aiida_quantumespresso.parsers.open_grid

Module Contents

Classes

OpenGridParser

Parser implementation for the OpenGridCalculation calculation job class.

class aiida_quantumespresso.parsers.open_grid.OpenGridParser(node: aiida.orm.CalcJobNode)

Bases: aiida_quantumespresso.parsers.base.BaseParser

Parser implementation for the OpenGridCalculation calculation job class.

class_error_map

parse(**kwargs)

Parse the retrieved files of a completed OpenGridCalculation into output nodes.

static parse_kpoints(stdout: str, logs: aiida.common.AttributeDict) → Tuple[aiida.orm.KpointsData, aiida.orm.KpointsData, aiida.common.AttributeDict]

Parse the stdout for the mesh and explicit list of kpoints.