GitHub - pyiron/vaspparser: Parser for the Vienna Ab initio Simulation Package (VASP)

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CODE_OF_CONDUCT.md		CODE_OF_CONDUCT.md
LICENSE		LICENSE
MANIFEST.in		MANIFEST.in
README.md		README.md
pyproject.toml		pyproject.toml

Parser for the Vienna Ab initio Simulation Package (VASP)

Via pip

pip install vaspparser

Via conda

conda install -c conda-forge vaspparser

Parse an directory with VASP output files

from vaspparser.vasp.output import parse_vasp_output

output_dict = parse_vasp_output(working_directory="path/to/calculation")

Parser for the Vienna Ab initio Simulation Package (VASP)

vaspparser-0.0.2 Latest

Mar 27, 2026