Takao Tsuneda, Tetsuya Taketsugu. Roles of Singlet Fission in the Photosensitization of Silicon Phthalocyanine. Journal of Physical Chemistry Letters. 2023. 14. 11587-11596
Masatoshi Hasebe, Takuro Tsutsumi, Tetsuya Taketsugu, Takao Tsuneda. Total and orbital density-based analyses of molecules revealing long-range interaction regions. Journal of Computational Chemistry. 2023. 44. 2391-2403
常田 貴夫. 量子化学計算の現在と未来. 化学と教育. 2023. 71. 5. 200-203
Takao Tsuneda. Reconsideration of chemical indices in conceptual density functional theory. Theoretical Chemistry Accounts (Chattaraj Festschrift). 2023. 142. 26. 1-9
On the fly excited state molecular dynamics study based on spin flip TDDFT approach: photoisomerization of stilbene and stilbene derivatives
Time-Dependent Density Functional Theory: Nonadiabatic Molecular Dynamics (Jenny Stanford Publishing) 2022
化学便覧 基礎編 改訂6版
丸善出版 2020
Time-Dependent Density Functional Theory
Apple Academic Press 2018
Density Functional Theory in Quantum Chemistry
Springer 2014
Reaction analysis based on orbital energies: An advanced reaction orbital theory
(The International Summer workshop 2018 on First-Principles Electronic Structure Calculations in ISSP (ISS2018) 2018)
