8. Ai Koizumi, Ryo Tamura, and Wen-Tong Geng*,
"Grain-Boundary-Induced Fe2CrNi-like Ordering in Austenitic Stainless Steels Revealed by DFT-Based Ising Optimization",
J. Appl. Phys. 2026, 140, 125302. DOI
7. Ai Koizumi*, Tomofumi Tada*, and Ryo Tamura*,
"Kinetic Monte Carlo–Ising Machine Optimization for Atomistic Inverse Design of Solid Electrolytes",
J. Phys. Chem. Lett. 2026, 17 (37), 10758–10762. DOI
*本論文はThe Journal of Physical Chemistry LettersのSupplementary Coverに選ばれました。
6. Ai Koizumi, Mariia Ivonina, Ryo Tamura*, and Tomofumi Tada*,
"Linking Microscopic Structures to Ionic Currents in Solid Electrolytes via Kinetic Monte Carlo and Regression Analysis",
J. Phys. Chem. C 130, 10, 3897–3908 (2026). DOI
*本論文はThe Journal of Physical Chemistry CのSupplementary Coverに選ばれました。
5. Takahiro Misawa*, Ai Koizumi, Ryo Tamura, and Kazuyoshi Yoshimi*,
"Exploring utilization of generative AI for research and education in data-driven materials science",
Science and Technology of Advanced Materials: Methods 5, 1, 2535956-1-9 (2025). DOI
4. Jianbo Lin*, Tomofumi Tada*, Ai Koizumi, Masato Sumita, Koji Tsuda, and Ryo Tamura*,
"Determination of Stable Proton Configurations by Black-Box Optimization Using an Ising Machine",
J. Phys. Chem. C 129, 5, 2332–2340 (2025). DOI
3. Ai Koizumi*, Guillaume Deffrennes, Kei Terayama*, and Ryo Tamura*,
"Performance of uncertainty-based active learning for efficient approximation of black-box functions in materials science",
Scientific Reports 14, 27019-1-10 (2024). DOI
2. Akihiro Morita*, Ai Koizumi, Tomonori Hirano,
"Recent Progress in Simulating Microscopic Ion Transport Mechanisms at Liquid-Liquid Interfaces",
J. Chem. Phys. 154, 8, 080901-1-9 (2021). DOI
1. Ai Koizumi, Hirofumi Tahara, Tomonori Hirano, Akihiro Morita*,
"Revealing Transient Shuttling Mechanism of Catalytic Ion Transport through Liquid-Liquid Interface",
J. Phys. Chem. Lett. 11, 4, 1584-1588 (2020). DOI