-* The ``-s optimize_only.yaml`` sets the specification of the workflow using the ``optimize_only.yaml`` file in `this directory <https://github.com/hackingmaterials/atomate/blob/master/atomate/vasp/workflows/base/library/>`_. Alternatively, the ``-p wf_structure_optimization`` sets the workflow specification using the preset Python function located in `this module <https://github.com/hackingmaterials/atomate/blob/master/atomate/vasp/workflows/presets/core.py>`_. For now, it's probably best not to worry about the distinction but to know that both libraries of workflows are available to you.
0 commit comments