{ "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" [ "V" "V" "V" "V" "V" "V" "V" "V" ] } "a" { "source-value" [ 7.65927 7.146071 6.82801 6.596922 6.415315 6.265691 6.138455 6.02777 5.929822 5.841979 5.762351 5.689531 5.622446 5.560259 5.502302 5.448037 5.397022 5.348888 5.303328 5.260081 5.218923 5.179661 5.142129 5.10618 5.081707 5.05595 5.028766 4.99999 4.969422 4.936824 4.901908 4.864319 4.823611 4.779223 4.73042 4.676226 4.615302 4.545736 4.464663 4.367509 4.246272 4.08494 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.65927e-10 7.146071e-10 6.82801e-10 6.596922e-10 6.415315e-10 6.265691000000001e-10 6.138455e-10 6.02777e-10 5.929822e-10 5.841979000000001e-10 5.762351e-10 5.689530999999999e-10 5.622446e-10 5.560259e-10 5.502302e-10 5.448037000000001e-10 5.397022e-10 5.348888e-10 5.303327999999999e-10 5.260080999999999e-10 5.218923000000001e-10 5.179661e-10 5.142129e-10 5.10618e-10 5.081707e-10 5.05595e-10 5.028766e-10 4.99999e-10 4.969422e-10 4.936823999999999e-10 4.901908e-10 4.864319e-10 4.823611e-10 4.779223e-10 4.73042e-10 4.676226e-10 4.615302e-10 4.5457359999999997e-10 4.464663e-10 4.3675090000000005e-10 4.2462720000000005e-10 4.08494e-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" [ 0.9157 1.60716 2.12561 2.50177 2.78705 3.01204 3.19448 3.34528 3.47159 3.57834 3.67145 3.75225 3.81819 3.87436 3.922 3.96215 3.99563 4.02315 4.0453 4.06258 4.07543 4.08422 4.08929 4.09092 4.09014 4.08761 4.08296 4.07574 4.06538 4.05116 4.03213 4.00703 3.97419 3.93132 3.87515 3.80098 3.70171 3.56612 3.37541 3.09555 2.65763 1.89702 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4671131437537999e-19 2.57495419909944e-19 3.40560267499674e-19 4.0082774376421796e-19 4.465346387789699e-19 4.8258201086733595e-19 5.11812121378032e-19 5.359729450187519e-19 5.562100380828059e-19 5.733132736507559e-19 5.8823114028993e-19 6.0117672749265e-19 6.117414802172459e-19 6.207409063704239e-19 6.283736758548e-19 6.348064150403099e-19 6.401705024109419e-19 6.4457969250771e-19 6.481285137520199e-19 6.508970749755719e-19 6.529558719502619e-19 6.543641852115479e-19 6.55176488764986e-19 6.554376435563279e-19 6.55312673778876e-19 6.549073230904739e-19 6.54162310955664e-19 6.530055394259159e-19 6.513456844330919e-19 6.49067389259544e-19 6.460184471250421e-19 6.41996983773702e-19 6.36735435707646e-19 6.2986690447768795e-19 6.2086747832451e-19 6.08984134230132e-19 5.9307932678441395e-19 5.71355413804008e-19 5.40800303216994e-19 4.9596178793786995e-19 4.25799268781742e-19 3.03936111823068e-19 ] } }