Published June 4, 2013
| Version 2022.1.24
Software
Open
Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis
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.
Files
materialsproject/pymatgen-v2023.1.30.zip
Files
(318.3 MB)
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md5:ff45f7292ae51547f56cd9e7e3ea4456
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Additional details
Related works
- Is supplement to
- https://github.com/materialsproject/pymatgen/tree/v2023.1.30 (URL)