jarvis-tools

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2024.4.10 jarvis_tools-2024.4.10-py2.py3-none-any.whl

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Project: jarvis-tools
Version: 2024.4.10
Filename: jarvis_tools-2024.4.10-py2.py3-none-any.whl
Download: [link]
Size: 978035
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Uploaded: 2024-04-14 14:32:46 +0000

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METADATA

Metadata-Version: 2.1
Name: jarvis-tools
Version: 2024.4.10
Summary: jarvis-tools: an open-source software package for data-driven atomistic materials design. https://jarvis.nist.gov/
Author: Kamal Choudhary
Author-Email: kamal.choudhary[at]nist.gov
Home-Page: https://github.com/usnistgov/jarvis
License: NIST
Classifier: Programming Language :: Python :: 3.6
Classifier: Development Status :: 4 - Beta
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: OS Independent
Classifier: Topic :: Scientific/Engineering
Requires-Dist: numpy (>=1.20.1)
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Requires-Dist: matplotlib (>=3.0.0)
Requires-Dist: spglib (>=1.14.1)
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Requires-Dist: torch; extra == "ai"
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Requires-Dist: tensorflow; extra == "ai"
Requires-Dist: scikit-learn; extra == "ai"
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Requires-Dist: pandas; extra == "ai"
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Requires-Dist: sphinx (>=1.3.1); extra == "doc"
Requires-Dist: sphinx-rtd-theme (>=0.1.8); extra == "doc"
Provides-Extra: ai
Provides-Extra: babel
Provides-Extra: doc
License-File: LICENSE.rst
[Description omitted; length: 2045 characters]

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