AiiDA plugin package "aiida-ddec"
General information
Current state:
Short description: AiiDA plugin for DDEC code
How to install: pip install git+https://github.com/yakutovicha/aiida-ddec
Source code: Go to the source code repository
Documentation: No documentation provided by the package author
Detailed information
Author(s): Aliaksandr Yakutovich
Contact: aliaksandr.yakutovich@epfl.ch
How to use from python: import aiida_ddec
Most recent version: 1.1.0
Compatibility:
Plugins provided by the package
Calculations 1 Parsers 1 Workflows 1CalcJobs and calculation functions (aiida.calculations)
ddecclass aiida_ddec.calculations:DdecCalculation
CalcJob parsers (aiida.parsers)
ddecclass aiida_ddec.parsers:DdecParser
WorkChains and work functions (aiida.workflows)
ddec.cp2k_ddecclass aiida_ddec.workchains:Cp2kDdecWorkChain