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RESEARCH PAPER · Materials Advances · 2024

Oxide ion dynamics in hexagonal perovskite mixed conductor Ba 7 Nb 4 MoO 20 : a comprehensive ab initio molecular dynamics study

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Oxide ion dynamics in hexagonal perovskite mixed conductor Ba 7 Nb 4 MoO 20 : a comprehensive ab initio molecular dynamics studyOriginalB-site deficient hexagonal perovskites: Structural stability, ionic order-disorder and electrical properties36Computational Insights into Dion–Jacobson Type Oxide Ion Conductors9Assessment of the Chemical Compatibility Between Ba7Nb4MoO20 Electrolyte and Some Electrode Materials for Solid Oxide Fuel Cells0Hydration-driven enhancement of interstitialcy oxide-ion diffusion10High Oxide-Ion Conduction in Rb-Containing Oxides8Elucidating oxide-ion and proton transport in ionic conductors using machine learning potentials4Oxygen Vacancy Engineering toward Enhanced Dielectric and Ionic Conductivity Properties in Single Crystal LiNbMoO 61Discovery of a Rubidium-Containing Oxide-Ion Conductor with Hexagonal Perovskite-Related Structure0Investigation of Cu-doped multi-cation perovskite oxides for high-temperature water splitting: a combined experimental and theoretical study0

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  1. B-site deficient hexagonal perovskites: Structural stability, ionic order-disorder and electrical properties

    Progress in Solid State Chemistry · 2024-04-30

    Xiaoyan Yang, Alberto José Fernández-Carrión, Xinyue Geng, Xiaojun Kuang

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  2. Computational Insights into Dion–Jacobson Type Oxide Ion Conductors

    The Journal of Physical Chemistry C · 2024-05-24

    Bettina Schwaighofer, Miguel Angel Gonzalez, Ivana Radosavljević Evans

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  3. Assessment of the Chemical Compatibility Between Ba7Nb4MoO20 Electrolyte and Some Electrode Materials for Solid Oxide Fuel Cells

    Powder Metallurgy and Metal Ceramics · 2025-01-01

    Oleksii Bezdorozhev, A. V. Stepanenko, Igor A. Morozov, Yu. М. Solonin

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  4. Hydration-driven enhancement of interstitialcy oxide-ion diffusion

    Journal of Materials Chemistry A · 2025-01-01

    Yuichi Sakuda, Mudasir A. Yatoo, Bhuvaneshwari Manivannan, Vediyappan Veeramani, Junko Habasaki, Stephen J. Skinner, Hiroshige Matsumoto, Masatomo Yashima

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  5. High Oxide-Ion Conduction in Rb-Containing Oxides

    Chemistry of Materials · 2025-02-03

    Yuta Yasui, Kazuaki Jojima, Kotaro Fujii, Kazuhiro John Mori, Masatomo Yashima

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  6. Elucidating oxide-ion and proton transport in ionic conductors using machine learning potentials

    npj Computational Materials · 2025-11-05

    Ying Zhou, Sacha Fop, Abbie Christina Mclaughlin, James Alexander Dawson

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  7. Oxygen Vacancy Engineering toward Enhanced Dielectric and Ionic Conductivity Properties in Single Crystal LiNbMoO 6

    Inorganic Chemistry · 2025-12-25

    Zheng Wang, L. Liu, Z. J. ZHAO, Jing Liang, Yaran ZHANG, Chao Chen, Wei Liu, Hongwei Geng, Zeliang Gao

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  8. Discovery of a Rubidium-Containing Oxide-Ion Conductor with Hexagonal Perovskite-Related Structure

    Springer theses · 2026-01-01

    Yuta Yasui

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  9. Investigation of Cu-doped multi-cation perovskite oxides for high-temperature water splitting: a combined experimental and theoretical study

    Journal of Materials Chemistry A · 2026-01-01

    Macmillan Chanda, Abdelali El Omrani, Younes Ait Bella, Houda Karibe, Abdessamad Faik, Hanane Ait Ousaleh

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