B.O., Smith M.D., Whitfield P., Kirkham M.J., Stoian S.A., zur Loye H.C., "Synthesis of a Ferrolite: A Zeolitic All-Iron Framework", Angewandte Chemie International Edition, 55, 42, 13195–13199 (2016).
Li M.R., Hodges J.P., Retuerto M., Deng Z., Stephens P.W., Croft M., Deng X., Kotliar G., Sanchez-Benitez J., Walker D., Greenblatt M., "Mn2MnReO6: Synthesis and Magnetic Structure Determination of a New Transition-metal-only Double Perovskite Canted Antiferromagnet", Chemistry of Materials, 28, 9, 3148–3158 (2016).
Liu J., Huq A., Moorhead-Rosenberg Z., Manthiram A., Page K., "Nanoscale Ni/Mn Ordering in the High Voltage Spinel Cathode LiNi0.5Mn1.5O4", Chemistry of Materials, 28, 19, 6817–6821 (2016).
Lussier J.A., Devitt G., Szkop K.M., Bieringer M., "Oxygen Trapping and Cation Site-Splitting in Y(2-x)PrxO3+δ (0.0≤x&lt;2.0 and δ≤1.0)", Journal of Solid State Chemistry, 242, 126-132 (2016).
Lussier J.A., Szkop K.M., Sharma A.Z., Wiebe C.R., Bieringer M., "Order/Disorder and in Situ Oxide Defect Control in the Bixbyite Phase YPrO3+δ (0 ≤ δ < 0.5)", Inorganic Chemistry, 55, 5, 2381-2389 (2016).
Maughan A.E., Ganose A.M., Bordelon M.M., Miller E.M., Scanlon D.O., Neilson J.R., "Defect Tolerance to Intolerance in the Vacancy-Ordered Double Perovskite Semiconductors Cs2SnI6 and Cs2TeI6", Journal of the American Chemical Society, 138, 27, 8453-8464 (2016).
Miskowiec A., Anderson B., Huq A., Mamontov E., Herwig K.W., Trowbridge L., Rondinone A.J., "Time-dependent water dynamics in hydrated uranyl fluoride", Molecular Physics, 114, 1, 61-71 (2016).
Morrow R., Soliz J.R., Hauser A.J., Gallagher J.C., Susner M.A., Sumption M.D., Aczel A.A., Yan J.Q., Yang F., Woodward P.M., "The effect of chemical pressure on the structure and properties of A2CrOsO6 (A=Sr, ca) ferrimagnetic double perovskite", Journal of Solid State Chemistry, 238, 46-52 (2016).
Morrow R., Taylor A.E., Singh D.J., Xiong J., Rodan S., Wolter A.U., Wurmehl S., Buchner B., Stone M.B., Kolesnikov A.I., Aczel A.A., Christianson A.D., Woodward P.M., "Spin-orbit coupling control of anisotropy, ground state and frustration in 5d2 Sr2MgOsO6", Scientific Reports, 6, 32462 (2016).
Murshed M.M., Zhao P., Fischer M., Huq A., Alekseev E.V., Gesing T.M., "Thermal expansion modeling of framework-type Na[AsW2O9] and K[AsW2O9]", Materials Research Bulletin, 84, 273-282, 273-282 (2016).
Rau J.G., Wu L.S., May A.F., Poudel L., Winn B., Garlea V.O., Huq A., Whitfield P., Taylor A.E., Lumsden M.D., Gingras M., Christianson A.D., "Anisotropic Exchange within Decoupled Tetrahedra in the Quantum Breathing Pyrochlore Ba3Yb2Zn5O11", Physical Review Letters, 116, 257204 (2016).
Redhammer G.J., Rettenwander D., Pristat S., Dashjav E., Kumar C.M., Topa D., Tietz F., "A single crystal X-ray and powder neutron diffraction study on NASICON-type Li1+xAlxTi2−x(PO4)3 (0 < x < 0.5) crystals: Implications on ionic conductivity", Solid State Sciences, 60, 99-107 (2016).
Retuerto M., Skiadopoulou S., Li M.R., Abakumov A.M., Croft M., Ignatov A., Sarkar T., Abbett B.M., Pokorny J., Savinov M., Nuzhnyy D., Prokleska J., Abeykoon M., Stephens P.W., Hodges J.P., Vanek P., Fennie C.J., Rabe K.M., Kamba S., Greenblatt M., "Pb2MnTeO6 Double Perovskite: An Antipolar Anti-ferromagnet", Inorganic Chemistry, 55 , 4320–4329, 9 (2016).
Rickert K., Boullay P., Malo S., Caignaert V., Poeppelmeier K.R., "A Rutile Chevron Modulation in Delafossite-Like Ga3–xIn3TixO9+x/2", Inorganic Chemistry, 55, 9, 4403–4409 (2016).
Santodonato L., "Temperature-Dependent Structures and Atomic Mixing Behaviors in High-Entropy Alloys", Ph.D. Dissertation, University of Tennessee (2016).
Sesselmann A., Klobes B., Dasgupta T.S., Gourdon O.A., Hermann R.P., Mueller E., "Neutron diffraction and thermoelectric properties of indium filled InxCo4Sb12 (x = 0.05, 0.2) and indium cerium filled Ce0.05In0.1Co4Sb12 skutterudites", Physica Status Solidi A, 213, 3, 766–773 (2016).
Sharits A.R., "Structure-Property Relationships in Noncentrosymmetric Layered Perovskites", Ph.D. Dissertation, Ohio State University (2016).
Sharits A.R., Khoury J.F., Woodward P.M., "Evaluating NaREMgWO6 (RE = La, Gd, Y) Doubly Ordered Double Perovskites as Eu3+ Phosphor Hosts", Inorganic Chemistry, 55, 23, 12383–12390 (2016).
Sterri K.B., Deringer V.L., Houben A., Jacobs P., Chogondahalli Muniraju N.K., Dronskowski R., "Neutron powder diffraction and theory-aided structure refinement of rubidium and cesium ureate", Zeitschrift fur Naturforschung B, 71, 5, 431–438 (2016).
Taddei K.M., Allred J.M., Bugaris D.E., Lapidus S., Krogstad M.J., Stadel R., Claus H., Chung D.Y., Kanatzidis M.G., Rosenkranz S., Osborn R., Chmaissem O., "Detailed magnetic and structural analysis mapping a robust magnetic C4 dome in Sr1−xNaxFe2As2", Physical Review B, 93, 134510 (2016).
Talaie-Pashiri E., "Manganese and Iron-Based Layered Oxide Positive Electrodes for Sodium-Ion Batteries", Ph.D. Dissertation, University of Waterloo (2016).
Tamimi M.A., "Ionic Conductivity and its Role in Oxidation Reactions", Ph.D. Dissertation, Lehigh University (2016).
Taylor D.D., Schreiber N.J., Levitas B.D., Xu W., Whitfield P., Rodriguez E.E., "Oxygen storage properties of La1-xSrxFeO3-δ for chemical-looping reactions – an in-situ neutron and synchrotron X-ray study", Chemistry of Materials, 28, 11, 3951–3960 (2016).
Tedesco J.C., Pedro S.S., Caraballo Vivas R.J., Cruz C., Andrade V.M., dos Santos A.M., Carvalho A.M., Costa M., Venezuela P., Rocco D.L., Reis M.S., "Chemical disorder determines the deviation of the Slater–Pauling rule for Fe2MnSi-based Heusler alloys: evidences from neutron diffraction and density functional theory", Journal of Physics: Condensed Matter, 28, 47, 476002 (2016).
Tomkiewicz A., Tamimi M.A., Huq A., McIntosh S., "Structural analysis of PrBaMn2O5+δ under SOFC anode conditions by in-situ neutron powder diffraction", Journal of Power Sources, 330, 240-245 (2016).
Trease N.M., Seymour I.D., Radin M., Liu H., Hy S., Liu H., Chernova N.A., Parikh P., Devaraj A., Wiaderek K.M., Chupas P.J., Chapman K.W., Whittingham M.S., Meng Y.S., Van der Ven A., Grey C.P., "Identifying the distribution of Al3+ in LiNi0.8Co0.15Al0.05O2", Chemistry of Materials, 28, 22, 8170–8180 (2016).
Valle Rios L.E., "Structural trends in off-stoichiometric kesterite type compound Cu2ZnSnSe4 semiconductor", Ph.D. Dissertation, Freie Universitat Berlin (2016).
Wang A., Graf D., Wu L., Wang K., Bozin E.S., Zhu Y., Petrovic C., "Interlayer electronic transport in CaMnBi2 antiferromagnet", Physical Review B, 94, 12, 125118 (2016).
Wang C.L., Crow L., Funk L.L., Hannan B.W., Hodges J.P., Riedel R.A., "Optimizing ZnS/6LiF scintillators for wavelength-shifting-fiber neutron detectors", 2015 IEEE Nuclear Science Symposium and Medical Imaging Conference (NSS/MIC), (2016).
Wang H., Kirkham M.J., Watkins T.R., Payzant E.A., Salvador J.R., Thompson A.J., Sharp J.W., Brown D., Miller D., "Neutron and x-ray powder diffraction study of skutterudite thermoelectrics", Powder Diffraction, 31, 1, 16-22 (2016).
Whitfield P., Coelho A.A., "Asymmetric band flipping for time-of-flight neutron diffraction data", Journal of Applied Crystallography, 49, 1806-1809 (2016).
Whitfield P., Herron N., Guise W.E., Page K., Cheng Y.Q., Milas I., Crawford M.K., "Structures, Phase Transitions and Tricritical Behavior of the Hybrid Perovskite Methyl Ammonium Lead Iodide", Scientific Reports, 6, 35685 (2016).
Woerner W.R., Qian G.R., Oganov A.R., Stephens P.W., Dharmagunawardhane H.A., Sinclair A., Parise J.B., "Combined Theoretical and in Situ Scattering Strategies for Optimized Discovery and Recovery of High-Pressure Phases: A Case Study of the GaN–Nb2O5 System", Inorganic Chemistry, 55, 7, 3384-3392 (2016).
Yang H., Chen Y., Bei H., dela Cruz C., Wang Y.D., An K., "Annealing effects on the structural and magnetic properties of off-stoichiometric Fe-Mn-Ga ferromagnetic shape memory alloys", Materials & Design, 104, 327–332 (2016).
Zhang Q., Kumar C.M., Tian W., Dennis K.W., Goldman A.I., Vaknin D., "Structure and magnetic properties of LnMnSbO (Ln=La and Ce)", Physical Review B, 93, 094413 (2016).
Zhou S., Barim G., Morgan B.J., Melot B.C., Brutchey R.L., "Influence of Rotational Distortions on Li+- and Na+-Intercalation in Anti-NASICON Fe2(MoO4)3", Chemistry of Materials, 28, 12, 4492–4500 (2016).

2015 66 Publications

Abughayada C., "Air separation and oxygen storage properties of hexagonal rare-earth manganites", Ph.D. Dissertation, Northern Illinois University (2015).
Abughayada C., Dabrowski B., Kolesnik S., Brown D.E., Chmaissem O., "Characterization of oxygen storage and structural properties of oxygen-loaded hexagonal RMnO3+sigma (R = Ho, Er, and Y)", Chemistry of Materials, 27, 18, 6259–6267 (2015).
Bernardo P.L., Ghivelder L., Amorim H.S., Neumeier J.J., Garcia S., "Magnetic structure driven by monoclinic distortions in the double perovskite Sr2YRuO6", New Journal of Physics, 17, 10, 103007 (2015).
Boltersdorf J., Maggard P.A., "Structural and electronic investigations of PbTa4O11 and BiTa7O19 Constructed from a-U3O8 Types of Layers", Journal of Solid State Chemistry, 229, 310-321 (2015).
Chatterji T., Kumar C.M., Wdowik U.D., "Anomalous temperature-induced volume contraction in GeTe", Physical Review B, 91, 5, 054110 (2015).
Chen Y., Cai L., Liu Z., dela Cruz C., Liang C., An K., "Correlation of anisotropy and directional conduction in b-Li3PS4 fast Li+ conductor", Applied Physics Letters, 107, 1, 013904 (2015).
Chen Y., Orlovskaya N., Payzant E.A., Graule T., Kuebler J., "A search for temperature induced time-dependent structural transitions in 10 mol%Sc2O3-1 mol%CeO2-ZrO2 and 8 mol%Y2O3-ZrO2 electrolyte ceramics", Journal of the European Ceramic Society, 35, 3, 951-958 (2015).
Colabello D.M., "Understanding Direct Metal-Metal Bonding in Rare Earth Molybdates", Ph.D. Dissertation, State University of New York at Stony Brook (2015).
Colabello D.M., Camino F.E., Huq A., Hybertsen M., Khalifah P.G., "Charge disproportionation in tretragonal La2MoO5, a small band gap semiconductor influenced by direct Mo-Mo bonding", Journal of the American Chemical Society, 37, 3, 1245-1257 (2015).
Duffort V., Talaie E., Black R., Nazar L.F., "Uptake of Co2 in Layered P2-Na0.67mn0.5fe0.5o2: Insertion of Carbonate Anions", Chemistry of Materials, 27, 7, 2515-2524 (2015).
Eckert J., Gourdon O.A., Jacob D.E., Meral C., Monteiro P.J., Vogel S.C., Wirth R., Wenk H.R., "Ordering of water in opals with different microstructures", European Journal of Mineralogy, 27, 203-213, 2 (2015).
Everett S.M., Rawn C.J., Chakoumakos B.C., Keffer D.J., Huq A., Phelps T.J., "Insights into the structure of mixed CO2/CH4 in gas hydrates", American Mineralogist, 100, 1203-1208 (2015).
Fowler D.E., "Study of Chromite Perovskite Oxides as Solid Oxide Fuel Cell Anodes", Ph.D. Dissertation, Northwestern University (2015).
Hancock J.C., Chapman K.W., Halder G.J., Morelock C.R., Kaplan B.S., Gallington L.C., Bongiorno A., Han C., Zhou S., Wilkinson A.P., "Large negative thermal expansion and anomalous behavior on compression in cubic ReO3-type AIIBIVF6: CaZrF6 and CaHfF6", Chemistry of Materials, 27, 11, 3912–3918 (2015).
Harris C., "Structure, redox and transport properties of acceptor doped cerium niobates", Ph.D. Dissertation, Imperial College-London (2015).
He G., Bridges C.A., Manthiram A., "Crystal Chemistry of Electrochemically and Chemically Lithiated Layered #I-LiVOPO4", Chemistry of Materials, 27, 19, 6699–6707 (2015).
He Q., "Enhanced redox stability of titanium doped molybdenum dioxide", Ph.D. Dissertation, Washington State University (2015).
Jacobs P., Houben A., Schweika W., Tchougréeff A.L., Dronskowski R., "A Rietveld refinement method for angular- and wavelength-dispersive neutron time-of-flight powder diffraction data", Journal of Applied Crystallography, 48, 6, 1627-1636 (2015).
Kan W.H., Huq A., Manthiram A., "Low-temperature Synthesis, Structural Characterization, and Electrochemistry of Ni-rich Spinel-like LiNi2-yMnyO4 (0.4 ≤ y ≤ 1)", Chemistry of Materials, 27, 22, 7729–7733 (2015).
Kan W.H., Huq A., Manthiram A., "The first Fe-based Na+-ion cathode with two distinct types of polyanions: Fe3P5SiO19", Chemical Communications, 51, 52, 10447-10450 (2015).
Kathriarachchi V.W., "Effect of processing temperature on the properties of nanophase Fe-substituted Hydroxyapatite", Ph.D. Dissertation, Florida Atlantic University (2015).
Kottenhahn M., Jennings E., "ICDD Annual Spring Meetings", Powder Diffraction, 30, 3, 303-317 (2015).
Kumar C.M., Xiao Y., Lunkenheimer P., Loidl A., Ohl M., "Crystal structure, incommensurate magnetic order, and ferroelectricity in Mn1-x Cux WO4", Physical Review B, 91, 23, 235149 (2015).
Kundu D., Tripathi R., Popov G., Makahnouk W.R., Nazar L.F., "Synthesis, Structure, and Na-Ion Migration in Na4NiP2O7F2: A Prospective High Voltage Positive Electrode Material for the Na-Ion Battery", Chemistry of Materials, 27, 3, 885-891 (2015).
Laurita G., Page K., Suzuki S., Seshadri R., "Average and local structure of the Pb-free ferroelectric perovskites (Sr,Sn)TiO3 and (Ba,Ca,Sn)TiO3", Physical Review B, 92, 21, 214109 (2015).
Liang C., Rangasamy E., Dudney N.J., Keum J.K., Rondinone A.J., "High Conducting Oxide-Sulfide Composite Lithium Superionic Conductor", (2015).
Liu J., "Nitrogen-containing CUBICON ceramics and their applications for rechargeable batteries", Ph.D. Dissertation, State University of New York at Stony Brook (2015).
Ma J., Bo S.H., Wu L., Zhu Y., Grey C.P., Khalifah P.G., "Ordered and Disordered Polymorphs of Na(Ni2/3sb1/3) O2: Honeycomb-Ordered Cathodes for Na-Ion Betteries", Chemistry of Materials, 27, 7, 2387-2399 (2015).
Maughan A.E., Kurzman J.A., Neilson J.R., "Hybrid inorganic-organic materials with an optoelectronically active aromatic cation: (C7H7)2SnI6 and C7H7PbI3", Inorganic Chemistry, 54, 1, 370-378 (2015).
McLeod M.V., Giri A.K., Paterson B.A., Dennis C., Zhou L., Vogel S.C., Gourdon O.A., Reiche H.M., Cho K.C., Sohn Y.H., Shull R.D., Majumdar B.S., "Magnetocaloric response of non-stoichiometric Ni2MnGa alloys and the influence of crystallographic texture", Acta Materialia, 97, 245-256 (2015).
Miskowiec A., Kirkegaard M.C., Huq A., Mamontov E., Herwig K.W., Trowbridge L., Rondinone A.J., Anderson B., "Structural Phase Transitions and Water Dynamics in Uranyl Fluoride Hydrates", Journal of Physical Chemistry A, 119, 49, 11900-11910 (2015).
Montasserasadi D., "New Dion-Jacobson and Ruddlesden-Popper Layered Perovskites Prepared by Topochemical Methods", Ph.D. Dissertation, University of New Orleans (2015).
Moorhead-Rosenberg Z., "Magnetic, Electronic, and Electrochemical Properties of High-Voltage Spinel Cathodes for Lithium-Ion Batteries", Ph.D. Dissertation, University of Texas at Austin (2015).
Moorhead-Rosenberg Z., Huq A., Goodenough J.B., Manthiram A., "Electronic and electrochemical properties of Li1-xMn1.5Ni0.5O4 spinel cathodes as a function of lithium content and cation ordering", Chemistry of Materials, 27, 20, 6934–6945 (2015).
Morrow R., "Competing Superexchange Interactions in Double Perovskite Osmates", Ph.D. Dissertation, Ohio State University (2015).
Morrow R., Susner M.A., Sumption M.D., Woodward P.M., "Magnetic structure of the quasi-one-dimensional La3OsO7 as determined by neutron powder diffraction", Physical Review B, 92, 13, 134402 (2015).
Morrow R., Yan J.Q., McGuire M.A., Freeland J.W., Haskel D., Woodward P.M., "Effects of chemical pressure on the magnetic ground states of the osmate double perovskites SrCaCoOsO6 and Ca2CoOsO6", Physical Review B, 92, 094435 (2015).
Mukhopadhyay S., Thompson T., Sakamoto J., Huq A., Wolfenstine J., Allen J.L., Bernstein N., Stewart D.A., Johannes M.D., "Structure and stoichiometry in supervalent doped Li7La3Zr2O12", Chemistry of Materials, 27, 10, 3658-3665 (2015).
Nhalil H., Nair H.S., Kumar C.M., Strydom A.M., Elizabeth S., "Ferromagnetism and the effect of free charge carriers on electric polarization in the double perovskite Y2NiMnO6", Physical Review B, 92, 21, 214426 (2015).
Peterson P.F., Campbell S.I., Reuter M.A., Taylor R.D., Zikovsky J., "Event-based processing of neutron scattering data", Nuclear Instruments and Methods in Physics Research Section A, 803, 24-28 (2015).
Phraewphiphat T., Iqbal M., Suzuki K., Matsuda Y., Yonemura M., Hirayama M., Kanno R., "Syntheses, structures, and Ionic conductivities of perovskite-structured lithium-strontium aluminum/gallium-tantalum-oxides", Journal of Solid State Chemistry, 225, 431-437 (2015).
Rickert K., Huq A., Lapidus S., Wustrow A., Ellis D.E., Poeppelmeier K.R., "Site Dependency of the High Conductivity in Ga2In6Sn2O16: the Role of the 7-Coordinate Site", Chemistry of Materials, 27, 23, 8084–8093 (2015).
Rickert K., Sedefoglu N., Malo S., Caignaert V., Kavak H., Poeppelmeier K.R., "Structural, Electrical, and Optical Properties of the Tetragonal, Fluorite-Related Zn0.456In1.084Ge0.460O3", Chemistry of Materials, 27, 14, 5072–5079 (2015).
Ross K.A., Bordelon M.M., Terho G., Neilson J.R., "Nanosized helical magnetic domains in strongly frustrated Fe3PO4O3", Physical Review B, 92, 134419 (2015).
Ruther R.E., Zhou H., Dhital C., Saravanan K., Kercher A.K., Chen G., Huq A., Delnick F.M., Nanda J., "Synthesis, Structure, and Electrochemical Performance of High Capacity Li2Cu0.5Ni0.5O2 Cathodes", Chemistry of Materials, 27, 19, 6746-6754 (2015).
Santodonato L., Zhang Y., Feygenson M., Parish C.M., Gao M.C., Weber R.J., Neuefeind J., Tang Z., Liaw P.K., "Deviation from high-entropy configurations in the atomic distributions of a multi-principal-element alloy", Nature Communications, 6, 5964 (2015).
Seymour K.C., "Thermal expansion and phase transformation behavior in the rare-earth titanate system", Ph.D. Dissertation, University of Illinois at Urbana-Champaign (2015).
Shanmugam R., "Synthesis and characterizaton of inorganic materials for sodium-ion batteries", Ph.D. Dissertation, Michigan State University (2015).
Silverstein H., "The Dugganites: A New Potentially Multiferroic Te6+-containing Subclass of the Langasites", Ph.D. Dissertation, University of Manitoba (2015).
Silverstein H., Huq A., Lee M., Choi E.S., Zhou H.D., Wiebe C.R., "Nuclear and magnetic Supercells in the multiferroic candidate: Pb3TeMn3P2O14", Journal of Solid State Chemistry, 221, 216-223 (2015).
Sturza M., Allred J.M., Malliakas C.D., Bugaris D.E., Han F., Chung D.Y., Kanatzidis M.G., "Tuning the magnetic properties of new layered iron chalcogenides (BaF)2Fe2-xQ3 (Q=S, Se) by changing the defect concentration on the iron sublattice", Chemistry of Materials, 27, 10, 3280-3290 (2015).
Taddei K.M., Sturza M., Chung D.Y., Cao H.B., Claus H., Kanatzidis M.G., Osborn R., Rosenkranz S., Chmaissem O., "Cesium vacancy ordering in phase-separated CsxFe2-ySe2", Physical Review B, 92, 9, 094505 (2015).
Talaie E., Duffort V., Smith H.L., Fultz B., Nazar L.F., "Structure of the High Voltage Phase of Layered P2-Na2/3-x[Mn1/2Fe1/2]O2 and the Positive Effect of Ni Substitution on its Stability", Energy & Environmental Science, 8, 8, 2512-2523 (2015).
Taylor A.E., Morrow R., Singh D.J., Calder S., Lumsden M.D., Woodward P.M., Christianson A.D., "Magnetic Order and Electronic Structure of 5d3 Double Perovskite Sr2ScOsO6", Physical Review B, 91, 10, 100406 (2015).
Thompson T., Sharafi A., Johannes M.D., Huq A., Allen J.L., Wolfenstine J., Sakamoto J., "A Tale of Two Sites: On Defining the Carrier Concentration in Garnet-Based Ionic Conductors for Advanced Li Batteries", Advanced Energy Materials, 5, 11, 1500096 (2015).
Tomkiewicz A., Tamimi M.A., Huq A., McIntosh S., "Is the Surface Oxygen Exchange Rate Linked to Bulk Ion Diffusivity in Mixed Conducting Ruddlesden-Popper Phases?", Faraday Discussions, 182, 113-127 (2015).
Tomkiewicz A., Tamimi M.A., Huq A., McIntosh S., "Oxygen transport pathways in Ruddlesden-Popper structured oxides revealed via in situ neutron diffraction", Journal of Materials Chemistry A, 3, 43, 21864-21874 (2015).
Torres-Castro L., Shojan J., Julien C.M., Huq A., Dhital C., Paranthaman M.P., Katiyar R.S., Manivannan A., "Synthesis, characterization and electrochemical performance of Al-substituted Li2MnO3", Materials Science and Engineering B: Solid State Materials for Advanced Tech, 201, 13-22 (2015).
Woerner W.R., "In Situ Scattering and Modeling Approaches for the Discovery and Optimization of Novel Mineral-Inspired Materials", Ph.D. Dissertation, State University of New York at Stony Brook (2015).
Yiu Y., "Studies Of Strongly Correlated Electron Systems Using Neutron Scattering", Ph.D. Dissertation, University of Tennessee (2015).
Zhao P., Murshed M.M., Huq A., Grossmann H.K., Madler L., Alekseev E.V., Gesing T.M., "Nanoscale building blocks in a novel lithium are not tungsten bronze: Synthesis and characterization", Journal of Solid State Chemistry, 226, 81-87 (2015).

2014 53 Publications

al-Wahish A.B., "Neutron Scattering Studies of Phosphate Proton Conductors", Ph.D. Dissertation, University of Tennessee (2014).
Allred J.M., Taddei K.M., Bugaris D.E., Avci S., Chung D.Y., Claus H., dela Cruz C., Kanatzidis M.G., Rosenkranz S., Osborn R., Chmaissem O., "Coincident structural and magnetic order in BaFe2(As1-xPx)2 revealed by high-resolution neutron diffraction", Physical Review B, 90, 104513 (2014).
Anand V.K., Quirinale D.G., Lee Y.B., Harmon B.N., Furukawa Y., Ogloblichev V.V., Huq A., Abernathy D.L., Stephens P.W., McQueeney R.J., Kreyssig A., Goldman A.I., Johnston D.C., "Crystallography and physical properties of BaCo2As2, Ba0.94K0.06Co2As2, and Ba0.78K0.22Co2As2", Physical Review B, 90, 064517 (2014).
Baggetto L., Bridges C.A., Jumas J.C., Mullins D.R., Carroll K.J., Meisner R., Crumlin E., Liu X., Yang W., Veith G.M., "The Local Atomic Structure and Chemical Bonding in Sodium Tin Phases", Journal of Materials Chemistry A, 2, 44, 18959-18973 (2014).
Bhat S.M., Huq A., Swain D., Narayana C., Sundaram N.G., "Photoluminescence tuning of Na1−xKxNdW2O8 (0.0 ≤ x ≤ 0.7) nanoparticles: synthesis, crystal structure and Raman study", Physical Chemistry Chemical Physics, 16, 35, 18772-18780 (2014).
Bo S.H., "Transition Metal Borates as Cathode Materials for Rechargeable Batteries", Ph.D. Dissertation, State University of New York at Stony Brook (2014).
Bo S.H., Nam K.W., Borkiewicz O.J., Hu Y., Yang X.Q., Chupas P.J., Chapman K.W., Wu L., Zhang L., Wang F., Grey C.P., Khalifah P.G., "Structures of Delithiated and Degraded LiFeBO3, and Their Distinct Changes upon Electrochemical Cycling", Inorganic Chemistry, 53, 13, 6585-6595 (2014).
Brant J.A., dela Cruz C., Yao J.L., Douvalis A.P., Bakas T., Sorescu M., Aitken J.A., "Field-Induced Spin-Flop in Antiferromagnetic Semiconductors with Commensurate and Incommensurate Magnetic Structures: Li2FeGeS4 (LIGS) and Li2FeSnS4 (LITS)", Inorganic Chemistry, 53, 12265-12274 (2014).
Bugaris D.E., Hodges J.P., Huq A., Chance W.M., Heyden A., Chen F., zur Loye H.C., "Investigation of the high-temperature redox chemistry of Sr2Fe1.5Mo0.5O6-sigma via in situ neutron diffraction", Journal of Materials Chemistry A, 11, 4045-4054 (2014).
Burnett J.D., Gourdon O.A., Ranmohotti K.G., Takas N.J., Djieutedjeu H., Poudeu P.F., Aitken J.A., "Structure-property relationships along the Fe-substituted CuInS2 series: Tuning of thermoelectric and magnetic properties", Materials Chemistry and Physics, 147, 1-2, 17-27 (2014).
Cheng Y.Q., Bi Z., Huq A., Feygenson M., Bridges C.A., Paranthaman M.P., Sumpter B.G., "An integrated approach for structural characterization of complex solid state electrolytes: the case of lithium lanthanum titanate", Journal of Materials Chemistry A, 2, 7, 2418-2426 (2014).
Cottingham P., Miller D., Sheckelton J.P., Neilson J.R., Feygenson M., Huq A., McQueen T.M., "Dynamic charge disproportionation in the 1D chain material PdTeI", Journal of Materials Chemistry C, 2, 17, 3238 (2014).
Dashjav E., Tietz F., "Neutron Diffraction Analysis of NASICON-type Li1+xAlxTi2-xP3O12", Zeitschrift fur Anorganische und Allgemeine Chemie, 640, 15, 3070-3073 (2014).
Disch S., Hermann R.P., Wetterskog E., Podlesnyak A.A., An K., Hyeon T., Salazar-Alvarez G., Bergstrom L., Brueckel T., "Spin excitations in cubic maghemite nanoparticles studied by time-of-flight neutron spectroscopy", Physical Review B, 89, 064402 (2014).
Fobes D., Zaliznyak I.A., Xu Z., Zhong R., Gu G.D., Tranquada J.M., Harriger L.W., Singh D.K., Garlea V.O., Lumsden M.D., Winn B., "Ferro-orbital ordering transition in iron telluride Fe 1+yTe", Physical Review Letters, 112, 187202 (2014).
Gourdon O.A., Gottschlich M., Persson J., dela Cruz C., Petricek V., McGuire M.A., Brueckel T., "Toward a better understanding of the magnetocaloric effect: An experimental and theoretical study of MnFe4Si3 ", Journal of Solid State Chemistry, 216, 56 (2014).
Grajczyk R., "Structure-property relationships of YbFe₂O₄-type layered transition metal oxides", Ph.D. Dissertation, Oregon State University (2014).
Hao X., "Synthesis and Defect Structure Analysis ofComplex Oxides for Li-Ion Battery Electrodes", Ph.D. Dissertation, University of Michigan (2014).
Hao X., Lin X., Lu W., Bartlett B.M., "Oxygen Vacancies Lead to Loss of Domain Order, Particle Fracture, and Rapid Capacity Fade in Lithium Manganospinel (LiMn2O4) Batteries", Applied Materials & Interfaces, 6, 14, 10849-10857 (2014).
Harrison K.L., Bridges C.A., Segre C., Varnado Jr C.D., Applestone D., Bielawski C.W., Paranthaman M.P., Manthiram A., "Chemical and Electrochemical Lithiation of LiVOPO4 Cathodes for Lithium-Ion Batteries", Chemistry of Materials, 26, 12, 3849-3861 (2014).
Jalarvo N., Gourdon O.A., Ehlers G., Tyagi M., Kumar S.K., Dobbs K.D., Smalley R.J., Guise W.E., Ramirez-Cuesta A.J., Wildgruber C., Crawford M.K., "Structure and dynamics of octamethyl-POSS nanoparticles", Journal of Physical Chemistry C, 118, 10, 5579-5592 (2014).
Kim J.H., Huq A., Chi M., Pieczonka N.P., Lee E., Bridges C.A., Tessema M.M., Manthiram A., Persson K.A., Powell B.R., "Integrated Nano-Domains of Disordered and Ordered Spinel Phases in LiNi0.5Mn1.5O4 for Li-Ion Batteries", Chemistry of Materials, 26, 15, 4377-4386 (2014).
Laurita G., "Investigation of the Structural Influence on the Properties of Functional Inorganic Oxides", Ph.D. Dissertation, Oregon State University (2014).
Letourneau S., "Role of point defects in Perovskite microwave resonators", Master's Thesis, University of Illinois at Urbana-Champaign (2014).
Letourneau S., Zhen Z., Owens J., Tolman K., Ubic R., Kriven W., "Lattice constant prediction of defective rare earth titanate perovskites", Journal of Solid State Chemistry, 219, 99-107 (2014).
Li C.W., Ma J., Cao H.B., May A.F., Abernathy D.L., Ehlers G., Hoffmann C., Wang X.P., Hong T., Huq A., Gourdon O.A., Delaire O., "Anharmonicity and atomic distribution of SnTe and PbTe thermoelectrics", Physical Review B, 90, 214303 (2014).
Li M.R., Retuerto M., Walker D., Sarkar T., Stephens P.W., Mukherjee S., Dasgupta T.S., Hodges J.P., Croft M., Grams C.P., Hemberger J., Sanchez-Benitez J., Huq A., Saouma F.O., Jang J.I., Greenblatt M., "Magnetic-Structure-Stabilized Polarization in an Above-Room-Temperature Ferrimagnet", Angewandte Chemie International Edition, 53, 40, 10774-10778 (2014).
Li T., Liu Y.H., Chitara B., Goldberger J.E., "Li intercalation into 1D TiS2(en) chains", Journal of the American Chemical Society, 136, 8, 2986-2989 (2014).
Liu J., Chang D., Whitfield P., Janssen Y., Yu X., Zhou Y., Bai J., Ko J.Y., Nam K.W., Wu L., Zhu Y., Feygenson M., Amatucci G., VanderVen A., Yang X.Q., Khalifah P.G., "Ionic Conduction in Cubic Na3TiP3O9N, a Secondary Na-Ion Battery Cathode with Extremely Low Volume Change", Chemistry of Materials, 26, 10, 3295-3305 (2014).
Ma J., Delaire O., Specht E., May A.F., Gourdon O.A., Budai J.D., McGuire M.A., Hong T., Abernathy D.L., Ehlers G., Karapetrova E., "Phonon scattering rates and atomic ordering in Ag1-xSb1+xTe2+x(x=0,0.1,0.2) investigated with inelastic neutron scattering and synchrotron diffraction", Physical Review B, 90, 134303 (2014).
Malingowski A.C., "Structural and Optical Characterization of Semiconductors for Solar Water Splitting", Ph.D. Dissertation, State University of New York at Stony Brook (2014).
Mohanty D., Li J., Abraham D.P., Huq A., Payzant E.A., Wood D.L., Daniel C., "Unraveling the Voltage-Fade Mechanism in High-Energy-Density Lithium-Ion Batteries: Origin of the Tetrahedral Cations for Spinel Conversion", Chemistry of Materials, 26, 21, 6272-6280 (2014).
Montasserasadi D., Mohanty D., Huq A., Heroux L., Payzant E.A., Wiley J.B., "Topochemical synthesis of alkali-metal hydroxide layers within double- and triple-layered perovskites", Inorganic Chemistry, 53, 1773-1778 (2014).
Morrow R., Freeland J.W., Woodward P.M., "Probing the Links between Structure and Magnetism in Sr2-xCaxFeOsO6 Double Perovskites", Inorganic Chemistry, 53, 15, 7983-7992 (2014).
Murshed M.M., Mendive C.B., Curti M., Nenert G., Kalita P.E., Lipinska K., Cornelius A.L., Huq A., Gesing T.M., "Anisotropic lattice thermal expansion of PbFeBO4: A study by X-ray and neutron diffraction, Raman spectroscopy and DFT calculations", Materials Research Bulletin, 59, 170-178 (2014).
Nicholson D.M., Odbadrakh K., Shassere B.A., Rios O., Hodges J.P., Ludtka G.M., Porter W.D., Sefat A.S., Rusanu A., Brown G.M., Evans B.M., "Modeling and characterization of the magnetocaloric effect in Ni2MnGa materials", International Journal of Refrigeration, 37, 289-296 (2014).
Porter S., Huang Z., Woodward P.M., "A study of anion order/disorder in RTaN2O (R = La, Ce, Pr) perovskite nitride oxides", Crystal Growth and Design, 14, 1, 117-125 (2014).
Reim J., Rosen E., Schweika W., Meven M., Leo N.R., Meier D., Fiebig M., Schmidt M., Kuo C.Y., Pi T.W., Hu Z., Valldor M., "Structural invariance upon antiferromagnetic ordering in geometrically frustrated swedenborgite, CaBaCo2Fe2O7", Journal of Applied Crystallography, 47, 6, 2038-2047 (2014).
Reinert A., "Quantification and Control of Inhomogeneity in Wurtzite (GaN) 1-x(ZnO)x Semiconductors for Visible Light Absorption", Ph.D. Dissertation, State University of New York at Stony Brook (2014).
Retuerto M., Sarkar T., Li M.R., Ignatov A., Croft M., Hodges J.P., Tran T.T., Halasyamani P.S., Greenblatt M., "Crystallographic and magnetic properties of Pb2-xBixIr2O7-o(0 = x = 2)", Materials Research Express, 1, 4, 046304 (2014).
Saccomanno M.R., "Synthesis and Characterization Studies of LiFeIn(PO4) Phases: Chemical relatives of battery cathode material lithium iron phosphate", Master's Thesis, State University of New York at Stony Brook (2014).
Tamimi M.A., McIntosh S., "High temperature in situ neutron powder diffraction of oxides", Journal of Materials Chemistry A, 2, 17, 6015-6026 (2014).
Thompson T., "Synthesis and processing of materials for direct thermal-to-electric energy conversion and storage", Ph.D. Dissertation, Michigan State University (2014).
Thompson T., Wolfenstine J., Allen J.L., Johannes M.D., Huq A., David I.N., Sakamoto J., "Tetragonal vs. cubic phase stability in Al - free Ta doped Li7La3Zr2O12 (LLZO)", Journal of Materials Chemistry A, 2, 13431-13436 (2014).
Vasala S., Saadaoui H., Morenzoni E., Chmaissem O., Chan T.S., Chen J.M., Hsu Y.Y., Yamauchi H., Karppinen M., "Characterization of magnetic properties of Sr2CuWO6 and Sr2CuMoO6", Physical Review B, 89, 134419 (2014).
Wdowik U.D., Parlinski K., Rols S., Chatterji T., "Soft-phonon mediated structural phase transition in GeTe", Physical Review B, 89, 224306 (2014).
Xu J., Lee D.H., Clement R.J., Yu X., Leskes M., Pell A.J., Pintacuda G., Yang X.Q., Grey C.P., Meng Y.S., "Identifying the critical role of Li subsitution in P2-Nax[LiyNizMn1-y-z]O2 (0 < x, y, z < 1) intercalation cathode materials for high-energy Na-ion batteries", Chemistry of Materials, 26, 1260-1269 (2014).
Yiu Y., Bonfa P., Sanna S., De Renzi R., Carretta P., McGuire M.A., Huq A., Nagler S.E., "Tuning the magnetic and structural phase transitions of PrFeAsO via Fe/Ru spin dilution", Physical Review B, 90, 064515 (2014).

2013 46 Publications

Bergstrom Jr R., "Morphotropic Phase Boundaries in Tb1-xDyxFe2 Alloys", Ph.D. Dissertation, University of Maryland (2013).
Bergstrom R.J., Wuttig M., Cullen J., Zavalij P., Briber R., Dennis C., Garlea V.O., Laver M., "Morphotropic phase boundaries in ferromagnets: Tb1-xDyxFe2 alloys", Physical Review Letters, 111, 017203 (2013).
Bessas D., Rushchanskii K.Z., Kachlik M., Disch S., Gourdon O.A., Bednarcik J., Maca K., Sergueev I., Kamba S., Lezaic M., Hermann R.P., "Lattice instabilities in bulk EuTiO3", Physical Review B, 88, 144308 (2013).
Bridges C.A., Harrison K.L., Unocic R.R., Idrobo J.C., Paranthaman M.P., Manthiram A., "Defect chemistry of phospho-olivine nanoparticles synthesized by a microwave-assisted solvothermal process", Journal of Solid State Chemistry, 205, 197-204 (2013).
Burnett J.D., Xu T., Sorescu M., Strohmeier B.R., Sturgeon J., Gourdon O.A., Baroudi K., Yao J.L., Aitken J.A., "Location and oxidation state of iron in Fe-substituted CuInS2 chalcopyrites", Journal of Solid State Chemistry, 197, 279-287 (2013).
Caignaert V., Maignan A., Singh K., Simon C., Pralong V., Raveau B., Mitchell J.F., Zheng H., Huq A., Chapon L.C., "Gigantic magnetic-field-induced polarization and magnetoelectric coupling in a ferrimagnetic oxide CaBaCo4O7", Physical Review B, 88, 174403 (2013).
Carmack J.M., "Extending symmetry-mode analysis to determining magnetic superstructure symmetry", Ph.D. Dissertation, Brigham Young University (2013).
Cox-Galhotra R.A., Huq A., Hodges J.P., Kim J.H., Yu C., Wang X., Jacobson A.J., McIntosh S., "Visualizing oxygen anion transport pathways in NdBaCo2O5+sigma by in situ neutron diffraction", Journal of Materials Chemistry A, 1, 9, 3091-3100 (2013).
Cox-Galhotra R.A., Huq A., Hodges J.P., Yu C., Wang X., Gong W., Jacobson A.J., McIntosh S., "An in-situ neutron diffraction study of the crystal structure of PrBaCo2O5 + delta at high temperature and controlled oxygen partial pressure", Solid State Ionics, 249-250, 34-40 (2013).
Gesing T.M., Mendive C.B., Curti M., Hansmann D., Nenert G., Kalita P.E., Lipinska K., Huq A., Cornelius A.L., Murshed M.M., "Structural properties of mullite-type Pb(Al1-xMnx)BO4", Zeitschrift fur Kristallographie, 228, 10, 532-543 (2013).
Gottschlich M., "Structure, magnetism and excitations in some Mn-based magnetocaloric effect compounds", Ph.D. Dissertation, RWTH Aachen University (2013).
Grajczyk R., Berthelot R., Muir S., Sleight A.W., Subramanian M.A., "Structural and magnetic investigation of Fe3+andMg2+substitution into the trigonal bipyramidal site of InGaCuO4", Journal of Solid State Chemistry, 199, 102-108 (2013).
Hoepfner V., Jacobs P., Sawinski P.K., Houben A., Reim J., Dronskowski R., "RbCN3H4 and CsCN3H4: a neutron powder and single-crystal X-ray diffraction study", Zeitschrift fur Anorganische und Allgemeine Chemie, 639, 7, 1232-1236 (2013).
Iqbal M., Kobayashi G., Hirayama M., Kanno R., "Synthesis, structure and electrochemical properties of layered La2Li2x(CO3)1-xO2+2x", Journal of Solid State Chemistry, 206, 14-19 (2013).
Jacobs P., Houben A., Tchougreeff A.L., Dronskowski R., "High-resolution neutron diffraction study of CuNCN: new evidence of structure anomalies at low temperature", Journal of Chemical Physics, 139, 224707 (2013).
Jalarvo N., Gourdon O.A., Bi Z., Gout D.J., Ohl M., Paranthaman M.P., "Atomic scale picture of the ion conduction mechanism in tetrahedral network of lanthanum barium gallate", Chemistry of Materials, 25, 14, 2741-2748 (2013).
Jiang P., Li J., Ozarowski A., Sleight A.W., Subramanian M.A., "Intense turquoise and green colors in brownmillerite-type oxides based on Mn5+ in Ba2In2-xMnxO5+x", Inorganic Chemistry, 52, 3, 1349-1357 (2013).
Johnson J.A., "Studies of reaction processes for voloxidation methods", Ph.D. Dissertation, University of Tennessee (2013).
Lee J., "Neutron Scattering Study on BiS2-based Superconductors", Ph.D. Dissertation, University of Virginia (2013).
Lee J., Stone M.B., Huq A., Yildirim T., Ehlers G., Mizuguchi Y., Miura O., Takano Y., Deguchi K., Demura S., Lee S.H., "Crystal structure, lattice vibrations, and superconductivity of LaO1-xFxBiS2", Physical Review B, 87, 205134 (2013).
Ma J., Delaire O., May A.F., Carlton C.E., McGuire M.A., VanBebber L.H., Abernathy D.L., Ehlers G., Hong T., Huq A., Tian W., Keppens V., Shao-Horn Y., Sales B.C., "Glass-like phonon scattering from a spontaneous nanostructure in AgSbTe2", Nature Nanotechnology, 8, 445–451 (2013).
Minnich A.J., "Naturally glassy crystals", Nature Nanotechnology, 8, 392-393 (2013).
Mohanty D., Huq A., Payzant E.A., Sefat A.S., Li J., Abraham D.P., Wood D.L., Daniel C., "Neutron diffraction and magnetic susceptibility studies on a high-voltage Li1.2Mn0.55Ni0.15Co0.10O2 lithium-ion battery cathode; an insight to the crystal structure", Chemistry of Materials, 25, 20, 4064-4070 (2013).
Morrow R., Mishra R., Restrepo O.D., Ball M.R., Windl W., Wurmehl S., Stockert U., Buechner B., Woodward P.M., "Independent ordering of two interpenetrating magnetic sublattices in the double perovskite Sr2CoOsO6", Journal of the American Chemical Society, 135, 50, 18824-18830 (2013).
Nichols E.J., Shi J., Huq A., Vogel S.C., Misture S.T., "Controlling structure distortions in 3-layer ferroelectric Aurivillius oxides", Journal of Solid State Chemistry, 197, 475-482 (2013).
Omenya F., Chernova N.A., Wang Q., Zhang R., Whittingham M.S., "The structural and electrochemical impact of Li and Fe site substitution in LiFePO4", Chemistry of Materials, 25, 13, 2691-2699 (2013).
Phelan D., Suzuki Y., Wang S., Huq A., Leighton C., "Structural, transport, and magnetic properties of narrow bandwidth Nd1-xCaxCoO3-delta and comparisons to Pr1-xCaxCoO3-delta", Physical Review B, 88, 075119 (2013).
Pieczonka N.P., Liu Z., Huq A., Kim J.H., "Comparative study of LiMnPO4/C cathodes synthesized by polyol and solid-state reaction methods for Li-ion batteries", Journal of Power Sources, 230, 122-129 (2013).
Quirinale D.G., Anand V.K., Kim M.G., Pandey A., Huq A., Stephens P.W., Heitmann T.W., Kreyssig A., McQueeney R.J., Johnston D.C., Goldman A.I., "Crystal and magnetic structure of CaCo1.86As2 studied by x-ray and neutron diffraction", Physical Review B, 88, 174420 (2013).
Ramezanipour F., Shishkin M., Singh K., Hodges J.P., Ziegler T., Thangadurai V., "Interstitial oxygens and cation deficiency in Mo-doped ceria, an anode material for SOFCs", Journal of Materials Chemistry A, 1, 8344-8347 (2013).
Retuerto M., Li M.R., Go Y.B., Ignatov A., Croft M., Ramanujachary K.V., Herber R.H., Nowik I., Hodges J.P., Dachraoui W., Hadermann J., Greenblatt M., "Corrigendum to "High magnetic ordering temperature in the perovskites Sr4-xLaxFe3ReO12 (x=0.0, 1.0, 2.0)" [J. Solid State Chem. 194 (2012) 48-58]", Journal of Solid State Chemistry, 198, 246 (2013).
Retuerto M., Li M.R., Ignatov A., Croft M., Ramanujachary K.V., Chi S.X., Hodges J.P., Dachraoui W., Hadermann J., Tran T.T., Halasyamani P.S., Grams C.P., Hemberger J., Greenblatt M., "Polar and magnetic layered A-site and rock salt B-site-ordered NaLnFeWO6 (Ln = La, Nd) perovskites", Inorganic Chemistry, 52, 21, 12482-12491 (2013).
Silverstein H., Sharma A.Z., Cruz-Kan K., Zhou H.D., Huq A., Flacau R., Wiebe C.R., "Complex long-range magnetic ordering in the Mn-bearing dugganite Pb3TeMn3P2O14", Journal of Solid State Chemistry, 150, 102-107 (2013).
Silverstein H., Sharma A.Z., Stoller A.J., Cruz-Kan K., Flacau R., Donaberger R.L., Zhou H.D., Manuel P., Huq A., Kolesnikov A.I., Wiebe C.R., "Phase diagram and magnetic structures of the Co-bearing dugganites Pb3TeCo3A2O14 (A = V, P)", Journal of Physics: Condensed Matter, 25, 246004 (2013).
Somaily H.M., "Structural and thermoelectric properties of A-site substituted (Sr1-x-yCaxNdy)TiO3 perovskites", Master's Thesis, Northern Illinois University (2013).
Tomkiewicz A., Tamimi M.A., Huq A., McIntosh S., "Evidence for the low oxygen stoichiometry of cubic Ba0.5Sr0.5Co0.5Fe0.5O3-delta from in-situ neutron diffraction", Solid State Ionics, 253, 27-31 (2013).
Tripathi R., "Novel high voltage electrodes for Li-ion batteries", Ph.D. Dissertation, University of Waterloo (2013).
Tripathi R., Popov G., Sun X., Nazar L.F., "Ultra-rapid microwave synthesis of triplite LiFeSO4F", Journal of Materials Chemistry A, 1, 2990-2994 (2013).
Wang C.L., Clonts L., Diawara Y., Hannan B.W., Hodges J.P., "Elimination of ghosting artifacts from wavelength-shifting fiber neutron detectors", Review of Scientific Instruments, 84, 013308 (2013).
Wang L., Cao B., Kang W., Hybertsen M., Maeda K., Domen K., Khalifah P.G., "Design of medium band gap Ag-Bi-Nb-O and Ag-Bi-Ta-O semiconductors for driving direct water splitting with visible light", Inorganic Chemistry, 52, 16, 9192-9205 (2013).
Wang R., He X., He L., Wang F., Xiao R., Gu L., Li H., Chen L., "Atomic structure of Li2MnO3 after partial delithiation and re-lithiation", Advanced Energy Materials, 3, 10, 1358-1367 (2013).
Zhao L.L., Wu S., Wang J.K., Hodges J.P., Broholm C., Morosan E., "Quasi-two-dimensional noncollinear magnetism in the Mott insulator Sr2F2Fe2OS2", Physical Review B, 87, 020406 (2013).

2012 26 Publications

Avci S., Chmaissem O., Zheng H., Huq A., Khalyavin D.D., Stephens P.W., Suchomel M.R., Manuel P., Mitchell J.F., "Kinetic control of structural and magnetic states in LuBaCo4O7", Physical Review B, 85, 094414 (2012).
Chen Y., Orlovskaya N., Klimov M., Huang X., Cullen D., Graule T., Kuebler J., "Layered YSZ/SCSZ/YSZ electrolytes for intermediate temperature SOFC part I: design and manufacturing", Fuel Cells, 12, 5, 722-731 (2012).
Delaire O., Stone M.B., Ma J., Huq A., Gout D.J., Brown C.M., Wang K.F., Ren Z.F., "Anharmonic phonons and magnons in BiFeO3", Physical Review B, 85, 064405 (2012).
Ehlers G., Huq A., Diallo S.O., Adriano C., Rule K.C., Cornelius A.L., Fouquet P., Pagliuso P.G., Gardner J.S., "Low energy spin dynamics in the spin ice Ho2Sn2O7", Journal of Physics: Condensed Matter, 24, 076005 (2012).
Gatimu A.J., "Structure-property relationships in oxides containing select platinum group metals", Ph.D. Dissertation, Oregon State University (2012).
Gottschilch M., Gourdon O.A., Persson J., dela Cruz C., Petricek V., Brueckel T., "Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material", Journal of Materials Chemistry, 22, 15275-15284 (2012).
Grajczyk R., Biswas K., Berthelot R., Li J., Sleight A.W., Subramanian M.A., "Substitutions into the trigonal bipyramidal site of InGaCuO4", Journal of Solid State Chemistry, 187, 6, 258-263 (2012).
Hao X., Gourdon O.A., Liddle B.J., Bartlett B.M., "Improved electrode kinetics in lithium manganospinel nanoparticles synthesized by hydrothermal methods: identifying and eliminating oxygen vacancies", Journal of Materials Chemistry, 22, 1578-1591 (2012).
Jiang P., "Structure-property relationships of oxides with hexagonal AMO3 and brownmillerite related structures", Ph.D. Dissertation, Oregon State University (2012).
Johnson J.A., Rawn C.J., Del Cul G.D., Spencer B.B., Collins E.D., "Kinetic studies of NO2 oxidation of uranium oxides by in situ XRD and neutron diffraction", Transactions of the American Nuclear Society, 107, 1, 243-245 (2012).
Kolesnik S., Dabrowski B., Chmaissem O., Avci S., Hodges J.P., Avdeev M.V., Swierczek K., "Enhancement of the Curie temperature in NdBaCo2O5.5 by A-site Ca substitution", Physical Review B, 86, 064434 (2012).
Lee E., "Structural and electrochemical characterization of high-energy oxide cathodes for lithium ion batteries", Ph.D. Dissertation, University of Texas at Austin (2012).
Lee E., Huq A., Chang H.Y., Manthiram A., "High-voltage, high-energy layered-spinel composite cathodes with superior cycle life for lithium-ion batteries", Chemistry of Materials, 24, 3, 600-612 (2012).
Malingowski A.C., Stephens P.W., Huq A., Huang Q.Z., Khalid S., Khalifah P.G., "Substitutional mechanism of Ni into the wide-band-gap semiconductor InTaO4 and its implications for water splitting activity in the wolframite structure type", Inorganic Chemistry, 51, 11, 6096-6103 (2012).
May A.F., McGuire M.A., Ma J., Delaire O., Huq A., Custelcean R., "Properties of single crystalline AZn2Sb2 (A= Ca, Eu, Yb)", Journal of Applied Physics, 111, 33708 (2012).
May A.F., McGuire M.A., Ma J., Delaire O., Huq A., Singh D.J., Cai W., Wang H., "Thermoelectric transport properties of CaMg2Bi2, EuMg2Bi2, and YbMg2Bi2", Physical Review B, 85, 35202 (2012).
Munoz-Garcia A.B., Bugaris D.E., Pavone M., Hodges J.P., Huq A., Chen F., zur Loye H.C., Carter E.A., "Unveiling structure-property relationships in Sr2Fe1.5Mo0.5O6-, an electrode material for symmetric solid oxide fuel cells", Journal of the American Chemical Society, 134, 6826-6833 (2012).
Nicholson D.M., Odbadrakh K., Shassere B.A., Rios O., Hodges J.P., Ludtka G.M., Porter W.D., Sefat A.S., Rusanu A., Evans B.M., "Modeling and characterization of the magnetocaloric effect in Ni2MnGa materials", Fifth IIF-IIR International Conference on Magnetic Refrigeration at Room Temperature, Thermag V, Grenoble, France, 17-20 September 2012, Proceedings of THERMAG V, (2012).
Niedziela J., "Structure and dynamics of high temperature superconductors", Ph.D. Dissertation, University of Tennessee (2012).
Retuerto M., Li M.R., Go Y.B., Ignatov A., Croft M., Ramanujachary K.V., Hadermann J., Hodges J.P., Herber R.H., Nowik I., Greenblatt M., "Magnetic and structural studies of the multifunctional material SrFe0.75Mo0.25O3-delta", Inorganic Chemistry, 51, 22, 12273-12280 (2012).
Retuerto M., Li M.R., Go Y.B., Ignatov A., Croft M., Ramanujachary K.V., Herber R.H., Nowik I., Hodges J.P., Dachraoui W., Hadermann J., Greenblatt M., "High magnetic ordering temperature in the perovskites Sr4-xLaxFe3ReO12 (x=0.0, 1.0, 2.0)", Journal of Solid State Chemistry, 194, 48-58 (2012).
Sheckelton J.P., Neilson J.R., Soltan D.G., McQueen T.M., "Possible valence-bond condensation in the frustrated cluster magnet LiZn2Mo3O8", Nature Materials, 11, 493-496 (2012).
Shin D.W., Bridges C.A., Huq A., Paranthaman M.P., Manthiram A., "Role of cation ordering and surface-segregation in high-voltage spinel LiMn1.5Ni0.5-xMxO4 (M = Cr, Fe, and Ga) cathodes for lithium-ion batteries", Chemistry of Materials, 24, 19, 3720-3731 (2012).
Tchougreeff A.L., Liu X., Mueller P., van Beek W., Ruschewitz U., Dronskowski R., "Structural study of CuNCN and its theoretical implications: a case of a resonating-valence-bond state?", Journal of Physical Chemistry Letters, 3, 3360-3366 (2012).
Tripathi R., Popov G., Ellis B.L., Huq A., Nazar L.F., "Lithium metal fluorosulfate polymorphs as positive electrodes for Li-ion batteries: synthetic strategies and effect of cation ordering", Energy & Environmental Science, 5, 6238-6246 (2012).
Yiu Y., Garlea V.O., McGuire M.A., Huq A., Mandrus D., Nagler S.E., "Neutron diffraction study and anomalous negative thermal expansion in nonsuperconducting PrFe1-xRuxAsO", Physical Review B, 86, 054111 (2012).

2011 6 Publications

Bridges C.A., Sefat A.S., Payzant E.A., Cranswick L.M., Paranthaman M.P., "Structure and magnetic order in the series BixRE1-xFe0.5Mn0.5O3 (RE=La,Nd)", Journal of Solid State Chemistry, 184, 4, 830-842 (2011).
Bugaris D.E., Hodges J.P., Huq A., zur Loye H.C., "Crystal growth, structures, and optical properties of the cubic double perovskites Ba2MgWO6 and Ba2ZnWO6", Journal of Solid State Chemistry, 184, 8, 2293-2298 (2011).
Dutton S.E., Climent-Pascual E., Stephens P.W., Hodges J.P., Huq A., Broholm C., Cava R.J., "Helical magnetism and structural anomalies in triangular lattice alpha-SrCr2O4", Journal of Physics: Condensed Matter, 23, 246005 (2011).
Huq A., Hodges J.P., Gourdon O.A., Heroux L., "POWGEN: a third-generation high resolution high-throughput powder diffraction instrument at the Spallation Neutron Source", Zeitschrift fur Kristallographie, 1, 127-135 (2011).
Jiang Y., Huq A., Booth C.H., Ehlers G., Greedan J.E., Gardner J.S., "Order and disorder in the local and long-range structure of the spin-glass pyrochlore, Tb2Mo2O7", Journal of Physics: Condensed Matter, 23, 164214 (2011).
Stone M.B., Podlesnyak A.A., Ehlers G., Huq A., Samulon E.C., Shapiro M.C., Fisher I.R., "Persistence of magnons in a site-diluted dimerized frustrated antiferromagnet", Journal of Physics: Condensed Matter, 23, 416003 (2011).