{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "C" "C" ] } "a" { "source-value" [ 3.51765 3.281954 3.13588 3.029749 2.946343 2.877625 2.81919 2.768356 2.723371 2.683028 2.646458 2.613014 2.582204 2.553643 2.527026 2.502104 2.478674 2.456568 2.435644 2.415782 2.396879 2.378848 2.36161 2.3451 2.33386 2.322031 2.309547 2.296331 2.282292 2.267321 2.251285 2.234021 2.215326 2.19494 2.172526 2.147637 2.119657 2.087708 2.050474 2.005854 1.950174 1.87608 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.51765e-10 3.281954e-10 3.13588e-10 3.029749e-10 2.946343e-10 2.877625e-10 2.81919e-10 2.768356e-10 2.723371e-10 2.683028e-10 2.646458e-10 2.6130140000000005e-10 2.582204e-10 2.553643e-10 2.527026e-10 2.5021040000000003e-10 2.478674e-10 2.4565679999999997e-10 2.435644e-10 2.415782e-10 2.3968790000000003e-10 2.3788480000000004e-10 2.3616100000000005e-10 2.3451e-10 2.33386e-10 2.3220310000000002e-10 2.309547e-10 2.296331e-10 2.282292e-10 2.267321e-10 2.2512850000000004e-10 2.234021e-10 2.215326e-10 2.19494e-10 2.172526e-10 2.147637e-10 2.1196570000000002e-10 2.0877080000000002e-10 2.050474e-10 2.0058539999999998e-10 1.9501740000000001e-10 1.87608e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3.57574e-21 0.00646698 0.431648 1.86397 3.50025 4.53476 4.87465 4.70755 4.19885 3.41828 2.52923 1.72513 1.15152 0.856236 0.786763 0.845519 0.907504 0.496428 -1.09119 -3.59486 -6.31851 -8.95867 -11.6559 -14.9109 -19.2147 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.7289670772591596e-40 1.0361244248545318e-21 6.915763397128319e-20 2.9864091804769796e-19 5.608018763158499e-19 7.26548651279784e-19 7.8100503289281e-19 7.5423266133867e-19 6.7272993596709e-19 5.47668834446952e-19 4.05227320801182e-19 2.76396297661242e-19 1.84493843758368e-19 1.3718413123896238e-19 1.2605332950957418e-19 1.3546707854030458e-19 1.4539817040615357e-19 7.953653420633519e-20 -1.7482791212544602e-19 -5.75960069450124e-19 -1.012336908369534e-18 -1.4353371745716778e-18 -1.86748106282406e-18 -2.3889895571910597e-18 -3.07853433693198e-18 ] } }