AiiDA plugin package "aiida-phonopy"
General information
Current state:
Short description: AiiDA plugin for running phonon calculations using phonopy
How to install: pip install aiida-phonopy
Source code: Go to the source code repository
Documentation: Go to plugin documentation
Detailed information
Author(s): AiiDA-phonpy team
Contact: atz.togo@gmail.com
How to use from python: import aiida_phonopy
Most recent version: 0.6.0
Compatibility:
Plugins provided by the package
Calculations 1 Parsers 1 Workflows 4CalcJobs and calculation functions (aiida.calculations)
phonopy.phonopy
class aiida_phonopy.calcs.phonopy:PhonopyCalculation
CalcJob parsers (aiida.parsers)
phonopy
class aiida_phonopy.parsers.phonopy:PhonopyParser
WorkChains and work functions (aiida.workflows)
phonopy.iter_ha
class aiida_phonopy.workflows.iter_ha:IterHarmonicApproxphonopy.phono3py
class aiida_phonopy.workflows.phono3py.phono3py:Phono3pyWorkChainphonopy.phonopy
class aiida_phonopy.workflows.phonopy.phonopy:PhonopyWorkChainphonopy.phonopy.base
class aiida_phonopy.workflows.phonopy.base:BasePhonopyWorkChain