:py:mod:`aiida_vasp.inputset.vaspsets` ====================================== .. py:module:: aiida_vasp.inputset.vaspsets .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets :allowtitles: Module Contents --------------- Classes ~~~~~~~ .. list-table:: :class: autosummary longtable :align: left * - :py:obj:`VASPInputSet ` - .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet :summary: API ~~~ .. py:class:: VASPInputSet(set_name, overrides=None, verbose=False) :canonical: aiida_vasp.inputset.vaspsets.VASPInputSet Bases: :py:obj:`aiida_vasp.inputset.base.InputSet` .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet .. rubric:: Initialization .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet.__init__ .. py:method:: get_input_dict(structure: aiida.orm.StructureData, raw_python: bool = True) -> typing.Union[dict, aiida.orm.Dict] :canonical: aiida_vasp.inputset.vaspsets.VASPInputSet.get_input_dict .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet.get_input_dict .. py:method:: get_pp_mapping(structure: aiida.orm.StructureData) -> dict :canonical: aiida_vasp.inputset.vaspsets.VASPInputSet.get_pp_mapping .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet.get_pp_mapping .. py:method:: get_potcar_family() -> str :canonical: aiida_vasp.inputset.vaspsets.VASPInputSet.get_potcar_family .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet.get_potcar_family .. py:method:: get_kpoints_spacing() -> float :canonical: aiida_vasp.inputset.vaspsets.VASPInputSet.get_kpoints_spacing .. autodoc2-docstring:: aiida_vasp.inputset.vaspsets.VASPInputSet.get_kpoints_spacing