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VASPMO aims at visualizing wavefunctions (or molecular orbitals) from VASP calculations. It reads VASP's output files PROCAR and CONTCAR, and exports an Alternatively, the k-point density can be set in the INCAR file with these flags as described in the VASP manual. If kspacing is set, the ASE calculator willThe VASP software is documented on the VASP Wiki. In case you cannot access the VASP Wiki, you can refer to the retired Online VASP manual or its pdf copy. The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling, e.g. electronic File:Vasp Manual.pdf. The VASP manual: cms.mpi.univie.ac.at/vasp/vasp/vasp.html. Index: cms.mpi.univie.ac.at/vasp/vasp/Index.html. • The VASP wiki: The VASP manual (cms.mpi.univie.ac.at/vasp/vasp/vasp.html) INCAR-tags: cms.mpi.univie.ac.at/wiki/index.php/Category:INCAR pip install vaspwiki==1.1.1. The VASP manual. Source. Among fairly niche packages on PyPI. Over 104 downloads in the last 90 days.