pyiron_vasp
Parser for the Vienna Ab initio Simulation Package (VASP)
Installation
Via pip
pip install pyiron_vasp
Via conda
conda install -c conda-forge pyiron_vasp
Usage
Parse an directory with VASP output files
from pyiron_vasp.vasp.output import parse_vasp_output
output_dict = parse_vasp_output(working_directory="path/to/calculation")
2 maintainers
Metadata
2 maintainers
Release files for pyiron-vasp 0.2.19
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Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| pyiron_vasp-0.2.19.tar.gz | 38.9 kB | With provenance | Details for pyiron_vasp-0.2.19.tar.gz |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Actions Reset |
|---|---|---|---|---|
| pyiron_vasp-0.2.19-py3-none-any.whl | Python 3 | none | any | Details for pyiron_vasp-0.2.19-py3-none-any.whl |
Total release size: 87.5 kB
Release files / pyiron_vasp-0.2.19.tar.gz
| Download URL | pyiron_vasp-0.2.19.tar.gz |
|---|---|
| Size | 38.9 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
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Transparency logRelease files / pyiron_vasp-0.2.19-py3-none-any.whl
| Download URL | pyiron_vasp-0.2.19-py3-none-any.whl |
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| Size | 48.5 kB |
| Tags | Python 3 |
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SHA-256 checksum How to use checksums |
0d01b17c90fe65cbc7fe433ee6ac74e556d9fc9c638ef039c190c2a0e2a18bc3
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Yes |
| Uploaded via |
twine/6.1.0 CPython/3.13.7
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Provenance
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Transparency logSecurity for pyiron-vasp 0.2.19
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Signed by GitHub Actions, verified by PyPI on Jan 25, 2026.
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