aiida_yambo

Subpackages

• aiida_yambo.calculations
  • aiida_yambo.calculations.yambo
  • aiida_yambo.calculations.ypp
• aiida_yambo.commands
  • aiida_yambo.commands.options
  • aiida_yambo.commands.plotting
  • aiida_yambo.commands.utils
  • aiida_yambo.commands.validators
• aiida_yambo.parsers
  • aiida_yambo.parsers.parsers
  • aiida_yambo.parsers.utils
  • aiida_yambo.parsers.yppparser
• aiida_yambo.utils
  • aiida_yambo.utils.defaults
    • aiida_yambo.utils.defaults.create_defaults
  • aiida_yambo.utils.common_helpers
  • aiida_yambo.utils.k_path_utils
  • aiida_yambo.utils.parallel_namelists
  • aiida_yambo.utils.parallelism_finder
• aiida_yambo.workflows
  • aiida_yambo.workflows.protocols
    • aiida_yambo.workflows.protocols.yambo
    • aiida_yambo.workflows.protocols.ypp
  • aiida_yambo.workflows.utils
    • aiida_yambo.workflows.utils.collectors
    • aiida_yambo.workflows.utils.extend_QPDB
    • aiida_yambo.workflows.utils.fittings
    • aiida_yambo.workflows.utils.generate_convergence_setup
    • aiida_yambo.workflows.utils.helpers_aiida_qe
    • aiida_yambo.workflows.utils.helpers_aiida_yambo
    • aiida_yambo.workflows.utils.helpers_workflow
    • aiida_yambo.workflows.utils.helpers_yamborestart
    • aiida_yambo.workflows.utils.helpers_yambowf
    • aiida_yambo.workflows.utils.optimization_module
    • aiida_yambo.workflows.utils.plotting
    • aiida_yambo.workflows.utils.predictor_1D
    • aiida_yambo.workflows.utils.predictor_2D
  • aiida_yambo.workflows.yamboconvergence
  • aiida_yambo.workflows.yamborestart
  • aiida_yambo.workflows.yambowf
  • aiida_yambo.workflows.ypprestart

Package Contents

aiida_yambo.__version__ = '3.1.0'