This file is automatically generated. It contains the descriptions of each uploaded file as provided by the user.

  • silica_Painn_model.zip: Neural network interatomic potential (PaiNN arXiv:2102.03150 ) for silica-water. Predicts energy and forces with units kcal/mol and Kcal/mol-Å respectively. Code for training and running MD simulations are found at https://github.com/learningmatter-mit/NeuralForceField
  • README.md: README