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0.2.6 quacc-0.2.6-py3-none-any.whl

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Project: quacc
Version: 0.2.6
Filename: quacc-0.2.6-py3-none-any.whl
Download: [link]
Size: 100940
MD5: f406d941c0e5119a02bd55e1cf8b38ec
SHA256: 8ef544fff93ba12f4426980af8069477486f3e7212fb1af850e776082d798601
Uploaded: 2023-09-11 20:53:25 +0000

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METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: quacc
Version: 0.2.6
Summary: A platform to enable high-throughput, database-driven quantum chemistry and computational materials science
Author-Email: "Andrew S. Rosen" <asrosen93[at]gmail.com>
Maintainer-Email: "Andrew S. Rosen" <asrosen93[at]gmail.com>
Project-Url: repository, https://github.com/Quantum-Accelerators/quacc
Project-Url: documentation, https://quantum-accelerators.github.io/quacc/
Project-Url: changelog, https://github.com/Quantum-Accelerators/quacc/blob/main/CHANGELOG.md
License: BSD-3
Keywords: high-throughput,automated,workflow,dft
Classifier: Development Status :: 3 - Alpha
Classifier: Intended Audience :: Science/Research
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.9
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Intended Audience :: Science/Research
Classifier: Topic :: Scientific/Engineering
Classifier: Operating System :: Microsoft :: Windows
Classifier: Operating System :: Unix
Classifier: Operating System :: MacOS
Requires-Python: <3.12,>=3.9
Requires-Dist: ase
Requires-Dist: cclib (>=1.8)
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Provides-Extra: covalent
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Provides-Extra: dev
Provides-Extra: docs
Provides-Extra: jobflow
Provides-Extra: newtonnet
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Provides-Extra: parsl
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Description-Content-Type: text/markdown
License-File: LICENSE.md
[Description omitted; length: 3004 characters]

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quacc-0.2.6.dist-info/RECORD — —

top_level.txt

quacc

entry_points.txt

[console_scripts]
quacc = quacc._cli.quacc:app