Downloads in the 30 and 7 days to October 10, 2026. Refreshed weekly.
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No reported malware or high/critical advisories · Details
The current version has no OSV.dev malware reports and no critical or high-severity vulnerabilities.
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Dependencies
- abipy ==0.9.6
- aiida-abinit ~=0.4.0
- aiida-ase
- aiida-bigdft >=0.2.6
- aiida-castep >=1.2.0a5
- aiida-core ~=1.6
- aiida-cp2k ~=1.6
- aiida-fleur >=1.3.0
- aiida-gaussian
- aiida-nwchem >=2.1.0
- aiida-orca
- aiida-pseudo ==0.6.5
- aiida-quantumespresso >=3.4.1,~=3.4
- aiida-siesta >=1.2.0
- aiida-vasp ~=2.2
- aiida-wien2k ~=0.1.1
- ase !=3.20.*
- masci-tools ~=0.9
- numpy <1.24.0
- pint ~=0.16
- pymatgen >=2022.1.20
- sqlalchemy <1.4
12 optional dependencies
-
docutils~=0.15.2[docs]extra == "docs"
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pgtest>=1.3.1,~=1.3[tests]extra == "tests"
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pre-commit~=2.2[pre-commit]extra == "pre-commit"
-
pydata-sphinx-theme~=0.4.0[docs]extra == "docs"
-
pygments~=2.5[docs]extra == "docs"
-
pylint~=2.5.2[pre-commit]extra == "pre-commit"
-
pytest~=7.2[tests]extra == "tests"
-
pytest-regressions~=1.0[tests]extra == "tests"
-
sphinx~=3.2[docs]extra == "docs"
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sphinx-copybutton~=0.3.0[docs]extra == "docs"
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sphinx-panels~=0.5.0[docs]extra == "docs"
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sphinxcontrib-details-directive~=0.1.0[docs]extra == "docs"