Jiayan Xu

DeePMD-kit v2: A software package for deep potential models

Jinzhe Zeng, Duo Zhang, Denghui Lu et al. · The Journal of Chemical Physics · 2023 · 453 citations · Full text

Engineering, Machine Learning, Molecular Biology +21

Thermal analysis of poly(vinyl alcohol)/graphite oxide intercalated composites

Jiayan Xu, Yuan Hu, Lei Song et al. · Polymer Degradation and Stability · 2001 · 99 citations

Materials Science, Engineering, Composite Technology +4

Flammability and thermal stability studies of styrene–butyl acrylate copolymer/graphite oxide nanocomposite

Rui Zhang, Yuan Hu, Jiayan Xu et al. · Polymer Degradation and Stability · 2004 · 75 citations

Materials Science, Chemical Engineering, Polymer Material +13

Achieving Theory–Experiment Parity for Activity and Selectivity in Heterogeneous Catalysis Using Microkinetic Modeling

Wenbo Xie, Jiayan Xu, Jianfu Chen et al. · Accounts of Chemical Research · 2022 · 75 citations · Full text

Chemical Engineering, Chemical Thermodynamics, Engineering +14

Perspective on computational reaction prediction using machine learning methods in heterogeneous catalysis

Jiayan Xu, Xiaoming Cao, P. Hu · Physical Chemistry Chemical Physics · 2021 · 73 citations