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aiida-quantum-transport

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Project: aiida-quantum-transport
Version: 0.1.0
Filename: aiida_quantum_transport-0.1.0-py3-none-any.whl
Download: [link]
Size: 26957
MD5: fb8c99172e180961e447af27d1a16a7d
SHA256: a8642fd172f0682ada8c28a064eb8a64c58c4959b9cc9a74fe22ce031819586c
Uploaded: 2024-05-04 06:52:12 +0000

dist-info

METADATA · WHEEL · RECORD · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: aiida-quantum-transport
Version: 0.1.0
Summary: A plugin for quantum transport calculations based on NEGF methods.
Author-Email: Edan Bainglass <edan.bainglass[at]gmail.com>
Project-Url: Source, https://github.com/edan-bainglass/aiida-quantum-transport
Keywords: quantum,transport,NEGF,DMFT,aiida,plugin
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3.9
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Programming Language :: Python :: 3.12
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: >=3.9
Requires-Dist: aiida-core (<3,>=2.0)
Requires-Dist: sphinx-design (~=0.4.1); extra == "docs"
Requires-Dist: pydata-sphinx-theme (==0.13.3); extra == "docs"
Requires-Dist: pre-commit (~=2.2); extra == "pre-commit"
Requires-Dist: mypy (~=1.7.1); extra == "pre-commit"
Requires-Dist: pytest (~=7.0); extra == "testing"
Requires-Dist: pytest-cov (<2.11,~=2.7); extra == "testing"
Requires-Dist: coverage (~=6.0); extra == "testing"
Provides-Extra: docs
Provides-Extra: pre-commit
Provides-Extra: testing
Description-Content-Type: text/markdown
[Description omitted; length: 4195 characters]

WHEEL

Wheel-Version: 1.0
Generator: flit 3.9.0
Root-Is-Purelib: true
Tag: py3-none-any

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entry_points.txt

[aiida.calculations]
quantum_transport = aiida_quantum_transport.calculations.custom:CustomCalculation
quantum_transport.current = aiida_quantum_transport.calculations.current:CurrentCalculation
quantum_transport.dft = aiida_quantum_transport.calculations.dft:DFTCalculation
quantum_transport.dmft = aiida_quantum_transport.calculations.dmft:DMFTCalculation
quantum_transport.greens = aiida_quantum_transport.calculations.greens:GreensFunctionParametersCalculation
quantum_transport.hybridize = aiida_quantum_transport.calculations.hybridize:HybridizationCalculation
quantum_transport.localize = aiida_quantum_transport.calculations.localize:LocalizationCalculation
quantum_transport.transmission = aiida_quantum_transport.calculations.transmission:TransmissionCalculation
[aiida.cmdline.data]
quantum_transport = aiida_quantum_transport.cli.commands:data_cli
[aiida.data]
quantum_transport = aiida_quantum_transport.data.custom:CustomData
[aiida.parsers]
quantum_transport = aiida_quantum_transport.parsers.custom:CustomParser
quantum_transport.current = aiida_quantum_transport.parsers.current:CurrentParser
quantum_transport.dft = aiida_quantum_transport.parsers.dft:DFTParser
quantum_transport.dmft = aiida_quantum_transport.parsers.dmft:DMFTParser
quantum_transport.greens = aiida_quantum_transport.parsers.greens:GreensFunctionParametersParser
quantum_transport.hybridize = aiida_quantum_transport.parsers.hybridize:HybridizationParser
quantum_transport.localize = aiida_quantum_transport.parsers.localize:LocalizationParser
quantum_transport.transmission = aiida_quantum_transport.parsers.transmission:TransmissionParser
[aiida.workflows]
quantum_transport.coulomb_diamonds = aiida_quantum_transport.workchains.coulomb_diamonds:CoulombDiamondsWorkChain