8 projects
lobsterpy
Package for automatic bonding analysis with Lobster/VASP
Euphonic
Euphonic calculates phonon bandstructures and inelastic neutron scattering intensities from modelling code output (e.g. CASTEP)
sumo
Heavy weight plotting tools for ab initio solid-state calculations
resins
Python library for working with resolution functions of neutron instruments
namedtuple-table
Simple indexable tables using NamedTuple
inline-reference
Sphinx extension for creating cross-reference links to arbitrary inline text
galore
Broadening and weighting for simulated spectra
kgrid
Reciprocal space sampling for atomistic crystal structures