aiida_vasp.parsers.content_parsers.doscar

The DOSCAR parser interface.

Module Contents

Classes

DoscarParser

The parser interface that enables parsing of DOSCAR content.

API

class aiida_vasp.parsers.content_parsers.doscar.DoscarParser(*, handler=None, data=None, settings=None, options=None)

Bases: aiida_vasp.parsers.content_parsers.base.BaseFileParser

The parser interface that enables parsing of DOSCAR content.

The parser is triggered by using the doscar-dos quantity key. The quantity key dos will on the other hand parse the structure using the XML parser.

Initialization

DEFAULT_SETTINGS = None

PARSABLE_QUANTITIES = None

_init_from_handler(handler)

Initialize a parsevasp object of Chgcar using a file like handler.

handlerobject

A file like object that provides the necessary DOSCAR content to be parsed.

property dos

Return the total and partial density of states, and in addition some metadata.

dosdict

A dict containing the keys tdos, pdos and header, which contain for the two first, NumPy arrays for the total density of states and partial density of states, respectively.