Published March 2, 2020
| Version v2020.3.2
Software
Open
materialsproject/pymatgen: v2020.3.2
Authors/Creators
- Shyue Ping Ong1
- gmatteo
- Michiel van Setten2
- Will Richards
- Matthew Horton3
- Joseph Montoya
- Anubhav Jain4
- Xiaohui Qu
- Richard Tran
- Samuel M. Blau5
- Danny Broberg
- David Waroquiers
- Kiran Mathew4
- Geoffroy Hautier
- Shyam Dwaraknath6
- Stephen Dacek
- Bharat Medasani7
- cedergroupclusters
- Nils Zimmermann8
- J. George9
- Evan Spotte-Smith8
- fraricci
- Ryan Kingsbury10
- Alex Ganose11
- Michael
- Sai Jayaraman
- Zhi Deng
- Guido Petretto
- Germain Salvato Vallverdu12
- 1. Materials Virtual Lab
- 2. UCLouvain
- 3. LBNL, UC Berkeley
- 4. Lawrence Berkeley Lab
- 5. Lawrence Berkeley National Lab
- 6. LBNL
- 7. Delaware Energy Institute
- 8. Lawrence Berkeley National Laboratory
- 9. Université catholique de Louvain
- 10. The Materials Project, Lawrence Berkeley Natonal Laboratory
- 11. @hackingmaterials
- 12. Université de Pau et des Pays de l'Adour, IPREM
Description
- New MonteCarloRattleTransformation and phonopy integration (@utf)
- New structure connectivity features in Chemenv analysis (@davidwaroquiers)
- Bug fixes (@richardtran415, @chc273, @JaGeo, @dskoda, @rkingsbury, @jmmshn, @espottesmith, @gVallverdu, @yimingchen95, @fraricci)
Files
materialsproject/pymatgen-v2020.3.2.zip
Files
(211.3 MB)
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Additional details
Related works
- Is supplement to
- https://github.com/materialsproject/pymatgen/tree/v2020.3.2 (URL)