!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 Supported species : C Fe Mn Si 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 -------------------------------- CC 10 / 10 yes CFe 10 / 10 yes CMn 10 / 10 yes CSi 10 / 10 yes FeFe 10 / 10 yes FeMn 10 / 10 yes FeSi 10 / 10 yes MnMn 10 / 10 yes MnSi 10 / 10 yes SiSi 10 / 10 yes CCC 10 / 10 yes CCFe 10 / 10 yes CCMn 10 / 10 yes CCSi 10 / 10 yes CFeFe 10 / 10 yes CFeMn 10 / 10 yes CFeSi 10 / 10 yes CMnMn 10 / 10 yes CMnSi 10 / 10 yes CSiSi 10 / 10 yes FeFeFe 10 / 10 yes FeFeMn 10 / 10 yes FeFeSi 10 / 10 yes FeMnMn 10 / 10 yes FeMnSi 10 / 10 yes FeSiSi 10 / 10 yes MnMnMn 10 / 10 yes MnMnSi 10 / 10 yes MnSiSi 10 / 10 yes SiSiSi 10 / 10 yes CCCC 10 / 10 yes CCCFe 10 / 10 yes CCCMn 10 / 10 yes CCCSi 10 / 10 yes CCFeFe 10 / 10 yes CCFeMn 10 / 10 yes CCFeSi 10 / 10 yes CCMnMn 10 / 10 yes CCMnSi 10 / 10 yes CCSiSi 10 / 10 yes CFeFeFe 10 / 10 yes CFeFeMn 10 / 10 yes CFeFeSi 10 / 10 yes CFeMnMn 10 / 10 yes CFeMnSi 10 / 10 yes CFeSiSi 10 / 10 yes CMnMnMn 10 / 10 yes CMnMnSi 10 / 10 yes CMnSiSi 10 / 10 yes CSiSiSi 10 / 10 yes FeFeFeFe 10 / 10 yes FeFeFeMn 10 / 10 yes FeFeFeSi 10 / 10 yes FeFeMnMn 10 / 10 yes FeFeMnSi 10 / 10 yes FeFeSiSi 10 / 10 yes FeMnMnMn 10 / 10 yes FeMnMnSi 10 / 10 yes FeMnSiSi 10 / 10 yes FeSiSiSi 10 / 10 yes MnMnMnMn 10 / 10 yes MnMnMnSi 10 / 10 yes MnMnSiSi 10 / 10 yes MnSiSiSi 10 / 10 yes SiSiSiSi 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.