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RESEARCH PAPER · Physical Chemistry Chemical Physics · 2021

Surface activation by electron scavenger metal nanorod adsorption on TiH 2 , TiC, TiN, and Ti 2 O 3

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Surface activation by electron scavenger metal nanorod adsorption on TiH 2 , TiC, TiN, and Ti 2 O 3OriginalFactors determining surface oxygen vacancy formation energy in ternary spinel structure oxides with zinc31Propane Dehydrogenation Catalysis of Titanium Hydrides: Positive Effect of Hydrogen Co-feeding5Recent Advances in Density Functional Theory (DFT) and Informatics Studies on Metal Oxide Surfaces1Understanding and controlling the formation of surface anion vacancies for catalytic applications12Trends in Surface Oxygen Formation Energy in Perovskite Oxides14Bond activation and formation on inorganic surfaces0Propane metathesis and hydrogenolysis over titanium hydride catalysts3Prediction of Stable Surfaces of Metal Oxides through the Unsaturated Coordination Index7Comparison of Matlantis and VASP Bulk Formation and Surface Energies in Metal Hydrides, Carbides, Nitrides, Oxides, and Sulfides13Propane dehydrogenation catalysis of group IIIB and IVB metal hydrides1Facilitating H migration on graphene by adsorbing on Au2

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  1. Factors determining surface oxygen vacancy formation energy in ternary spinel structure oxides with zinc

    Physical Chemistry Chemical Physics · 2021-01-01

    Yoyo Hinuma, Shinya Mine, Takashi Toyao, Takashi Kamachi, Ken‐ichi Shimizu

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  2. Propane Dehydrogenation Catalysis of Titanium Hydrides: Positive Effect of Hydrogen Co-feeding

    Chemistry Letters · 2021-12-06

    Shunsaku Yasumura, Yuxiang Wen, Takashi Toyao, Yasuharu Kanda, Ken‐ichi Shimizu, Zen Maeno

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  3. Recent Advances in Density Functional Theory (DFT) and Informatics Studies on Metal Oxide Surfaces

    Springer eBooks · 2022-01-01

    Takashi Kamachi, Yoyo Hinuma, Nobutsugu Hamamoto

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  4. Understanding and controlling the formation of surface anion vacancies for catalytic applications

    Catalysis Science & Technology · 2022-01-01

    Shinya Mine, Takashi Toyao, Yoyo Hinuma, Ken‐ichi Shimizu

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  5. Trends in Surface Oxygen Formation Energy in Perovskite Oxides

    ACS Omega · 2022-05-24

    Yoyo Hinuma, Shinya Mine, Takashi Toyao, Ken‐ichi Shimizu

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  6. Bond activation and formation on inorganic surfaces

    Elsevier eBooks · 2022-09-24

    Yuta Tsuji

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  7. Propane metathesis and hydrogenolysis over titanium hydride catalysts

    Catalysis Science & Technology · 2023-01-01

    Mengwen Huang, Yosuke Tomimuro, Shinta Miyazaki, Shinya Mine, Takashi Toyao, Yoyo Hinuma, Yasuharu Kanda, Masaaki Kitano, Ken‐ichi Shimizu, Zen Maeno

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  8. Prediction of Stable Surfaces of Metal Oxides through the Unsaturated Coordination Index

    ACS Omega · 2023-08-01

    Shunsaku Yasumura, Takashi Kamachi, Takashi Toyao, Ken‐ichi Shimizu, Yoyo Hinuma

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  9. Comparison of Matlantis and VASP Bulk Formation and Surface Energies in Metal Hydrides, Carbides, Nitrides, Oxides, and Sulfides

    Chemistry Letters · 2023-08-18

    Shinya Mine, Takashi Toyao, Ken‐ichi Shimizu, Yoyo Hinuma

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  10. Propane dehydrogenation catalysis of group IIIB and IVB metal hydrides

    RSC Advances · 2024-01-01

    Xiaoming Hu, Mengwen Huang, Tetsuya Kinjo, Shinya Mine, Takashi Toyao, Yoyo Hinuma, Masaaki Kitano, Toyoto Sato, Norikazu Namiki, Ken‐ichi Shimizu, Zen Maeno

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  11. Facilitating H migration on graphene by adsorbing on Au

    Computational and Theoretical Chemistry · 2024-06-14

    Yoyo Hinuma, Kohsuke Mori

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