[EC] Environmental catalysis

[EC-12] Prediction of Active-Site Structure and Catalytic Activity for Methane Combustion Using Neural Network Potential

*Shiho Sakuma¹, Shunsaku Yasumura¹, Kenichiro Saita², Tetsuya Taketsugu³, Masaru Ogura¹ (1. The University of Tokyo (Japan), 2. Yokohama City University (Japan), 3. Hokkaido University (Japan))

Keywords:

Methane combustion,Pd-exchanged zeolite,Neural network potential