!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! VERIFICATION CHECK: vc-species-supported-as-stated !!!!! !!!!! !!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! Description: This verification check ensures that a model supports all of the species that it claims to. The verification check attempts to compute the energy for all clusters up to a preset size for all combinations of the species listed by the model. Several random samples are generated for each cluster. The check is successful if all elements appear in at least one successful calculation, i.e. the model does not abort during the calculation. This algorithm accounts for the fact that some models may only support species in certain combinations. For example a model supporting species A and B may be for an AB alloy and may only support A-B interactions and not A-A or B-B. The output provides full information on which interactions are supported and which are not. Note that this definition of 'support' does not imply that the model has non- trivial energy and/or force interactions for any of the species. Author: Ellad Tadmor -------------------------------------------------------------------------------- Results for KIM Model : MEAM_LAMMPS_ShimKoKim_2013_AlVH__MO_344724145339_000 Supported species : Al H V Maximum cluster size considered (#atoms) = 4 Maximum number of allowed combinations = 10000 Radius of ball containing clusters: = 1.500 Minimum allowed distance between atoms: = 1.000 Number of random samples for each cluster = 10 Random number seed: = 13 -------------------------------------------------------------------------------- Cluster Success Supported -------------------------------- AlAl 10 / 10 yes AlH 10 / 10 yes AlV 10 / 10 yes HH 10 / 10 yes HV 10 / 10 yes VV 10 / 10 yes AlAlAl 10 / 10 yes AlAlH 10 / 10 yes AlAlV 10 / 10 yes AlHH 10 / 10 yes AlHV 10 / 10 yes AlVV 10 / 10 yes HHH 10 / 10 yes HHV 10 / 10 yes HVV 10 / 10 yes VVV 10 / 10 yes AlAlAlAl 10 / 10 yes AlAlAlH 10 / 10 yes AlAlAlV 10 / 10 yes AlAlHH 10 / 10 yes AlAlHV 10 / 10 yes AlAlVV 10 / 10 yes AlHHH 10 / 10 yes AlHHV 10 / 10 yes AlHVV 10 / 10 yes AlVVV 10 / 10 yes HHHH 10 / 10 yes HHHV 10 / 10 yes HHVV 10 / 10 yes HVVV 10 / 10 yes VVVV 10 / 10 yes -------------------------------- ================================================================================ To pass this verification check each model element must be supported in at least one cluster combination. Grade: P Comment: All elements claimed by model are supported in at least one of the tested configurations.