vasprun

Utility/library to process vasprun.xml, possibly more.

Environment
- Console
Intended Audience
- Science/Research
License
- OSI Approved :: MIT License
Operating System
- OS Independent
Programming Language
- Python
Topic
- Scientific/Engineering

Project description

A few routines and an executable to convert the XML file output by the The Vienna Ab initio simulation package (VASP) to a json dictionary with specific entries permitting analysis and plotting of density of states (DoS) and band-structure.

Project details

Environment
- Console
Intended Audience
- Science/Research
License
- OSI Approved :: MIT License
Operating System
- OS Independent
Programming Language
- Python
Topic
- Scientific/Engineering

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This version

0.1.0

Jan 14, 2019

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Source Distribution

vasprun-0.1.0.tar.gz (721.9 kB view hashes)

Uploaded Jan 14, 2019 source

Built Distribution

vasprun-0.1.0-py3-none-any.whl (7.4 kB view hashes)

Uploaded Jan 14, 2019 py3

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