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A collective of tools for the preparation of input files for ZACROS

Project description

ZacrosTools

ZacrosTools is a versatile toolkit designed to simplify the preparation of Zacros input files and the reading of Zacros output files. It is especially useful for performing pressure and temperature scans, which often require the generation of numerous input files and the processing of extensive output data.

Changelog

You can view the full list of changes in CHANGELOG.md.

Installation

The easiest way to install ZacrosTools is by using pip:

$ pip install zacrostools

Alternatively, it can also be cloned from GitHub:

$ git clone https://github.com/hprats/ZacrosTools.git

The only requirements are scipy and pandas.

How to Use

For detailed usage instructions, please visit the ZacrosTools Documentation.

Contributors

Hector Prats

Project details


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Source Distribution

zacrostools-1.1.tar.gz (23.8 kB view hashes)

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