982 citations · 2k across the 5 of their papers we have counts for
Showing 2019Show all
2 papers · 1 filter
physics.chem-ph2019★ 310 cited
Neural Network Based in Silico Simulation of Combustion Reactions
Jinzhe Zeng, Liqun Cao, Mingyuan Xu +2
Understanding and prediction of the chemical reactions are fundamental demanding in the study of many complex chemical systems. Reactive molecular dynamics (MD) simulation has been…
physics.comp-ph2019★ 982 cited
DP-GEN: A concurrent learning platform for the generation of reliable deep learning based potential energy models
Yuzhi Zhang, Haidi Wang, Weijie Chen +4
In recent years, promising deep learning based interatomic potential energy surface (PES) models have been proposed that can potentially allow us to perform molecular dynamics simu…