Surefire618

PhD student at FHI

Fritz Haber Institute of the Max Planck SocietyBerlin

Pinned Repositories

binding
Language:Shell0 0 00
cgcnn
Crystal graph convolutional neural networks for predicting material properties.
Language:Python0 0 00
nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
Language:Python0 0 00
nequip-heatflux
Heat flux calculator for NequIP
Language:Python0 1 00
tdep
The Temperature Dependent Effective Potentials (TDEP) code
Language:Fortran72 8 7523

Surefire618's Repositories

Surefire618/binding
Language:Shell0 0 00
Surefire618/cgcnn
Crystal graph convolutional neural networks for predicting material properties.
Language:Python0 0 00
Surefire618/nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
Language:Python0 0 00
Surefire618/nequip-heatflux
Heat flux calculator for NequIP
Language:Python0 1 00