{ "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" [ "Ga" "Ga" ] } "a" { "source-value" [ 4.75401 4.435474 4.238058 4.094624 3.981903 3.889034 3.81006 3.741359 3.680564 3.626041 3.576617 3.531418 3.48978 3.451181 3.415208 3.381526 3.349862 3.319986 3.291708 3.264865 3.239318 3.214949 3.191653 3.16934 3.15415 3.138163 3.12129 3.103429 3.084456 3.064223 3.042551 3.01922 2.993953 2.966402 2.936111 2.902473 2.864659 2.82148 2.771159 2.710857 2.635607 2.53547 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.75401e-10 4.4354740000000003e-10 4.2380579999999996e-10 4.094624e-10 3.981903e-10 3.889034e-10 3.8100600000000003e-10 3.741359e-10 3.680564e-10 3.626041e-10 3.576617e-10 3.531418e-10 3.48978e-10 3.451181e-10 3.4152079999999997e-10 3.381526e-10 3.349862e-10 3.319986e-10 3.291708e-10 3.264865e-10 3.239318e-10 3.214949e-10 3.191653e-10 3.16934e-10 3.15415e-10 3.138163e-10 3.1212900000000003e-10 3.1034290000000003e-10 3.084456e-10 3.064223e-10 3.0425510000000003e-10 3.01922e-10 2.993953e-10 2.9664020000000003e-10 2.936111e-10 2.902473e-10 2.8646590000000003e-10 2.8214800000000004e-10 2.771159e-10 2.710857e-10 2.635607e-10 2.5354700000000004e-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 0.000672759 0.178535 0.58892 1.09883 1.59866 2.02295 2.34681 2.5726 2.71613 2.79665 2.83085 2.83826 2.84201 2.84323 2.84265 2.84074 2.83723 2.83177 2.82042 2.7929 2.74138 2.65485 2.51851 2.3143 2.02397 1.63685 1.16556 0.671061 0.233604 -0.340193 -1.20112 -2.64043 ] "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 1.077878750113206e-22 2.8604460535118995e-20 9.4355386329528e-20 1.7605197507382198e-19 2.56133569771044e-19 3.2411232217502996e-19 3.76000414643754e-19 4.1217596086283996e-19 4.35172002090642e-19 4.4807272834761e-19 4.5355217243589e-19 4.547393853216839e-19 4.55340201559434e-19 4.555356671087819e-19 4.5544274086401e-19 4.551367251269159e-19 4.54574361128382e-19 4.53699572686218e-19 4.518811022066279e-19 4.4747191210986e-19 4.39217498091492e-19 4.2535386367749e-19 4.0350978744953397e-19 3.7079173840661993e-19 3.2427574419169797e-19 2.6225228233628996e-19 1.8674329975250397e-19 1.0751582541886739e-19 3.74274870408936e-20 -5.45049275650362e-20 -1.92440639863008e-19 -4.2304352497126193e-19 ] } }