9 projects
equiformer-v2
Equiformer v2
equiformer-v3
Equiformer v3
hienet
A machine learning potential energy project HIENet from AIRS
msc-alphanet
AlphaNet: A Local Frame-based Atomistic Potential
eqnorm
A machine learning potential energy project eqnorm
matris
MatRIS model
EquFlash
GGNN: EquFlashV2
myplots
Lightweight plotting utilities for consistent well-readable matplotlib figures
moltensaltcalc
Molten salt simulation package employing universal machine-learned interatomic potentials (uMLIPs)
