Presentation Information

[A-122P]Theoretical Elucidation of Ethane Hydrogenolysis Mechanism Based on Free Energy Landscape

○Kenshin Takei1, Tatsushi Ikeda1, Akira Nakayama1 (1. Department of Chemical System Engineering, Graduate School of Engineering, The University of Tokyo)

Keywords:

Hydrogenolysis,Free energy landscape,Machine learning potential