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AiiDA plugin "aiida-porousmaterials"

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General information

Current state: development Adds new functionality, not yet ready for production. Testing welcome!

Short description: AiiDA plugin for PorousMaterials code

How to install: pip install git+https://github.com/pzarabadip/aiida-porousmaterials

Source code: Go to the source code repository

Documentation: No documentation provided by the plugin author

Detailed information

Author(s): Pezhman Zarabadi-Poor

Contact: pzarabadip@gmail.com

How to use from python: import aiida_porousmaterials

Most recent version: 1.0.0a1

Compatible with aiida-core: >=1.0.0b5

Entry points provided by the plugin

Calculations 1 Parsers 1 Workflows 2

Calculation plugins (aiida.calculations)

  • porousmaterials
    class aiida_porousmaterials.calculations:PorousMaterialsCalculation

Calculation parsers (aiida.parsers)

  • porousmaterials
    class aiida_porousmaterials.parser:PorousMaterialsParser

Workflows and WorkChains (aiida.workflows)

  • porousmaterials.base
    class aiida_porousmaterials.workchains:PorousMaterialsBaseWorkChain
  • aiida_porousmaterials.workflows.voronoi_energy
    class aiida_porousmaterials.workflows.voronoi_energy:VoronoiEnergyWorkChain