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aiida-tbmodels

AiiDA Plugin for running TBmodels

status alpha

General information

Install pip install aiida-tbmodels
Source code https://github.com/greschd/aiida-tbmodels
Documentation https://aiida-tbmodels.readthedocs.io
Author(s) Dominik Gresch
Contact [email protected]
Python import import aiida_tbmodels
Latest version 0.3.0
Released 2020-03-03

Registry checks

W019: No <code>bdist_wheel</code> available for PyPI release.
W002: AiiDA version not found
E001: Failed to install plugin aiida-tbmodels<pre>Collecting aiida-tbmodels Downloading aiida-tbmodels-0.3.0.tar.gz (8.8 kB) Installing build dependencies: started Installing build dependencies: finished with status 'done' Getting requirements to build wheel: started Getting requirements to build wheel: finished with status 'done' Installing backend dependencies: started Installing backend dependencies: finished with status 'done' Preparing metadata (pyproject.toml): started Preparing metadata (pyproject.toml): finished with status 'error' error: subprocess-exited-with-error × Preparing metadata (pyproject.toml) did not run successfully. │ exit code: 1 ╰─> [3 lines of output] error in aiida-tbmodels setup command: 'install_requires' must be a string or iterable of strings containing valid project/version requirement specifiers; Expected comma (within version specifier), semicolon (after version specifier) or end aiida-core>=1.1.0<2.0.0 ~~~~~~~^ [end of output] note: This error originates from a subprocess, and is likely not a problem with pip. error: metadata-generation-failed × Encountered error while generating package metadata. ╰─> aiida-tbmodels note: This is an issue with the package mentioned above, not pip. hint: See above for details. </pre>
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Plugins provided

Calculations 4 Parsers 1

Entry points

CalcJobs and calculation functions aiida.calculations

  • tbmodels.eigenvals

    aiida_tbmodels.calculations.eigenvals:EigenvalsCalculation

  • tbmodels.parse

    aiida_tbmodels.calculations.parse:ParseCalculation

  • tbmodels.slice

    aiida_tbmodels.calculations.slice:SliceCalculation

  • tbmodels.symmetrize

    aiida_tbmodels.calculations.symmetrize:SymmetrizeCalculation
CalcJob parsers aiida.parsers

  • tbmodels.model

    aiida_tbmodels.parsers.model:ModelParser