{ "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" [ "Zn" "Zn" "Zn" "Zn" ] } "a" { "source-value" [ 5.8312 5.440489 5.198341 5.022409 4.884147 4.770234 4.673366 4.589099 4.514529 4.447652 4.387029 4.331589 4.280516 4.233171 4.189047 4.147734 4.108895 4.07225 4.037564 4.004639 3.973304 3.943413 3.914839 3.88747 3.868838 3.849229 3.828534 3.806626 3.783354 3.758536 3.731954 3.703336 3.672345 3.638551 3.601396 3.560138 3.513755 3.460793 3.399071 3.325105 3.232806 3.10998 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.8312e-10 5.440489000000001e-10 5.198341e-10 5.022409e-10 4.884147e-10 4.770234e-10 4.673366e-10 4.5890990000000004e-10 4.5145289999999997e-10 4.447652e-10 4.3870290000000004e-10 4.3315890000000004e-10 4.280516000000001e-10 4.233171e-10 4.1890470000000007e-10 4.147734e-10 4.1088950000000006e-10 4.0722500000000006e-10 4.037564e-10 4.0046390000000003e-10 3.9733040000000004e-10 3.943413e-10 3.9148390000000003e-10 3.88747e-10 3.8688380000000003e-10 3.849229e-10 3.828534e-10 3.806626e-10 3.7833540000000004e-10 3.758536e-10 3.731954e-10 3.703336e-10 3.672345e-10 3.638551e-10 3.601396e-10 3.560138e-10 3.5137550000000004e-10 3.460793e-10 3.399071e-10 3.3251050000000003e-10 3.2328060000000003e-10 3.1099800000000005e-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" [ 0.0484696 0.0704018 0.114265 0.187224 0.288294 0.413021 0.556552 0.712181 0.863976 0.983134 1.05364 1.09301 1.12382 1.15475 1.18628 1.21699 1.24559 1.27122 1.29335 1.31167 1.32599 1.3362 1.34236 1.34442 1.3434 1.34 1.33361 1.32345 1.3085 1.28745 1.25852 1.21935 1.16667 1.09588 1.00038 0.870323 0.690533 0.436409 0.0655555 -0.501441 -1.43197 -3.14469 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 7.76568599395277e-21 1.1279611802223745e-20 1.83072711575712e-20 2.9996591565265924e-20 4.6189790671691524e-20 6.617325900994368e-20 8.916946026594817e-20 1.1410397479779647e-19 1.384242148132301e-19 1.5751543099135873e-19 1.6881173747397119e-19 1.7511950683006083e-19 1.8005581299874562e-19 1.8501134528688001e-19 1.900630081722624e-19 1.9498329257473922e-19 1.995655177102272e-19 2.0367189638933762e-19 2.07217513251168e-19 2.1015270082047359e-19 2.1244701774145922e-19 2.1408284007129602e-19 2.1506978086970882e-19 2.153998292535936e-19 2.15236407238272e-19 2.1469166718720002e-19 2.136678763265088e-19 2.12040064879776e-19 2.0964481083168002e-19 2.0627222904489601e-19 2.0163713208092163e-19 1.95361406257248e-19 1.8692113981887361e-19 1.755793315202304e-19 1.6027854479159043e-19 1.3944111631445183e-19 1.1063558284908864e-19 6.992042969067072e-20 1.0503148946485441e-20 -8.033970469105729e-20 -2.294268855686976e-19 -5.038348797663553e-19 ] } }