5 projects
aseview
A molecular viewer for ASE (Atomic Simulation Environment) data
cvve
Read, write, and analyze cube, CHGCAR, and PARCHG volumetric grids with explicit units.
miraeping
Slack DM notifications for SGE jobs and Python computations
randatoms
A random atoms package for atomistic scientists: easily generate, filter, and manage atomic datasets.
aimDIAS
SUPER FAST D/I analysis with aimnet2