vasp/xml format

xml format

Class: VASPXMLFormat

Conversions

Convert from this format to LabeledSystem

dpdata.LabeledSystem(file_name, begin=0, step=1, fmt: Literal['vasp/xml'] = None) → dpdata.system.LabeledSystem

dpdata.LabeledSystem(file_name, begin=0, step=1, fmt: Literal['xml'] = None) → dpdata.system.LabeledSystem

dpdata.LabeledSystem.from_vasp_xml(file_name, begin=0, step=1) → dpdata.system.LabeledSystem

dpdata.LabeledSystem.from_xml(file_name, begin=0, step=1) → dpdata.system.LabeledSystem

Convert this format to LabeledSystem.

Returns:

LabeledSystem

converted system