6 projects
molcas-suite
A package for dealing with OpenMOLCAS input and output files
angmom-suite
A package for working with phenomenological spin and angular momentum operators
orca-suite
A package for working with ORCA input and output files
spin-phonon-suite
A package for performing spin-phonon coupling calculations with openMOLCAS, VASP, and Gaussian
gaussian-suite
A package for working with Gaussian input and output files
hpc-suite
A package for working with data on HPC platforms
