{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Sb" "Sb" "Sb" "Sb" ] } "a" { "source-value" [ 5.73484 5.350585 5.112439 4.939414 4.803437 4.691407 4.596139 4.513265 4.439926 4.374155 4.314534 4.26001 4.209781 4.163218 4.119824 4.079193 4.040996 4.004956 3.970844 3.938463 3.907646 3.878249 3.850147 3.82323 3.804906 3.78562 3.765267 3.743721 3.720833 3.696426 3.670282 3.642137 3.611658 3.578422 3.541881 3.501304 3.455687 3.403599 3.342897 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.73484e-10 5.350584999999999e-10 5.112439e-10 4.939414000000001e-10 4.803437e-10 4.691407e-10 4.5961390000000003e-10 4.513265e-10 4.439926e-10 4.3741550000000004e-10 4.3145340000000004e-10 4.2600100000000004e-10 4.2097810000000004e-10 4.1632179999999997e-10 4.1198240000000005e-10 4.079193e-10 4.040996e-10 4.004956e-10 3.970844e-10 3.938463e-10 3.907646e-10 3.878249e-10 3.8501470000000005e-10 3.82323e-10 3.804906e-10 3.7856200000000005e-10 3.765267e-10 3.743721e-10 3.720833e-10 3.6964260000000003e-10 3.670282e-10 3.642137e-10 3.611658e-10 3.5784220000000006e-10 3.541881e-10 3.5013040000000003e-10 3.4556870000000003e-10 3.4035989999999997e-10 3.342897e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 4.17469 6.23783 8.06351 9.73425 11.2865 12.7387 14.1075 15.3956 16.6057 17.743 18.8064 19.7962 20.7129 21.5573 22.3269 23.0208 23.6379 24.1788 24.6401 25.0205 25.3182 25.5329 25.6651 25.7096 25.6872 25.6118 25.4683 25.2366 24.8899 24.3918 23.6916 22.718 21.3683 19.4919 16.8506 13.0691 7.52022 -0.913932 -14.3712 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 6.688590717087553e-19 9.994105390524864e-19 1.291916720358701e-18 1.55959877710224e-18 1.8082966430659202e-18 2.040964731938496e-18 2.2602706677936e-18 2.466647038318848e-18 2.6605264312018558e-18 2.8427419782854398e-18 3.013117440141312e-18 3.171700882068096e-18 3.3185724128968324e-18 3.4538602067571842e-18 3.577163719493952e-18 3.688338755211264e-18 3.787209074480832e-18 3.873870807899904e-18 3.947779215417408e-18 4.00872601407264e-18 4.0564228120738564e-18 4.090821544122433e-18 4.112002319049408e-18 4.119132005011968e-18 4.115543129381377e-18 4.103462717660544e-18 4.080471483152064e-18 4.043349050848128e-18 3.987801587404992e-18 3.907997169922944e-18 3.795812762934528e-18 3.6398248471334404e-18 3.4235790686240643e-18 3.1229466474971524e-18 2.6997637366452482e-18 2.0939006474897283e-18 1.2048720667272576e-18 -1.4642804834009856e-19 -2.302520065284096e-18 ] } }