NQCDynamics.jl friction connector for molecular dynamics with electronic friction
This package supports the following models:
- Full tensorial models based on orbital dependent friction (ODF):
- ACEds.jl: ACE-based ODF models
- SchNet-based ODF models
- Local density friction approximation (LDFA)-based density models:
- Density cube files
- ACEpotentials.jl-based density models
- scikit-learn-based models