{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3760578 -1.331526 -0.4247792 ] [ -1.7043978 2.1909746 -0.4620629 ] [ 2.9347821 -4.4427218 0.2043656 ] [ -3.3005154 -0.9460721 -1.267849 ] [ -0.3768867 -0.2670748 1.3083759 ] [ 0.07096 4.7964202 0.6419496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.806864288193445e-09 -2.133339844763484e-09 -6.805713088492128e-10 ] [ -2.730746330201005e-09 3.510328309807496e-09 -7.403063818182785e-10 ] [ 4.702039306501451e-09 -7.118025059322421e-09 3.274297891133904e-10 ] [ -5.288008654037163e-09 -1.515774612699311e-09 -2.031318043240266e-09 ] [ -6.038390644053678e-10 -4.279010040902231e-10 2.09624929546872e-09 ] [ 1.1369045394864e-10 7.684712371285606e-09 1.028516649325646e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.899038719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.066653843700776e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8698663 0.5891357 3.9438778 ] [ 2.0717033 2.7925586 4.0077238 ] [ 4.8444743 1.5671042 3.1434312 ] [ 3.2518086 2.8969944 1.8969509 ] [ 4.3040351 3.1924575 4.8537213 ] [ 4.3661455 4.6354236 3.00705 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8698663e-10 5.891357000000001e-11 3.9438778e-10 ] [ 2.0717033e-10 2.7925586e-10 4.0077238e-10 ] [ 4.8444743e-10 1.5671042e-10 3.1434312e-10 ] [ 3.2518086e-10 2.8969944e-10 1.8969509e-10 ] [ 4.3040351e-10 3.192457500000001e-10 4.8537213e-10 ] [ 4.3661455e-10 4.635423600000001e-10 3.00705e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.4e-06 5.9e-06 -2.94e-05 ] [ 2.36e-05 -1.69e-05 1.11e-05 ] [ -1.27e-05 1.19e-05 3.73e-05 ] [ -2.92e-05 -1.48e-05 -3.1e-05 ] [ 1.12e-05 4.3e-06 1.62e-05 ] [ 1.25e-05 9.7e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.6517538236e-15 9.452842140600001e-15 -4.710399303959999e-14 ] [ 3.78113685624e-14 -2.70767851146e-14 1.77841606374e-14 ] [ -2.03476432518e-14 1.90659019446e-14 5.97611884482e-14 ] [ -4.67835577128e-14 -2.37122141832e-14 -4.966747565399999e-14 ] [ 1.79443783008e-14 6.8893595262e-15 2.59552614708e-14 ] [ 2.0027207925e-14 1.55411133498e-14 -6.729141862799999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.647189719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.667173838991149e-18 } }