aiida-bigdft

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0.3.0 aiida_bigdft-0.3.0-py3-none-any.whl

Wheel Details

Project: aiida-bigdft
Version: 0.3.0
Filename: aiida_bigdft-0.3.0-py3-none-any.whl
Download: [link]
Size: 14392
MD5: 9329e38d2ee3c6184b0d7374e43a040b
SHA256: 9d1f6282f40bd4c4dc0fc97dad839ef40765784449d3ae8aecf5653473709de7
Uploaded: 2024-01-10 10:32:47 +0000

dist-info

METADATA

Metadata-Version: 2.1
Name: aiida-bigdft
Version: 0.3.0
Summary: Translation layer for AiiDA-PyBigDFT
Author-Email: Louis Beal <louis.j.beal[at]gmail.com>
Project-Url: Source, https://github.com/ljbeal/aiida-bigdft
Keywords: aiida,plugin
Classifier: Programming Language :: Python
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: MIT License
Classifier: Natural Language :: English
Classifier: Development Status :: 3 - Alpha
Classifier: Framework :: AiiDA
Requires-Python: >=3.7
Requires-Dist: aiida-core (<3,>=1.6.3)
Requires-Dist: voluptuous
Requires-Dist: PyBigDFT
Requires-Dist: ase
Requires-Dist: click
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Requires-Dist: coverage[toml]; extra == "testing"
Requires-Dist: pytest (~=6.0); extra == "testing"
Requires-Dist: pytest-cov; extra == "testing"
Provides-Extra: docs
Provides-Extra: pre-commit
Provides-Extra: testing
Description-Content-Type: text/markdown
[Description omitted; length: 1384 characters]

WHEEL

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entry_points.txt

bigdft = aiida_bigdft.calculations:BigDFTCalculation
bigdft = aiida_bigdft.cli:data_cli
bigdft = aiida_bigdft.data.BigDFTParameters:BigDFTParameters
bigdftfile = aiida_bigdft.data.BigDFTFile:BigDFTFile
bigdftlogfile = aiida_bigdft.data.BigDFTFile:BigDFTLogfile
bigdft = aiida_bigdft.parsers:BigDFTParser
bigdft = aiida_bigdft.workflows.base:BigDFTBaseWorkChain
bigdft.relax = aiida_bigdft.workflows.relax:BigDFTRelaxWorkChain