VASP - Vienna Ab initio Simulation Package

The Vienna Ab initio Simulation Package: atomic scale materials modelling from first principles.

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VASP Wiki

The user manual of VASP

Documentation of input and output

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py4vasp

Python tool to interface with VASP

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Latest News

May 11, 2022

Online VASP workshop: Moving ions with VASP

Interested in learning VASP?
Apply for this online workshop (dates: September 27 - 30, 2022)! We will focus on the ionic degrees of freedom.

May 5, 2022

NEW RELEASE: VASP.6.3.1

A new release of VASP, version 6.3.1, is available for download now.

February 17, 2022

py4vasp available via PyPI

Check our new tool to make your research with VASP even easier. With the post-processing package py4vasp, you get easy access to the data of your calculation using Python scripts.

January 20, 2022

NEW RELEASE: VASP.6.3.0

A new release of VASP, version 6.3.0, is available for download now.