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Published March 10, 2023 | Version v2023.3.10
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Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis

Authors/Creators

Description

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials Project.

Notes

If you use pymatgen in your research, please consider citing the following: In addition, some of pymatgen's functionality is based on scientific advances / principles developed by the computational materials scientists in our team. Please refer to pymatgen's docs at http://pymatgen.org on how to cite them.

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materialsproject/pymatgen-v2023.3.10.zip

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Additional details

Related works

Is supplement to
https://github.com/materialsproject/pymatgen/tree/v2023.3.10 (URL)