{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1795987 0.1700788 -0.1689354 ] [ -0.3610768 1.1928687 0.1449864 ] [ 1.0525639 -1.6409422 3.0473204 ] [ 1.1637282 0.346462 -2.3218896 ] [ -0.6756167 -0.0684673 -0.7014817 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.889925474636776e-09 2.724962792987591e-10 -2.706643505354436e-10 ] [ -5.785088120394911e-10 1.911186358569955e-09 2.322938223277776e-10 ] [ 1.686393286371912e-09 -2.629079250584555e-09 4.882345541191533e-09 ] [ 1.864498130366879e-09 5.55093320968908e-10 -3.720077263847606e-09 ] [ -1.082457290280188e-09 -1.096967082530682e-10 -1.123897588918598e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.397124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.466891230360061e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4470809 2.6940286 3.1311284 ] [ 2.6609223 4.6731136 1.5203441 ] [ 4.3866353 2.7833146 1.4325311 ] [ 4.7922696 1.9212402 3.8093798 ] [ 4.3460749 4.414198 3.4309377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4470809e-10 2.6940286e-10 3.1311284e-10 ] [ 2.6609223e-10 4.6731136e-10 1.5203441e-10 ] [ 4.3866353e-10 2.783314600000001e-10 1.4325311e-10 ] [ 4.7922696e-10 1.9212402e-10 3.8093798e-10 ] [ 4.3460749e-10 4.414198e-10 3.4309377e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-05 -2.42e-05 -8.7e-06 ] [ 1.3e-06 9.2e-06 -6.7e-06 ] [ -1.64e-05 -3e-07 -2.97e-05 ] [ 1.28e-05 -1.35e-05 3.06e-05 ] [ 1.93e-05 2.89e-05 1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.723700277799999e-14 -3.877267454279999e-14 -1.39389367158e-14 ] [ 2.0828296242e-15 1.47400250328e-14 -1.07345834478e-14 ] [ -2.62756967976e-14 -4.806529901999999e-16 -4.75846460298e-14 ] [ 2.05078609152e-14 -2.162938455899999e-14 4.90266050004e-14 ] [ 3.09220090362e-14 4.63029047226e-14 2.30713435296e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }