:py:mod:`aiida_phonopy.utils.resources` ======================================= .. py:module:: aiida_phonopy.utils.resources .. autoapi-nested-parse:: Utilities for CalcJob resources. Module Contents --------------- Functions ~~~~~~~~~ .. autoapisummary:: aiida_phonopy.utils.resources.get_default_options .. py:function:: get_default_options(max_num_machines=1, max_wallclock_seconds=300, with_mpi=False) Return an instance of the options dictionary with the minimally required parameters for a `CalcJob`. :param max_num_machines: set the number of nodes, default=1 :param max_wallclock_seconds: set the maximum number of wallclock seconds, default=1800 :param with_mpi: whether to run the calculation with MPI enabled