Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
Efficient Dynamic Computational Strategy for Heterogeneous Catalysis Based on Neural Network Potential Energy Surface: A Case Study of Temperature-Dependent Thermodynamics and Kinetics for the Chemisorbed on-surface CO
, Authors:
Jun Chen, Tan Jin, Tonghao Shen, Mingjun Yang, Zhe-Ning Chen
Version 1 posted 01 October 2021
258
Downloads