!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! VERIFICATION CHECK: vc-species-supported-as-stated !!!!! !!!!! !!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! Description: This verfication check ensures that a model supports all of the species that it claims. The verification check attempts to compute the energy for all clusters up to a preset size for all combinations of supported elements. Several random samples are generated for each cluster. The check is successful if all elements appear in at least one successful 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. Author: Ellad Tadmor -------------------------------------------------------------------------------- Results for KIM Model : Three_Body_Stillinger_Weber_CdTeZnSeHgS__MO_503261197030_000 Supported species : Cd Hg S Se Te Zn 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 -------------------------------- CdCd 10 / 10 yes CdHg 10 / 10 yes CdS 10 / 10 yes CdSe 10 / 10 yes CdTe 10 / 10 yes CdZn 10 / 10 yes HgHg 10 / 10 yes HgS 10 / 10 yes HgSe 10 / 10 yes HgTe 10 / 10 yes HgZn 10 / 10 yes SS 10 / 10 yes SSe 10 / 10 yes STe 10 / 10 yes SZn 10 / 10 yes SeSe 10 / 10 yes SeTe 10 / 10 yes SeZn 10 / 10 yes TeTe 10 / 10 yes TeZn 10 / 10 yes ZnZn 10 / 10 yes CdCdCd 10 / 10 yes CdCdHg 10 / 10 yes CdCdS 10 / 10 yes CdCdSe 10 / 10 yes CdCdTe 10 / 10 yes CdCdZn 10 / 10 yes CdHgHg 10 / 10 yes CdHgS 10 / 10 yes CdHgSe 10 / 10 yes CdHgTe 10 / 10 yes CdHgZn 10 / 10 yes CdSS 10 / 10 yes CdSSe 10 / 10 yes CdSTe 10 / 10 yes CdSZn 10 / 10 yes CdSeSe 10 / 10 yes CdSeTe 10 / 10 yes CdSeZn 10 / 10 yes CdTeTe 10 / 10 yes CdTeZn 10 / 10 yes CdZnZn 10 / 10 yes HgHgHg 10 / 10 yes HgHgS 10 / 10 yes HgHgSe 10 / 10 yes HgHgTe 10 / 10 yes HgHgZn 10 / 10 yes HgSS 10 / 10 yes HgSSe 10 / 10 yes HgSTe 10 / 10 yes HgSZn 10 / 10 yes HgSeSe 10 / 10 yes HgSeTe 10 / 10 yes HgSeZn 10 / 10 yes HgTeTe 10 / 10 yes HgTeZn 10 / 10 yes HgZnZn 10 / 10 yes SSS 10 / 10 yes SSSe 10 / 10 yes SSTe 10 / 10 yes SSZn 10 / 10 yes SSeSe 10 / 10 yes SSeTe 10 / 10 yes SSeZn 10 / 10 yes STeTe 10 / 10 yes STeZn 10 / 10 yes SZnZn 10 / 10 yes SeSeSe 10 / 10 yes SeSeTe 10 / 10 yes SeSeZn 10 / 10 yes SeTeTe 10 / 10 yes SeTeZn 10 / 10 yes SeZnZn 10 / 10 yes TeTeTe 10 / 10 yes TeTeZn 10 / 10 yes TeZnZn 10 / 10 yes ZnZnZn 10 / 10 yes CdCdCdCd 10 / 10 yes CdCdCdHg 10 / 10 yes CdCdCdS 10 / 10 yes CdCdCdSe 10 / 10 yes CdCdCdTe 10 / 10 yes CdCdCdZn 10 / 10 yes CdCdHgHg 10 / 10 yes CdCdHgS 10 / 10 yes CdCdHgSe 10 / 10 yes CdCdHgTe 10 / 10 yes CdCdHgZn 10 / 10 yes CdCdSS 10 / 10 yes CdCdSSe 10 / 10 yes CdCdSTe 10 / 10 yes CdCdSZn 10 / 10 yes CdCdSeSe 10 / 10 yes CdCdSeTe 10 / 10 yes CdCdSeZn 10 / 10 yes CdCdTeTe 10 / 10 yes CdCdTeZn 10 / 10 yes CdCdZnZn 10 / 10 yes CdHgHgHg 10 / 10 yes CdHgHgS 10 / 10 yes CdHgHgSe 10 / 10 yes CdHgHgTe 10 / 10 yes CdHgHgZn 10 / 10 yes CdHgSS 10 / 10 yes CdHgSSe 10 / 10 yes CdHgSTe 10 / 10 yes CdHgSZn 10 / 10 yes CdHgSeSe 10 / 10 yes CdHgSeTe 10 / 10 yes CdHgSeZn 10 / 10 yes CdHgTeTe 10 / 10 yes CdHgTeZn 10 / 10 yes CdHgZnZn 10 / 10 yes CdSSS 10 / 10 yes CdSSSe 10 / 10 yes CdSSTe 10 / 10 yes CdSSZn 10 / 10 yes CdSSeSe 10 / 10 yes CdSSeTe 10 / 10 yes CdSSeZn 10 / 10 yes CdSTeTe 10 / 10 yes CdSTeZn 10 / 10 yes CdSZnZn 10 / 10 yes CdSeSeSe 10 / 10 yes CdSeSeTe 10 / 10 yes CdSeSeZn 10 / 10 yes CdSeTeTe 10 / 10 yes CdSeTeZn 10 / 10 yes CdSeZnZn 10 / 10 yes CdTeTeTe 10 / 10 yes CdTeTeZn 10 / 10 yes CdTeZnZn 10 / 10 yes CdZnZnZn 10 / 10 yes HgHgHgHg 10 / 10 yes HgHgHgS 10 / 10 yes HgHgHgSe 10 / 10 yes HgHgHgTe 10 / 10 yes HgHgHgZn 10 / 10 yes HgHgSS 10 / 10 yes HgHgSSe 10 / 10 yes HgHgSTe 10 / 10 yes HgHgSZn 10 / 10 yes HgHgSeSe 10 / 10 yes HgHgSeTe 10 / 10 yes HgHgSeZn 10 / 10 yes HgHgTeTe 10 / 10 yes HgHgTeZn 10 / 10 yes HgHgZnZn 10 / 10 yes HgSSS 10 / 10 yes HgSSSe 10 / 10 yes HgSSTe 10 / 10 yes HgSSZn 10 / 10 yes HgSSeSe 10 / 10 yes HgSSeTe 10 / 10 yes HgSSeZn 10 / 10 yes HgSTeTe 10 / 10 yes HgSTeZn 10 / 10 yes HgSZnZn 10 / 10 yes HgSeSeSe 10 / 10 yes HgSeSeTe 10 / 10 yes HgSeSeZn 10 / 10 yes HgSeTeTe 10 / 10 yes HgSeTeZn 10 / 10 yes HgSeZnZn 10 / 10 yes HgTeTeTe 10 / 10 yes HgTeTeZn 10 / 10 yes HgTeZnZn 10 / 10 yes HgZnZnZn 10 / 10 yes SSSS 10 / 10 yes SSSSe 10 / 10 yes SSSTe 10 / 10 yes SSSZn 10 / 10 yes SSSeSe 10 / 10 yes SSSeTe 10 / 10 yes SSSeZn 10 / 10 yes SSTeTe 10 / 10 yes SSTeZn 10 / 10 yes SSZnZn 10 / 10 yes SSeSeSe 10 / 10 yes SSeSeTe 10 / 10 yes SSeSeZn 10 / 10 yes SSeTeTe 10 / 10 yes SSeTeZn 10 / 10 yes SSeZnZn 10 / 10 yes STeTeTe 10 / 10 yes STeTeZn 10 / 10 yes STeZnZn 10 / 10 yes SZnZnZn 10 / 10 yes SeSeSeSe 10 / 10 yes SeSeSeTe 10 / 10 yes SeSeSeZn 10 / 10 yes SeSeTeTe 10 / 10 yes SeSeTeZn 10 / 10 yes SeSeZnZn 10 / 10 yes SeTeTeTe 10 / 10 yes SeTeTeZn 10 / 10 yes SeTeZnZn 10 / 10 yes SeZnZnZn 10 / 10 yes TeTeTeTe 10 / 10 yes TeTeTeZn 10 / 10 yes TeTeZnZn 10 / 10 yes TeZnZnZn 10 / 10 yes ZnZnZnZn 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 configrations.