!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_KangSaLee_2009_ZrAgCu__MO_813575892799_001 Supported species : Ag Cu Zr 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 -------------------------------- AgAg 10 / 10 yes AgCu 10 / 10 yes AgZr 10 / 10 yes CuCu 10 / 10 yes CuZr 10 / 10 yes ZrZr 10 / 10 yes AgAgAg 10 / 10 yes AgAgCu 10 / 10 yes AgAgZr 10 / 10 yes AgCuCu 10 / 10 yes AgCuZr 10 / 10 yes AgZrZr 10 / 10 yes CuCuCu 10 / 10 yes CuCuZr 10 / 10 yes CuZrZr 10 / 10 yes ZrZrZr 10 / 10 yes AgAgAgAg 10 / 10 yes AgAgAgCu 10 / 10 yes AgAgAgZr 10 / 10 yes AgAgCuCu 10 / 10 yes AgAgCuZr 10 / 10 yes AgAgZrZr 10 / 10 yes AgCuCuCu 10 / 10 yes AgCuCuZr 10 / 10 yes AgCuZrZr 10 / 10 yes AgZrZrZr 10 / 10 yes CuCuCuCu 10 / 10 yes CuCuCuZr 10 / 10 yes CuCuZrZr 10 / 10 yes CuZrZrZr 10 / 10 yes ZrZrZrZr 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.