class x_amber_mdin_run(MCategory): ''' Parameters of mdin belonging to settings run. ''' m_def = Category(categories=[public.settings_run], a_legacy=LegacyDefinition(name='x_amber_mdin_run'))
class x_amber_mdout_single_configuration_calculation(MCategory): ''' Parameters of mdout belonging to section_single_configuration_calculation. ''' m_def = Category(a_legacy=LegacyDefinition( name='x_amber_mdout_single_configuration_calculation'))
class x_vasp_incarUnknown_param(MCategory): ''' Unknown incar parameters. By 'unknown' we refer to incar parameters in the OLD (predated Sept.2019) 'vasp.nomadmetainfo.json' that are **not** listed in the current (Oct.2019) VaspWiki ''' m_def = Category(a_legacy=LegacyDefinition( name='x_vasp_incarUnknown_param'))
class x_fhi_vibes_method(MCategory): ''' Parameters from vibes metadata belonging to section method. ''' m_def = Category(a_legacy=LegacyDefinition(name='x_fhi_vibes_method'))
class x_amber_mdout_method(MCategory): ''' Parameters of mdin belonging to section method. ''' m_def = Category(a_legacy=LegacyDefinition(name='x_amber_mdout_method'))
class x_phonopy_input(MCategory): ''' Information about properties that concern phonopy calculations. ''' m_def = Category(a_legacy=LegacyDefinition(name='x_phonopy_input'))