2018 The Chemical Society of Japan

Presentation information

Academic Program (AP)

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Wed. Mar 21, 2018 9:00 AM - 12:20 PM E2 (1012, Bldg. 10)

2E2-01~2E2-05 KAWAI, Shinnosuke
2E2-08~2E2-13 YAMAMOTO, Norifumi
2E2-15~2E2-20 KISHI, Ryohei

AM

10:40 AM - 10:50 AM

[2E2-11] Constrained DFT calculation and analysis of electronic coupling of donor-bridge-acceptor molecules.

01.Oral A

○YOSHIMOTO, Mika; NAKANO, Hiroshi; SATO, Hirofumi (Sch. Eng., Kyoto Univ.)

PC Setting Time : 10:00 - 10:10

Keywords:Electron Transfer、Electronic Coupling、Constrained DFT