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

10:00 AM - 11:30 AM JST(1:00 AM - 2:30 AM UTC)Japanese

[[PA]-2am-08] Construction of an interpretable data assimilation framework for predicting band gaps in perovskite photocatalyst compounds

○Shuan Shinkawa¹, Yousuke Harashima^1,2, Tomoaki Takayama^1,2, Shogo Takasuka¹, Hiroki Kotaka⁴, Hiroki Iriguchi⁴, Mikiya Fujii^1,2,3 (1. NAIST, 2. NAIST DSC, 3. NAIST CMP, 4. ENEOS Corporation)

Keywords:

Materials informatics,Machine learning,Photocatalysis,Data assimilation,Symbolic regression