Thermodynamics of high entropy oxides

McCormack, Scott J.; Navrotsky, Alexandra

doi:10.1016/j.actamat.2020.10.043

Thermodynamics of high entropy oxides

Journal Article · 01 January 2021 · Acta Materialia

DOI:https://doi.org/10.1016/j.actamat.2020.10.043· OSTI ID:1849469

McCormack, Scott J.; Navrotsky, Alexandra

Not provided.

Research Organization:: Univ. of California, Davis, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC)

DOE Contract Number:: FG02-03ER46053

OSTI ID:: 1849469

Journal Information:: Acta Materialia, Vol. 202, Issue C; ISSN 1359-6454

Publisher:: Elsevier

Country of Publication:: United States

Language:: English

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Size-Driven Structural and Thermodynamic Complexity in Iron Oxides Navrotsky, A.; Mazeina, L.; Majzlan, J. Science, Vol. 319, Issue 5870 https://doi.org/10.1126/science.1148614	journal	March 2008
High-temperature calorimetry of zirconia: Heat capacity and thermodynamics of the monoclinic–tetragonal phase transition Moriya, Yosuke; Navrotsky, Alexandra The Journal of Chemical Thermodynamics, Vol. 38, Issue 3 https://doi.org/10.1016/j.jct.2005.05.002	journal	March 2006
Systematics of Phase Transition and Mixing Energetics in Rare Earth, Yttrium, and Scandium Stabilized Zirconia and Hafnia Simoncic, Petra; Navrotsky, Alexandra Journal of the American Ceramic Society, Vol. 90, Issue 7 https://doi.org/10.1111/j.1551-2916.2007.01678.x	journal	July 2007
Energy Crossovers in Nanocrystalline Zirconia: Energy Crossovers in Nanocrystalline Zirconia Pitcher, Michael W.; Ushakov, Sergey V.; Navrotsky, Alexandra Journal of the American Ceramic Society, Vol. 88, Issue 1 https://doi.org/10.1111/j.1551-2916.2004.00031.x	journal	December 2004
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The Zirconia?Hafnia System: DTA Measurements and Thermodynamic Calculations Wang, Chong; Zinkevich, Matvei; Aldinger, Fritz Journal of the American Ceramic Society, Vol. 89, Issue 12 https://doi.org/10.1111/j.1551-2916.2006.01286.x	journal	December 2006
Calorimetric Measurements of Surface Energy of Amorphous HfO ₂ Nanoparticles Produced by Gas Phase Condensation Sharma, Geetu; Ushakov, Sergey V.; Li, Hui The Journal of Physical Chemistry C, Vol. 121, Issue 19 https://doi.org/10.1021/acs.jpcc.7b01262	journal	May 2017
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The olivine-spinel transition in Fe ₂ SiO ₄ and Ni ₂ SiO ₄ Akimoto, Syun-iti; Fujisawa, Hideyuki; Katsura, Takashi Journal of Geophysical Research, Vol. 70, Issue 8 https://doi.org/10.1029/JZ070i008p01969	journal	April 1965
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High pressure studies of the system Mg 2 GeO 4 Mg 2 SiO 4 with special reference to the olivine-spinel traansition Dachille, F.; Roy, R. American Journal of Science, Vol. 258, Issue 4 https://doi.org/10.2475/ajs.258.4.225	journal	April 1960
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Thermodynamics of the CoO–ZnO System at Bulk and Nanoscale Ma, Chengcheng; Navrotsky, Alexandra Chemistry of Materials, Vol. 24, Issue 12 https://doi.org/10.1021/cm3005198	journal	June 2012
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Fluorite-pyrochlore transformation in Eu2Zr2O7—direct calorimetric measurement of phase transition, formation and surface enthalpies Saradhi, M. P.; Ushakov, S. V.; Navrotsky, A. RSC Advances, Vol. 2, Issue 8 https://doi.org/10.1039/c2ra00727d	journal	January 2012
Etude de la transformation ordre-desordre de la structure fluorite a la structure pyrochlore pour des phases (1−x) ZrO2  x Ln2O3 Michel, D.; Perez y. Jorba, M.; Collongues, R. Materials Research Bulletin, Vol. 9, Issue 11 https://doi.org/10.1016/0025-5408(74)90092-0	journal	November 1974
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On the homogeneity of high entropy oxides: An investigation at the atomic scale Chellali, Mohammed Reda; Sarkar, Abhishek; Nandam, Sree Harsha Scripta Materialia, Vol. 166 https://doi.org/10.1016/j.scriptamat.2019.02.039	journal	June 2019
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Energetics of nanoparticle oxides: interplay between surface energy and polymorphism† Navrotsky, Alexandra Geochemical Transactions, Vol. 4, Issue 1 https://doi.org/10.1186/1467-4866-4-34	journal	November 2003
Nanophase Transition Metal Oxides Show Large Thermodynamically Driven Shifts in Oxidation-Reduction Equilibria Navrotsky, Alexandra; Ma, Chengcheng; Lilova, Kristina Science, Vol. 330, Issue 6001 https://doi.org/10.1126/science.1195875	journal	October 2010
Thermodynamic analysis of phase stability of nanocrystalline titania Zhang, Hengzhong; Banfield, Jillian F. Journal of Materials Chemistry, Vol. 8, Issue 9 https://doi.org/10.1039/a802619j	journal	January 1998
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Analysis of Anhydrous and Hydrated Surface Energies of gamma-Al ₂ O ₃ by Water Adsorption Microcalorimetry Castro, Ricardo H. R.; Quach, Dat V. The Journal of Physical Chemistry C, Vol. 116, Issue 46 https://doi.org/10.1021/jp309319j	journal	November 2012
Surface Energy and Thermodynamic Stability of γ-Alumina: Effect of Dopants and Water Castro, Ricardo H. R.; Ushakov, Sergey V.; Gengembre, Leon Chemistry of Materials, Vol. 18, Issue 7 https://doi.org/10.1021/cm052599d	journal	April 2006
Molecular dynamics simulations of α-alumina and γ-alumina surfaces Blonski, S.; Garofalini, S. H. Surface Science, Vol. 295, Issue 1-2 https://doi.org/10.1016/0039-6028(93)90202-U	journal	September 1993
Effects of Increased Surface Area and Chemisorbed H ₂ O on the Relative Stability of Nanocrystalline γ-Al ₂ O ₃ and α-Al ₂ O ₃ McHale, J. M.; Navrotsky, A.; Perrotta, A. J. The Journal of Physical Chemistry B, Vol. 101, Issue 4 https://doi.org/10.1021/jp9627584	journal	January 1997
Energetics of X-ray-amorphous zirconia and the role of surface energy in its formation Molodetsky, Irina; Navrotsky, Alexandra; Paskowitz, Michael J. Journal of Non-Crystalline Solids, Vol. 262, Issue 1-3 https://doi.org/10.1016/S0022-3093(99)00690-0	journal	February 2000
Surface Enthalpy, Enthalpy of Water Adsorption, and Phase Stability in Nanocrystalline Monoclinic Zirconia Radha, A. V.; Bomati-Miguel, Oscar; Ushakov, Sergey V. Journal of the American Ceramic Society, Vol. 92, Issue 1 https://doi.org/10.1111/j.1551-2916.2008.02796.x	journal	January 2009
First-principles study of the surfaces of zirconia Christensen, A.; Carter, Emily A. Physical Review B, Vol. 58, Issue 12 https://doi.org/10.1103/PhysRevB.58.8050	journal	September 1998
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Determination of the surface energy of amorphous silica from solubility measurements in micropores Mizele, J.; Dandurand, J. L.; Schott, J. Surface Science Letters, Vol. 162, Issue 1-3 https://doi.org/10.1016/0167-2584(85)90343-3	journal	October 1985
Energetics of oxide nanoparticles Navrotsky, Alexandra International Journal of Quantum Chemistry, Vol. 109, Issue 12 https://doi.org/10.1002/qua.21981	journal	October 2009
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Surface Enthalpies of Nanophase ZnO with Different Morphologies Zhang, Peng; Xu, Fen; Navrotsky, Alexandra Chemistry of Materials, Vol. 19, Issue 23 https://doi.org/10.1021/cm0711919	journal	November 2007
First-Principles Study of the Surface of Wurtzite ZnO and ZnS - Implications for Nanostructure Formation Na, Sung-Ho; Park, Chul-Hong Journal of the Korean Physical Society, Vol. 54, Issue 9(2) https://doi.org/10.3938/jkps.54.867	journal	February 2009
Energetics of Cubic and Monoclinic Yttrium Oxide Polymorphs: Phase Transitions, Surface Enthalpies, and Stability at the Nanoscale Zhang, Peng; Navrotsky, Alexandra; Guo, Bing The Journal of Physical Chemistry C, Vol. 112, Issue 4 https://doi.org/10.1021/jp7102337	journal	January 2008
Thermodynamics of formation of the silicates and germanates of some divalent transition metals and of magnesium Navrotsky, A. Journal of Inorganic and Nuclear Chemistry, Vol. 33, Issue 12 https://doi.org/10.1016/0022-1902(71)80502-X	journal	December 1971

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