Published December 3, 2016
| Version v4.5.3
Software
Open
materialsproject/pymatgen: v4.5.3
Authors/Creators
- Shyue Ping Ong1
- gmatteo
- Michiel van Setten2
- Will Richards
- Xiaohui Qu
- Geoffroy Hautier
- Anubhav Jain3
- Stephen Dacek
- Bharat Medasani4
- cedergroupclusters
- Kiran Mathew3
- Richard Tran
- Joseph Montoya
- Michael
- Sai Jayaraman
- Shyam Dwaraknath5
- Germain Salvato Vallverdu6
- yanikou19
- Guido Petretto
- Dan Gunter5
- Saurabh Bajaj7
- Bruno Rousseau
- Nils Zimmermann7
- ndardenne
- Miao Liu8
- Muratahan Aykol5
- Zihan XU
- Nav Nidhi Rajput5
- zacharygibbs
- Patrick Huck7
- 1. Materials Virtual Lab
- 2. UCLouvain
- 3. Lawrence Berkeley Lab
- 4. Lawrence Berkeley National Lab
- 5. LBNL
- 6. Université de Pau et des Pays de l'Adour, IPREM
- 7. Lawrence Berkeley National Laboratory
- 8. LBL
Description
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
Files
materialsproject/pymatgen-v4.5.3.zip
Files
(104.9 MB)
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md5:565bf077c4660893a173cfcab2764bdc
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Additional details
Related works
- Is supplement to
- https://github.com/materialsproject/pymatgen/tree/v4.5.3 (URL)