AiiDA plugin package "aiida-mpds"
General information
Current state:
Short description: Aiida workflows for MPDS based on CRYSTAL
How to install: pip install git+https://github.com/mpds-io/mpds-aiida
Source code: Go to the source code repository
Documentation: Go to plugin documentation
Detailed information
Author(s): Andrey Sobolev
Contact: as@tilde.pro
How to use from python: import aiida_mpds
Most recent version:
Compatibility:
Plugins provided by the package
Workflows 3WorkChains and work functions (aiida.workflows)
crystal.aiida
class mpds_aiida.workflows.aiida:AiidaStructureWorkchaincrystal.cif
class mpds_aiida.workflows.cif:CIFStructureWorkchaincrystal.mpds
class mpds_aiida.workflows.mpds:MPDSStructureWorkchain