radtools.DOSQE.pdos#
method
- DOSQE.pdos(atom, wfc, wfc_numbers=None, atom_numbers=None, background_total=False) PDOSQE[source]#
Projected density of states for a particular atom.
- Parameters:
- atomstr
Name of the atom type.
- wfcstr
Name of the projector wave function.
- wfc_numbersIterable or int, optional
Number of wave function projector.
- atom_numbersIterable or int, optional
If
None, then PDOS summed over all atom numbers foratom.
- Returns:
- pdos
PDOSQE Partial density of states, orbital-resolved.
- pdos