!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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 : Sim_LAMMPS_Polymorphic_ZhouJonesChu_2017_GaInN__SM_887684855692_000 Supported species : Ga In N 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 -------------------------------- GaGa 10 / 10 yes GaIn 10 / 10 yes GaN 10 / 10 yes InIn 10 / 10 yes InN 10 / 10 yes NN 10 / 10 yes GaGaGa 10 / 10 yes GaGaIn 10 / 10 yes GaGaN 10 / 10 yes GaInIn 10 / 10 yes GaInN 10 / 10 yes GaNN 10 / 10 yes InInIn 10 / 10 yes InInN 10 / 10 yes InNN 10 / 10 yes NNN 10 / 10 yes GaGaGaGa 10 / 10 yes GaGaGaIn 10 / 10 yes GaGaGaN 10 / 10 yes GaGaInIn 10 / 10 yes GaGaInN 10 / 10 yes GaGaNN 10 / 10 yes GaInInIn 10 / 10 yes GaInInN 10 / 10 yes GaInNN 10 / 10 yes GaNNN 10 / 10 yes InInInIn 10 / 10 yes InInInN 10 / 10 yes InInNN 10 / 10 yes InNNN 10 / 10 yes NNNN 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.