AiiDA plugin package "aiida-catmat"
General information
Current state:
Short description: Collection of AiiDA WorkChains Developed in Morgan Group
How to install: pip install --pre aiida-catmat
Source code: Go to the source code repository
Documentation: Go to plugin documentation
Detailed information
Author(s): Pezhman Zarabadi-Poor
Contact: pzarabadip@gmail.com
How to use from python: import aiida_catmat
Most recent version: 1.0.0b0
Compatibility:
Plugins provided by the package
Parsers 1 Workflows 5CalcJob parsers (aiida.parsers)
vasp_base_parser
class aiida_catmat.parsers:VaspBaseParser
WorkChains and work functions (aiida.workflows)
catmat.vasp_catmat
class aiida_catmat.workchains:VaspCatMatWorkChaincatmat.vasp_converge
class aiida_catmat.workchains:VaspConvergeWorkChaincatmat.vasp_multistage
class aiida_catmat.workchains:VaspMultiStageWorkChaincatmat.vasp_multistage_ddec
class aiida_catmat.workchains:VaspMultiStageDdecWorkChainvasp.base
class aiida_catmat.workchains:VaspBaseWorkChain