Published March 18, 2016
| Version v3.3.6
Software
Open
pymatgen: v3.3.6
Authors/Creators
- Shyue Ping Ong1
- Michiel van Setten2
- gmatteo
- Will Richards
- Geoffroy Hautier
- Xiaohui Qu
- Stephen Dacek
- Bharat Medasani3
- cedergroupclusters
- Anubhav Jain4
- Richard Tran
- Michael
- Sai Jayaraman
- Joseph Montoya
- yanikou19
- Germain Salvato Vallverdu5
- Dan Gunter6
- Guido Petretto
- Bruno Rousseau
- ndardenne
- Miao Liu7
- Nav Nidhi Rajput6
- shyamd
- zacharygibbs
- Zihan XU
- Patrick Huck8
- Nils Zimmermann8
- Xin Chen
- wenhaosun
- maartendft
- 1. Materials Virtual Lab
- 2. UCLouvain
- 3. Lawrence Berkeley National Lab
- 4. Lawrence Berkeley Lab
- 5. Université de Pau et des Pays de l'Adour, IPREM, Équipe de Chimie Physique
- 6. LBNL
- 7. LBL
- 8. Lawrence Berkeley National Laboratory
Description
- Update to use enum.x instead of multienum.x.
- Minor robustness fixes to VaspInputSet serialization.
- Add a reciprocal density parameter to vasp sets.
- Minor bug fixes to Vasprun parsing.
Files
pymatgen-v3.3.6.zip
Files
(56.6 MB)
| Name | Size | Download all |
|---|---|---|
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md5:5c2784de5dc4efbdf027393f92207534
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56.6 MB | Preview Download |
Additional details
Related works
- Is supplement to
- https://github.com/materialsproject/pymatgen/tree/v3.3.6 (URL)