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• Physically Motivated Recursively Embedded Atom Neural Networks: Incorporating Local Completeness and Nonlocality
  2021 · 95 citations
• Symmetry-Adapted High Dimensional Neural Network Representation of Electronic Friction Tensor of Adsorbates on Metals
  2019
• Accelerating Atomistic Simulations with Piecewise Machine Learned Ab Initio Potentials at Classical Force Field-like Cost
  2020
• Learning Dipole Moments and Polarizabilities
  2021
• REANN: A PyTorch-based End-to-End Multi-functional Deep Neural Network Package for Molecular, Reactive and Periodic Systems
  2021