Shin Kiyohara, Yoyo Hinuma, Fumiyasu Oba. Band Alignment of Oxides by Learnable Structural-Descriptor-Aided Neural Network and Transfer Learning. Journal of the American Chemical Society. 2024. 146. 14. 9697-9708
Kohei Tada, Yoyo Hinuma, Satoshi Ichikawa, Shingo Tanaka. Investigation of the Interaction Between Au and Brookite TiO2 Using Transmission Electron Microscopy and Density Functional Theory. Bulletin of the Chemical Society of Japan. 2023. 96. 4. 373-380
Kohei Tada, Takashi Kawakami, Yoyo Hinuma. Model calculations for the prediction of the diradical character of physisorbed molecules: p-benzyne/MgO and p-benzyne/SrO. Physical Chemistry Chemical Physics. 2023
Yoyo Hinuma, Shinya Mine, Takashi Toyao, Ken-ichi Shimizu. Trends in Surface Oxygen Formation Energy in Perovskite Oxides. ACS Omega. 2022. 7. 22. 18427-18433
Shinya Mine, Takashi Toyao, Yoyo Hinuma, Ken Ichi Shimizu. Understanding and controlling the formation of surface anion vacancies for catalytic applications. Catalysis Science and Technology. 2022