{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "diamond" ] } "species" { "source-value" [ "N" "N" "N" "N" "N" "N" "N" "N" ] } "a" { "source-value" [ 5.66214 5.282756 5.047628 4.876796 4.742542 4.631933 4.537872 4.456048 4.38364 4.318702 4.259836 4.206004 4.156411 4.110439 4.067595 4.027479 3.989766 3.954183 3.920503 3.888532 3.858106 3.829081 3.801335 3.77476 3.756668 3.737627 3.717532 3.696259 3.673662 3.649564 3.623753 3.595964 3.565872 3.533057 3.49698 3.456917 3.41188 3.360453 3.30052 3.228698 3.139075 3.01981 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.66214e-10 5.282756e-10 5.047628e-10 4.876796e-10 4.742542000000001e-10 4.6319330000000005e-10 4.5378720000000003e-10 4.456048e-10 4.38364e-10 4.3187020000000004e-10 4.259836e-10 4.206004e-10 4.1564110000000007e-10 4.1104390000000006e-10 4.067595e-10 4.027479e-10 3.989766e-10 3.954183e-10 3.920503e-10 3.8885320000000004e-10 3.858106e-10 3.829081e-10 3.801335e-10 3.7747600000000004e-10 3.756668e-10 3.737627e-10 3.717532e-10 3.6962590000000003e-10 3.673662e-10 3.649564e-10 3.623753e-10 3.595964e-10 3.5658720000000004e-10 3.533057e-10 3.4969800000000003e-10 3.456917e-10 3.41188e-10 3.3604530000000005e-10 3.3005200000000003e-10 3.2286980000000003e-10 3.1390750000000004e-10 3.0198100000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.25 ] [ 0.25 0.75 0.75 ] [ 0.75 0.75 0.25 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0.0129902 0.496405 1.27139 2.02543 2.6515 3.13443 3.49236 3.75137 3.93576 4.06509 4.15398 4.22156 4.2797 4.32934 4.37122 4.40602 4.4343 4.45658 4.47328 4.4848 4.49149 4.49366 4.49262 4.48921 4.48293 4.47312 4.45898 4.43945 4.41316 4.37827 4.33231 4.27185 4.19204 4.08574 3.94211 3.74385 3.46168 3.04185 2.37398 -3.56622 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 2.08125949109868e-21 7.953284920007699e-20 2.03699135070126e-19 3.2450966198026197e-19 4.248171345051e-19 5.02191050690862e-19 5.59537758951624e-19 6.01035735948858e-19 6.305782709031839e-19 6.512992213107059e-19 6.655409694103319e-19 6.76368479102904e-19 6.8568353405298e-19 6.936367388641559e-19 7.00346654607348e-19 7.059222292936679e-19 7.104531848146201e-19 7.140228343551719e-19 7.166984693339519e-19 7.185441768163199e-19 7.19616032984466e-19 7.19963705314044e-19 7.197970789441078e-19 7.192507367119139e-19 7.182445697857619e-19 7.166728345078079e-19 7.14407356747332e-19 7.112783057811299e-19 7.07066183410344e-19 7.014761891343179e-19 6.941125853244539e-19 6.844258253952899e-19 6.71638853679336e-19 6.54607716059916e-19 6.31595653065774e-19 5.9983089912009e-19 5.54622281038512e-19 4.8735809941329e-19 3.80353528558332e-19 -5.71371435570348e-19 ] } }