aiida-wannier90-workflows

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2.2.0 aiida_wannier90_workflows-2.2.0-py3-none-any.whl

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Project: aiida-wannier90-workflows
Version: 2.2.0
Filename: aiida_wannier90_workflows-2.2.0-py3-none-any.whl
Download: [link]
Size: 163780
MD5: a4cee48b0d6845d603d746b409ea2e62
SHA256: aee53e34e8080d73afcb0ca240bdd9a2e30f2a3e3590f0c61a1d4d673898283d
Uploaded: 2023-11-23 18:05:40 +0000

dist-info

METADATA

Metadata-Version: 2.1
Name: aiida-wannier90-workflows
Version: 2.2.0
Summary: Advanced AiiDA workflows for Wannier90
Author-Email: The AiiDA team <developers[at]aiida.net>
Project-Url: Documentation, https://aiida-wannier90-workflows.readthedocs.io
Project-Url: Source, https://github.com/aiidateam/aiida-wannier90-workflows
Keywords: aiida,plugin,wannier90
Classifier: Development Status :: 5 - Production/Stable
Classifier: Framework :: AiiDA
Classifier: Environment :: Plugins
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: POSIX :: Linux
Classifier: Operating System :: MacOS :: MacOS X
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3.8
Classifier: Programming Language :: Python :: 3.9
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Natural Language :: English
Classifier: Topic :: Scientific/Engineering :: Physics
Classifier: Intended Audience :: Science/Research
Requires-Python: >=3.8
Requires-Dist: aiida-core (<3,>=2.0)
Requires-Dist: aiida-pseudo (>=0.6)
Requires-Dist: aiida-quantumespresso (>=4.4)
Requires-Dist: aiida-wannier90 (>=2.1)
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Requires-Dist: pgtest; extra == "tests"
Provides-Extra: analysis
Provides-Extra: dev
Provides-Extra: docs
Provides-Extra: pre-commit
Provides-Extra: tests
Description-Content-Type: text/markdown
[Description omitted; length: 3089 characters]

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entry_points.txt

wannier90_workflows.split = aiida_wannier90_workflows.calculations.split:Wannier90SplitCalculation
wannier90_workflows.split = aiida_wannier90_workflows.parsers.split:Wannier90SplitParser
wannier90_workflows.bands = aiida_wannier90_workflows.workflows.bands:Wannier90BandsWorkChain
wannier90_workflows.base.open_grid = aiida_wannier90_workflows.workflows.base.open_grid:OpenGridBaseWorkChain
wannier90_workflows.base.projwfc = aiida_wannier90_workflows.workflows.base.projwfc:ProjwfcBaseWorkChain
wannier90_workflows.base.pw2wannier90 = aiida_wannier90_workflows.workflows.base.pw2wannier90:Pw2wannier90BaseWorkChain
wannier90_workflows.base.wannier90 = aiida_wannier90_workflows.workflows.base.wannier90:Wannier90BaseWorkChain
wannier90_workflows.open_grid = aiida_wannier90_workflows.workflows.open_grid:Wannier90OpenGridWorkChain
wannier90_workflows.optimize = aiida_wannier90_workflows.workflows.optimize:Wannier90OptimizeWorkChain
wannier90_workflows.projwfcbands = aiida_wannier90_workflows.workflows.projwfcbands:ProjwfcBandsWorkChain
wannier90_workflows.split = aiida_wannier90_workflows.workflows.split:Wannier90SplitWorkChain
wannier90_workflows.wannier90 = aiida_wannier90_workflows.workflows.wannier90:Wannier90WorkChain
aiida-wannier90-workflows = aiida_wannier90_workflows.cli:cmd_root