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vasputils

Pre-and-Post processing tools for Vienna Ab initio Simulation Package (VASP)

Table of Contents

Requirements

vasputils requires the following to run:

  • python 2.7
  • numpy

Installation

pip install git+git://github.com/akiraakaishi/vasputils.git

Usage

chg_split ./CHG
vasprun dos
vasprun --file somewhere/vasprun.xml eigenval --energy=-3.0:3.0

License

vasputils is licensed under the MIT license.
Copyright © 2016, Akira Akaishi

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Utility tools for pre/post processing for VASP(Vienna Ab initio Simulation Package)

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