aiida_cusp.data.outputs.vasp_outcar module
Datatype and methods to initialize and interact with VASP specific OUTCAR output data
- class aiida_cusp.data.outputs.vasp_outcar.VaspOutcarData(file, filename=None, **kwargs)
Bases:
SingleArchiveData
AiiDA compatible node representing a VASP OUTCAR output data object as gzip-compressed node in the repository.
- get_outcar()
Return a
pymatgen.io.vasp.outputs.Outcar
instance initialized from the OUTCAR data stored by the node- Returns:
Outcar instance initialized from the node’s stored OUTCAR data
- Return type: