AiiDA plugin package "aiida-ase"
General information
Current state:
Short description: The official AiiDA plugin for ASE.
How to install: pip install aiida-ase
Source code: Go to the source code repository
Documentation: Go to plugin documentation
Detailed information
Author(s):
Contact: The AiiDA team <developers@aiida.net>
How to use from python: import aiida_ase
Most recent version: 2.0.0
Compatibility:
Plugins provided by the package
Calculations 1 Parsers 2 Workflows 1CalcJobs and calculation functions (aiida.calculations)
ase.ase
class aiida_ase.calculations.ase:AseCalculation
CalcJob parsers (aiida.parsers)
ase.ase
class aiida_ase.parsers.ase:AseParserase.gpaw
class aiida_ase.parsers.gpaw:GpawParser
WorkChains and work functions (aiida.workflows)
ase.gpaw.base
class aiida_ase.workflows.base:GpawBaseWorkChain