{ "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 1.0778787412327872e-22 2.86044602994528e-20 9.43553855521536e-20 1.760519736233664e-19 2.561335676608128e-19 3.24112319504736e-19 3.7600041154596483e-19 4.1217595746700803e-19 4.351719985053505e-19 4.48072724656032e-19 4.53552168699168e-19 4.547393815751808e-19 4.553401978079809e-19 4.555356633557184e-19 4.55442737111712e-19 4.551367213771392e-19 4.545743573832384e-19 4.536995689482816e-19 4.518810984836736e-19 4.47471908423232e-19 4.392174944728704e-19 4.2535386017308807e-19 4.0350978412510083e-19 3.70791735351744e-19 3.242757415200576e-19 2.62252280175648e-19 1.867432982139648e-19 1.0751582453306688e-19 3.742748673253632e-20 -5.450492711598144e-20 -1.9244063827752962e-19 -4.230435214858944e-19 ] } }