[P2-3pm] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Japanese

[P2-3pm-30] Machine-Learning for Analyzing Relationship between HOMO Levels and Functional Groups in Aromatics and Its Application to Design of Redox Potentials of Conductive Polymers

○Yokuto Haze¹, Tomoaki Takayama^1,2, Shogo Takasuka¹, Yosuke Harashima^1,2, Mikiya Fujii^1,2,3 (1. Nara Institute of Science and Technology, 2. DSC, Nara Institute of Science and Technology, 3. CMP, Nara Institute of Science and Technology)

Keywords:

Machine Learning,Deep Learning,Materials Informatics,Conductive Polymers,Photocatalysts