{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2686488 0.6692448 -0.7791153 ] [ 0.1978273 -2.8199844 -0.8356804 ] [ -5.4144637 2.1763403 2.3843813 ] [ -10.2053412 4.7641929 -3.1092482 ] [ 4.3447111 -4.8371123 4.2078718 ] [ 4.3785709 -8.015647 -10.7350018 ] [ 6.4300469 8.0629657 8.8667927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.304228265659751e-10 1.072248372151972e-09 -1.248280318567578e-09 ] [ 3.169542750159878e-10 -4.518113076700715e-09 -1.338907599340792e-09 ] [ -8.674927154310265e-09 3.486881547564858e-09 3.82019997393271e-09 ] [ -1.635075907792702e-08 7.633078481361352e-09 -4.981564774304483e-09 ] [ 6.96099454855025e-09 -7.749908239244117e-09 6.741753821283614e-09 ] [ 7.015243928495214e-09 -1.284248222398566e-08 -1.719936890820592e-08 ] [ 1.030207081382752e-08 1.291829513885231e-08 1.420616796542011e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.332771 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.815710074508024e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8348017 2.7266745 1.0268976 ] [ 1.5400543 1.2213827 2.8983145 ] [ 1.0042238 3.1439703 4.411765 ] [ 1.8171758 4.6960352 2.6720667 ] [ 3.4588532 2.3976773 4.1547615 ] [ 4.0853258 3.4765595 1.837367 ] [ 4.0101534 4.9082135 3.9764209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8348017e-10 2.7266745e-10 1.0268976e-10 ] [ 1.5400543e-10 1.2213827e-10 2.8983145e-10 ] [ 1.0042238e-10 3.1439703e-10 4.411765e-10 ] [ 1.8171758e-10 4.6960352e-10 2.6720667e-10 ] [ 3.4588532e-10 2.3976773e-10 4.154761500000001e-10 ] [ 4.0853258e-10 3.4765595e-10 1.837367e-10 ] [ 4.0101534e-10 4.9082135e-10 3.9764209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.4e-06 -1e-06 1e-07 ] [ 5.9e-06 -7e-07 1.21e-05 ] [ -1.49e-05 7.2e-06 3.2e-06 ] [ 1.15e-05 -4e-06 -5.5e-06 ] [ 1.3e-06 -6.5e-06 8.5e-06 ] [ 1.33e-05 4.81e-05 1.5e-05 ] [ -8.7e-06 -4.31e-05 -3.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.345828361472e-14 -1.6021766208e-15 1.6021766208e-16 ] [ 9.45284206272e-15 -1.12152363456e-15 1.938633711168e-14 ] [ -2.387243164992e-14 1.153567166976e-14 5.126965186560001e-15 ] [ 1.84250311392e-14 -6.4087064832e-15 -8.8119714144e-15 ] [ 2.08282960704e-15 -1.04141480352e-14 1.36185012768e-14 ] [ 2.130894905664e-14 7.706469546047999e-14 2.4032649312e-14 ] [ -1.393893660096e-14 -6.905381235648e-14 -5.351269913472e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.988725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.721893801220048e-18 } }