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AiiDA plugin package "aiida-environ"

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General information

Current state:

Short description: Environ plugin

How to install: pip install git+https://github.com/environ-developers/aiida-environ

Source code: Go to the source code repository

Documentation: No documentation provided by the package author

Detailed information

Author(s): Matthew Truscott

Contact: matthew.a.truscott@gmail.com

How to use from python: import aiida_environ

Most recent version: 0.1.0

Compatibility:

Plugins provided by the package

Calculations 1 Parsers 1 Workflows 3

CalcJobs and calculation functions (aiida.calculations)

  • environ.pw
    class aiida_environ.calculations.pw:EnvPwCalculation

CalcJob parsers (aiida.parsers)

  • environ.pw
    class aiida_environ.parsers.pw:EnvPwParser

WorkChains and work functions (aiida.workflows)

  • environ.pw.base
    class aiida_environ.workflows.pw.base:EnvPwBaseWorkChain
  • environ.pw.relax
    class aiida_environ.workflows.pw.relax:EnvPwRelaxWorkChain
  • environ.pw.solvation
    class aiida_environ.workflows.pw.solvation:PwSolvationWorkChain