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aiida-python

AiiDA Python

status beta AiiDA >=2.1.0

General information

Install pip install aiida-python
Source code https://github.com/addman2/aiida-python
Documentation https://aiida-python.readthedocs.io
Author(s) Ot(t)o Kohulák
Contact otto.kohulak@dontemail.me
Python import import aiida_python
Latest version 0.0.6
Released 2023-11-03

Registry checks

W019: No <code>bdist_wheel</code> available for PyPI release.
W006: 'development_status' key is deprecated. Use PyPI Trove classifiers in the plugin repository instead.
W008: Unable to reach documentation URL: https://aiida-python.readthedocs.io
W009: Prefix 'aiida-python' does not follow naming convention.
W010: Entry point 'python.calc' does not start with prefix 'aiida-python.'
W010: Entry point 'python.parser' does not start with prefix 'aiida-python.'
Click any code (W001, E001…) to jump to troubleshooting instructions .

Plugins provided

Calculations 1 Parsers 1 Other 5

Entry points

CalcJobs and calculation functions aiida.calculations

  • python.calc

    aiida_python.calc:CalcJobPython
CalcJob parsers aiida.parsers

  • python.parser

    aiida_python.parser:ParserPython
aiida_python.serializers aiida_python.serializers

  • int

    aiida_python.serializers:SerializerInt

  • float

    aiida_python.serializers:SerializerFloat

  • str

    aiida_python.serializers:SerializerStr

  • list

    aiida_python.serializers:SerializerList

  • arraydata

    aiida_python.serializers:SerializerArrayData
Data node types aiida.data