nix-packages

This is a collection of nix packages I curate for myself.

Packages

• fhiaims
• runner
• kim-api
• mrcpp
• xcfun
• mrchem
• rmsd-finder
• lammps with openkim support
• sirius (Has been merged into nixpkgs)
• umpire (Has been merged into nixpkgs)

Python Packages

• sqnm
• ase-mh
• kimpy
• sirius
• sirius-python-interface
• torch-nl
• alpaca-py
• pyFAI