DeePMD-kit
Deep learning package for many-body potential energy representation and molecular dynamics
Deep Potential
General Representation of a Many-Body Potential Energy Surface
Reinforced Dynamics
Enhanced sampling in large atomic and molecular systems

LATEST RELEASE

DATA FILES

Recent news & events

Recent news & events

  • We Released the newest data files here , containing Al2O3, Cu, Ge, HEA, MoS2_Pt, pyridine, Si, TiO2. 10.24.2018 
  • The smooth version of Deep Potential (DeepPot-SE) has been released! Please see arXiv: 1805.09003 for more details!