Pinned Repositories
binding
cgcnn
Crystal graph convolutional neural networks for predicting material properties.
nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
tdep
The Temperature Dependent Effective Potentials (TDEP) code
tdep-tutorials
TDEP Tutorials
Surefire618's Repositories
Surefire618/binding
Surefire618/cgcnn
Crystal graph convolutional neural networks for predicting material properties.
Surefire618/nequip
NequIP is a code for building E(3)-equivariant interatomic potentials