[TH2] Theory and computation in catalysis

12:00 PM - 12:40 PM JST(3:00 AM - 3:40 AM UTC)

[TH2-01] Heterogeneity and Dynamics in Catalysis

*Philippe Sautet^1,2 (1. Chemical and Biomolecular Engineering dep., University of California Los Angeles (USA), 2. Chemistry and Biochemistry dep., University of California Los Angeles (USA))

Keywords:

atomistic modeling,metastable active sites,dynamical behavior