{ "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" [ "C" "C" "C" "C" ] } "a" { "source-value" [ 4.37421 4.081122 3.899477 3.767503 3.663787 3.578337 3.505672 3.44246 3.386522 3.336355 3.290879 3.249292 3.21098 3.175464 3.142365 3.111375 3.08224 3.054751 3.028732 3.004033 2.980528 2.958105 2.93667 2.91614 2.902163 2.887453 2.871929 2.855495 2.838038 2.819421 2.799481 2.778013 2.754765 2.729415 2.701543 2.670593 2.6358 2.596071 2.54977 2.494285 2.425047 2.33291 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.37421e-10 4.081122e-10 3.899477e-10 3.767503e-10 3.6637870000000003e-10 3.578337e-10 3.5056720000000005e-10 3.4424600000000004e-10 3.386522e-10 3.336355e-10 3.290879e-10 3.2492920000000004e-10 3.2109800000000004e-10 3.175464e-10 3.142365e-10 3.111375e-10 3.0822400000000003e-10 3.054751e-10 3.0287320000000005e-10 3.0040330000000004e-10 2.9805280000000003e-10 2.9581050000000004e-10 2.93667e-10 2.91614e-10 2.902163e-10 2.887453e-10 2.871929e-10 2.855495e-10 2.838038e-10 2.819421e-10 2.799481e-10 2.778013e-10 2.754765e-10 2.729415e-10 2.701543e-10 2.6705930000000004e-10 2.6358000000000003e-10 2.596071e-10 2.54977e-10 2.494285e-10 2.4250470000000004e-10 2.3329100000000004e-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" [ 1.91166 2.62624 3.16114 3.59413 3.95798 4.27027 4.54181 4.77985 4.98953 5.17471 5.33835 5.48279 5.60993 5.72137 5.81839 5.90214 5.97357 6.03353 6.08274 6.12186 6.15146 6.17205 6.1841 6.18803 6.18613 6.17986 6.16823 6.14997 6.12346 6.08659 6.03655 5.96961 5.88064 5.76244 5.60468 5.392 5.10069 4.69226 4.10025 3.19999 1.72854 -0.97588 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.0628169841524397e-19 4.20770036327616e-19 5.06470464480276e-19 5.758431105558419e-19 6.34138307383932e-19 6.84172681487118e-19 7.276781858067539e-19 7.658163984024899e-19 7.99410838064202e-19 8.29079944972614e-19 8.5529796341139e-19 8.784398027128859e-19 8.98809876437562e-19 9.16664532846858e-19 9.32208850549926e-19 9.45627079859676e-19 9.570714275563379e-19 9.66678078653802e-19 9.74562389869716e-19 9.808301048619239e-19 9.85572547698564e-19 9.8887142938797e-19 9.9080205223194e-19 9.91431707649102e-19 9.91127294088642e-19 9.901227293391238e-19 9.88259397913782e-19 9.853338233800979e-19 9.81086453123364e-19 9.75179227873806e-19 9.6716193599727e-19 9.56436965609274e-19 9.421824000965759e-19 9.232446722826958e-19 8.97968733704712e-19 8.638936410528e-19 8.17220633527746e-19 7.51782933265284e-19 6.5693247435585e-19 5.12694920703366e-19 2.76942639893436e-19 -1.5635321335879198e-19 ] } }