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GitHub / materialsvirtuallab / pymatgen-analysis-diffusion

This add-on to pymatgen provides tools for analyzing diffusion in materials.

JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/materialsvirtuallab%2Fpymatgen-analysis-diffusion

Stars: 76
Forks: 52
Open Issues: 10

License: bsd-3-clause
Language: Python
Repo Size: 21.8 MB
Dependencies: 19

Created: over 8 years ago
Updated: 26 days ago
Last pushed: 26 days ago
Last synced: 25 days ago

Commit Stats

Commits: 781
Authors: 23
Mean commits per author: 33.96
Development Distribution Score: 0.773
More commit stats: https://commits.ecosyste.ms/hosts/GitHub/repositories/materialsvirtuallab/pymatgen-analysis-diffusion

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Dependencies

requirements-ci.txt pypi

black *
coveralls ==3.3.1
flake8 *
maggma ==0.47.3
mypy *
pydocstyle *
pylint *
pytest ==7.1.2
pytest-cov ==3.0.0
treon ==0.1.4

requirements.txt pypi

ase ==3.22.1
joblib ==1.1.0
pymatgen ==2022.7.25

setup.py pypi

pymatgen >=2022.0.3

.github/workflows/linting.yml actions

actions/checkout v2 composite
actions/setup-python v2 composite

.github/workflows/testing.yml actions

AndreMiras/coveralls-python-action v20201129 composite
actions/checkout v2 composite
actions/setup-python v2 composite