The 103rd CSJ Annual Meeting

Presentation information

Academic Program [Poster]

02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry » Poster

[P1-2am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Thu. Mar 23, 2023 9:40 AM - 11:10 AM Poster Site (Morito Memorial Gymnasium)

[P1-2am-29] A theoretical study on orbital levels of polymers for organic photovoltaic semiconductors using long-range corrected density functional theory

Shingo Harada1, Toru Matsui2 (1. School of Science and Engineering, University of Tsukuba, 2. Degree Programs in Pure and Applied Sciences, University of Tsukuba )

[Lang.] Japanese

Keywords:organic photovoltaic semiconductor, density functional theory, long-range correction