{ "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" [ 3.39552 3.168008 3.027005 2.924558 2.844048 2.777716 2.72131 2.672241 2.628818 2.589876 2.554575 2.522292 2.492552 2.464983 2.439289 2.415233 2.392616 2.371278 2.35108 2.331908 2.313661 2.296256 2.279617 2.26368 2.25283 2.241412 2.229361 2.216603 2.203052 2.188601 2.173122 2.156457 2.138411 2.118732 2.097096 2.073071 2.046062 2.015222 1.97928 1.936209 1.882463 1.81094 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.39552e-10 3.1680080000000003e-10 3.027005e-10 2.9245580000000005e-10 2.844048e-10 2.777716e-10 2.72131e-10 2.672241e-10 2.628818e-10 2.589876e-10 2.554575e-10 2.522292e-10 2.492552e-10 2.464983e-10 2.439289e-10 2.4152330000000003e-10 2.392616e-10 2.371278e-10 2.35108e-10 2.331908e-10 2.3136610000000002e-10 2.296256e-10 2.279617e-10 2.26368e-10 2.25283e-10 2.241412e-10 2.229361e-10 2.216603e-10 2.203052e-10 2.188601e-10 2.1731220000000003e-10 2.1564570000000002e-10 2.1384110000000002e-10 2.1187320000000003e-10 2.0970960000000002e-10 2.073071e-10 2.046062e-10 2.0152220000000002e-10 1.97928e-10 1.936209e-10 1.882463e-10 1.81094e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.17192 1.76939 2.25227 2.66055 3.01367 3.32315 3.59655 3.83928 4.05532 4.24777 4.41909 4.57129 4.70602 4.82468 4.92846 5.0184 5.0954 5.16023 5.21361 5.25616 5.28844 5.31095 5.32416 5.32847 5.32637 5.31947 5.30663 5.28646 5.25712 5.21624 5.16067 5.08619 4.987 4.85495 4.6783 4.43957 4.11169 3.65063 2.98007 1.95637 0.27533 -2.83274 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.8776228254479362e-19 2.834875291077312e-19 3.6085343377292164e-19 4.2626710084694407e-19 4.828431616806336e-19 5.324273237411521e-19 5.762308325538241e-19 6.151204656705024e-19 6.497338893862657e-19 6.805677784535616e-19 7.080162683211072e-19 7.324013964896833e-19 7.539875221017216e-19 7.729989498841345e-19 7.896263388547969e-19 8.04036315382272e-19 8.16373075362432e-19 8.267599863950785e-19 8.353124051969089e-19 8.421296667184129e-19 8.473014928503552e-19 8.509079924237761e-19 8.530244677398529e-19 8.537150058634177e-19 8.533785487730496e-19 8.522730469046977e-19 8.502158521235905e-19 8.469842618794368e-19 8.422834756740096e-19 8.357337776481792e-19 8.268304821663936e-19 8.148974706946752e-19 7.9900548079296e-19 7.77848738515296e-19 7.495462885088641e-19 7.112975260405056e-19 6.587653589977153e-19 5.848954037191105e-19 4.774598482347457e-19 3.134450275634496e-19 4.4112728900486405e-20 -4.5385498008049915e-19 ] } }