The 99th CSJ Annual Meeting

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Academic Program (AP)

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Sun. Mar 17, 2019 1:10 PM - 5:20 PM D6 (336, Bldg. 3 [3F])

2D6-26～2D6-31　HARUTA, Naoki
2D6-33～2D6-36　SUGIMOTO, Manabu
2D6-39～2D6-42　SUGISAKI, Kenji
2D6-45～2D6-49　OKUMURA, Mitutaka

PM

2:00 PM - 2:10 PM

[2D6-31] Development of a hybrid solvation model based on CASSCF wave function

Oral A

○YOSHIKAWA, Ayaka; SAITOW, Masaaki; YANAI, Takeshi (Sch. Sci., Nagoya Univ.)

PC Setting Time : 13:00 - 13:10

Keywords:solution、quantum chemistry、solvent effect、electronic structure、computational chemistry

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