TSUCHIYA Akira | INAMORI Frontier Research Center, Kyushu University
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概要
INAMORI Frontier Research Center, Kyushu University | 論文
- Optimized Molecular Exponents on Gaussian Basis Sets for Hybrid Orbitals of Hydrocarbon Molecules
- Systematic Improvement of Energy-Components by Simultaneous Optimization of Exponents and Centers of Gaussian-Type Function Basis Sets for Molecular Self-Consistent-Field Wave Functions
- Systematic Improvement of Energy-Components by Simultaneous Optimization of Exponents and Centers of Gaussian-Type Function Basis Sets for Molecular Self-Consistent-Field Wave Functions
- Theoretical investigation on counter ion directed asymmetric gold catalyzed hydroamination: reaction mechanism and origin of enantioselectivity (第103回触媒討論会B講演予稿 資源有効利用のための触媒化学)
- Adsorption of atomic hydrogen on A-Al2O3 by hydrogen spillover: a quantum chemical molecular dynamics study (第104回触媒討論会B講演予稿)