Shibaura Institute of Technology · Faculty of Engineering, Materials Chemistry Program, Chemistry and Life Engineering Course · 教授

Research keywordsconfiguration interaction singles・state-averaged CIS・conical intersections・excited-state electronic structure・bootstrap embedding・variational quantum eigensolver・dynamical correlation・orbital relaxation

Research fields基礎物理化学・生物物理、化学物理、ソフトマターの物理

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• Leveraging Configuration Interaction Singles for Qualitative Descriptions of Ground and Excited States: State-Averaging, Linear-Response, and Spin-Projection2026 · Journal of Chemical Theory and Computation
• Analytical Nuclear Gradients for State-Averaged Configuration Interaction Singles Variants: Application to Conical Intersections2026 · Journal of Chemical Theory and Computation
• Quantitative Analysis of a Large-Scale Microstructural Reconstruction of a Ni-YSZ Solid Oxide Fuel Cell Anode2025 · Journal of Physics: Conference Series
• QuEmb: A Toolbox for Bootstrap Embedding Calculations of Molecular and Periodic Systems2025 · JOURNAL OF PHYSICAL CHEMISTRY A

• 縮退化学領域を開拓する新たな量子化学計算スキームの創出と応用2025 · 科学研究費助成事業
• スピン射影と密度汎関数理論のハイブリッドと縮退系化学への応用2025 · 科学研究費助成事業
• 未踏化学を拓く革新的エンタングルメント量子計算2024 · 創発的研究支援事業
• 多様な電子状態計算を実現する包括的量子アルゴリズムの開発2020 · さきがけ

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