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aiida-sssp-workflow 0.2.0-beta.0 documentation

  • The aiida-sssp-workflow plugin for AiiDA
  • User guide
    • Getting started
    • Tutorial
  • Developer guide
  • API documentation
    • aiida_sssp_workflow
      • aiida_sssp_workflow.REF
      • aiida_sssp_workflow.calculations
        • aiida_sssp_workflow.calculations.birch_murnaghan_fit
        • aiida_sssp_workflow.calculations.calculate_bands_distance
        • aiida_sssp_workflow.calculations.calculate_delta
        • aiida_sssp_workflow.calculations.wien2k_ref
      • aiida_sssp_workflow.data
      • aiida_sssp_workflow.workflows
        • aiida_sssp_workflow.workflows.convergence
        • aiida_sssp_workflow.workflows.evaluate
        • aiida_sssp_workflow.workflows.legacy_convergence
        • aiida_sssp_workflow.workflows._eos
        • aiida_sssp_workflow.workflows.bands_distance
        • aiida_sssp_workflow.workflows.delta_factor
        • aiida_sssp_workflow.workflows.verifications
      • aiida_sssp_workflow.helpers
      • aiida_sssp_workflow.parsers
      • aiida_sssp_workflow.utils

Made possible by the support of NCCR MARVEL, MaX CoE and the swissuniversities P-5 project.

Contents
  • Submodules

aiida_sssp_workflow.calculations¶

Submodules¶

  • aiida_sssp_workflow.calculations.birch_murnaghan_fit
  • aiida_sssp_workflow.calculations.calculate_bands_distance
  • aiida_sssp_workflow.calculations.calculate_delta
  • aiida_sssp_workflow.calculations.wien2k_ref

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aiida_sssp_workflow.REF

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aiida_sssp_workflow.calculations.birch_murnaghan_fit

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