{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -36.1805562 -22.3063186 -1.416216 ] [ -5.1094597 15.646986 -15.6062639 ] [ -2.29675 21.4851537 22.2767201 ] [ 6.6099556 -6.8657102 -27.3359982 ] [ 33.9220654 -14.1091686 22.0662054 ] [ 3.0547449 6.1490578 0.0155526 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.796764174876382e-08 -3.573866245147959e-08 -2.269028183896944e-09 ] [ -8.18625694370465e-09 2.506923536172512e-08 -2.500399136461771e-08 ] [ -3.679799184139499e-09 3.442301123603864e-08 3.569124042637814e-08 ] [ 1.059031641409745e-08 -1.100008045825547e-08 -4.379709758310605e-08 ] [ 5.434914056089986e-08 -2.260538025608649e-08 3.535395869292463e-08 ] [ 4.894240901610666e-09 9.851876728275444e-09 2.49180123179484e-11 ] ] } "unrelaxed-potential-energy" { "source-value" 15.356073 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.460314135059828e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.8395282 1.2517627 1.7780743 ] [ 0.255991 2.1247884 -0.0744397 ] [ 0.7667688 0.7210007 3.3696734 ] [ 2.5392814 2.1392159 0.3588772 ] [ 2.8460551 1.2689629 2.4919339 ] [ 4.1872143 2.8767975 -1.0582857 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.395282e-11 1.2517627e-10 1.7780743e-10 ] [ 2.55991e-11 2.1247884e-10 -7.44397e-12 ] [ 7.667688000000001e-11 7.210007e-11 3.3696734e-10 ] [ 2.5392814e-10 2.1392159e-10 3.588772e-11 ] [ 2.8460551e-10 1.2689629e-10 2.4919339e-10 ] [ 4.1872143e-10 2.8767975e-10 -1.0582857e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 2.9e-06 -1.29e-05 ] [ 1.3e-06 -4.8e-06 3.03e-05 ] [ -3.13e-05 -8.6e-06 9.3e-06 ] [ 3.12e-05 -1.07e-05 9.1e-06 ] [ -7.7e-06 9.7e-06 -8.3e-06 ] [ -4.2e-06 1.15e-05 -2.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.73035076472e-14 4.6463122386e-15 -2.06680785786e-14 ] [ 2.0828296242e-15 -7.690447843199998e-15 4.854595201019999e-14 ] [ -5.014812864419999e-14 -1.37787190524e-14 1.49002426962e-14 ] [ 4.998791098079999e-14 -1.71432899838e-14 1.45798073694e-14 ] [ -1.23367600818e-14 1.55411133498e-14 -1.32980660622e-14 ] [ -6.729141862799999e-15 1.8425031291e-14 -4.42200750984e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.100622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.419386372726635e-18 } }