[P01-1am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

[P01-1am-08] Theoretical study of the methane activation on the surface of binary alloys with the combination of DFT calculation and chemoinformatics

^○Masataka Yoshida¹, Masashi Saito¹, Yuta Tsuji¹, Takashi Kamachi², Kazunari Yoshizawa¹ (1. Kyushu University, 2. Fukuoka Institute of Technology)

[Lang.] English

Keywords:Methane Activation, Oxidative Coupling of Methane, Surface of Binary Alloys, Density Functional Theory, Chemoinformatics