Computational chemistry/physics and software person. Mostly interested in materials and thermodynamics. I like Python, Emacs and SCIENCE
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ase-tutorial-symmetry
ase-tutorial-symmetry PublicTutorial notebook for symmetry features in ASE
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551 contributions in the last year
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Contribution activity
March 2024
Created 34 commits in 3 repositories
Opened 2 pull requests in 2 repositories
pace-neutrons/abins-tutorials
1
merged
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reference MACE papers
This contribution was made on Mar 15
mantidproject/mantid
1
open
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Abins validator: Allow phonopy.yaml with separate force constants
This contribution was made on Mar 14
Reviewed 1 pull request in 1 repository
mantidproject/mantid
1 pull request
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Abins: JSON data import
This contribution was made on Mar 11
6
contributions
in private repositories
Mar 4 – Mar 15