[P1-1am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Japanese

[P1-1am-12] Development of FMO-CDFT method by Integrating FMO method and Constrained Density Functional Theory

○Shohei Osaki¹, Masato Kobayashi², Tetsuya Taketsugu², Toru Matsui¹ (1. Univ. of Tsukuba, 2. Univ. of Hokkaido)

Keywords:

Constrained Density Functional Theory,Fragment Molecular Orbital Theory