:py:mod:`aiida_vasp.commands.dryrun_vasp` ========================================= .. py:module:: aiida_vasp.commands.dryrun_vasp .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp :allowtitles: Module Contents --------------- Functions ~~~~~~~~~ .. list-table:: :class: autosummary longtable :align: left * - :py:obj:`cmd_dryrun_vasp ` - .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.cmd_dryrun_vasp :summary: * - :py:obj:`dryrun_vasp ` - .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.dryrun_vasp :summary: * - :py:obj:`parse_ibzkpt ` - .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.parse_ibzkpt :summary: * - :py:obj:`parse_outcar ` - .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.parse_outcar :summary: API ~~~ .. py:function:: cmd_dryrun_vasp(input_dir: str, vasp_exe: str, timeout: int, work_dir: typing.Optional[str], keep: bool, force: bool) -> None :canonical: aiida_vasp.commands.dryrun_vasp.cmd_dryrun_vasp .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.cmd_dryrun_vasp .. py:function:: dryrun_vasp(input_dir: typing.Union[str, pathlib.Path], vasp_exe: str = 'vasp_std', timeout: int = 10, work_dir: typing.Optional[typing.Union[str, pathlib.Path]] = None, keep: bool = False, force: bool = False) -> typing.Dict[str, typing.Union[int, float, str]] :canonical: aiida_vasp.commands.dryrun_vasp.dryrun_vasp .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.dryrun_vasp .. py:function:: parse_ibzkpt(ibzkpt_path: typing.Union[str, pathlib.Path]) -> typing.List[typing.List[float]] :canonical: aiida_vasp.commands.dryrun_vasp.parse_ibzkpt .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.parse_ibzkpt .. py:function:: parse_outcar(outcar_path: typing.Union[str, pathlib.Path]) -> typing.Dict[str, typing.Union[typing.List[str], int, float]] :canonical: aiida_vasp.commands.dryrun_vasp.parse_outcar .. autodoc2-docstring:: aiida_vasp.commands.dryrun_vasp.parse_outcar