Research field (3):
Computational science
, Structural/physical organic chemistry
, Basic physical chemistry
Research theme for competitive and other funds (22):
2017 - 2020 Elucidation of lubrication phenomena involving additives by multiscale simulations and QCM measurements
2007 - 2009 Spontaneous and Perpetual Development of a New Quantum-Chemistry Data Base System
2004 - 2006 Development of continually viable quantum chemistry literature date base
2004 - 2004 電子状態理論と統計理論の融合による柔らかい分子系の理論化学
2001 - 2003 Development of New Quantum Chemistry Literature Database System
1999 - 2001 Theoretical Studies on Controlling of Chemical Reactions Catalyzod by Transidon Metal Complexes
1998 - 2001 Electronic Structures of Assembled Transition Metal Complexes
1998 - 2000 Development of the Quantum Chemistry Literature Data Base System for Internet
1997 - 1999 New Electronic Structure of Quasi-One-Dimensional Halogen-Bridged Ni(III) Complexes with Strong Electron Correlations
1998 - 1998 遷移金属錯体での炭素結合形成反応の理論的研究
1997 - 1998 Simulation of Selective Chemical Reactions and Theoretical Elucidation of their Mechanisms.
1997 - 1998 時間分解ZEKE光電子分光法による分子振動波束の直接観測の理論
1997 - 1997 異核遷移金属錯体による炭素結合形成反応の理論的研究
1995 - 1996 REACTION FIELD CREATED BY METAL COMPLEXES
1995 - 1995 希土類錯体の化学反応のポテンシャル面の非経験的分子軌道計算
1992 - 1995 Electronic Structure theories for Chemical Reactions
1994 - 1994 希土類錯体の化学反応のポテンシャル面の非経験的分子軌道計算
1992 - 1992 Theoretical Study on Chemical Reaction Transition State
1990 - 1992 Molecular Theory of Electronic Structure Design and Control of Reactions and Its Application
1990 - 1990 ヘテロ有機化合物の素反応と有機求核付加反応の理論設計
1989 - 1989 ヘテロ有機化合物の構造と反応性の理論設計
1987 - 1987 物質科学及び化学反応論の実験的・理論的研究
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Papers (215):
Satoru Iuchi, Nobuaki Koga. Ultrafast Electronic Relaxation in Aqueous [Fe(bpy)3]2+: A Surface Hopping Study. The Journal of Physical Chemistry Letters. 2023. 14. 18. 4225-4232
Seanghai Hor, Kin-ichi Oyama, Nobuaki Koga, Masaki Tsukamoto. Synthesis and characterization of methoxybenzene-linked polyimides formed by 1,4-addition to bismaleimides. Polymer. 2021. 124326-124326
Seanghai Hor, Kin-ichi Oyama, Nobuaki Koga, Masaki Tsukamoto. Brønsted acid-catalyzed 1,4-addition of 1,3,5-trimethoxybenzene to maleimides and acrylates. Tetrahedron Letters. 2021. 153100-153100
Satoru Iuchi, Nobuaki Koga. A model electronic Hamiltonian to describe low-lying d-d and metal-to-ligand charge-transfer excited states of [Fe(bpy) 3 ] 2+. Journal of Computational Chemistry. 2021. 42. 3. 166-179