Result
- class ase2sprkkr.asr.pdos.Result(dos_at_ef_nosoc, pdos_nosoc, pdos_soc, dos_at_ef_soc)[source]
Class hierarchy
Constructor
- Parameters:
dos_at_ef_nosoc (float) –
pdos_nosoc (List[float]) –
pdos_soc (List[float]) –
dos_at_ef_soc (float) –
- __init__(dos_at_ef_nosoc, pdos_nosoc, pdos_soc, dos_at_ef_soc)
Instantiate result.
- Parameters:
data (Dict[str, Any]) – Input data to be wrapped.
metadata (dict) – Dictionary containing metadata.
strict (bool or None) – Strictly enforce data entries in data.
- property pdos_nosoc: List[float]
Projected density of states w/o soc.
- property pdos_soc: List[float]
Projected density of states
- property dos_at_ef_nosoc: float
Density of states at the Fermi level w/o soc [states/(eV * unit cell)]
- property dos_at_ef_soc: float
Density of states at the Fermi level [states/(eV * unit cell)]
- key_descriptions: Dict[str, str] = {'dos_at_ef_nosoc': 'Density of states at the Fermi level w/o soc [states/(eV * unit cell)]', 'dos_at_ef_soc': 'Density of states at the Fermi level [states/(eV * unit cell)]', 'pdos_nosoc': 'Projected density of states w/o soc.', 'pdos_soc': 'Projected density of states'}
- formats = {'ase_webpanel': <function webpanel>}
- _known_data_keys = {'dos_at_ef_nosoc', 'dos_at_ef_soc', 'pdos_nosoc', 'pdos_soc'}
- strict = True