{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.0805756 -50.843709 -0.2532507 ] [ -50.8484177 9.7169971 -40.7204889 ] [ -27.97223 92.2822704 43.6473199 ] [ 59.8197186 -69.5878524 31.2876122 ] [ 29.0815047 18.4322939 -33.9611926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.615086255052693e-08 -8.146060187455854e-08 -4.057523507412345e-10 ] [ -8.14681460436129e-08 1.55683455780014e-08 -6.524141530312591e-08 ] [ -4.481645293764039e-08 1.478524961492239e-07 6.99307155043586e-08 ] [ 9.584175460375491e-08 -1.114920302069612e-07 5.012828078749685e-08 ] [ 4.659370692802532e-08 2.953179035429446e-08 -5.441182879820596e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 46.23665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.407927965411233e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9908816 -0.5410322 1.7403059 ] [ 0.248744 1.714155 1.012967 ] [ 0.9877751 2.8832111 3.075192 ] [ 1.7952343 0.5801351 3.9255378 ] [ 1.7654918 2.3898347 -0.7166546 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.908816e-11 -5.410322e-11 1.7403059e-10 ] [ 2.48744e-11 1.714155e-10 1.012967e-10 ] [ 9.877751e-11 2.8832111e-10 3.075192e-10 ] [ 1.7952343e-10 5.801351000000001e-11 3.9255378e-10 ] [ 1.7654918e-10 2.3898347e-10 -7.166546e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.16e-05 6.26e-05 -1.6e-05 ] [ -5.39e-05 -1.14e-05 2.01e-05 ] [ 4e-06 -2.78e-05 -5.8e-06 ] [ 7.8e-06 -6.3e-06 1.71e-05 ] [ 3.05e-05 -1.71e-05 -1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.858524880128e-14 1.0029625646208e-13 -2.56348259328e-14 ] [ -8.635731986112e-14 -1.826481347712e-14 3.220375007808e-14 ] [ 6.4087064832e-15 -4.454051005824e-14 -9.292624400640001e-15 ] [ 1.249697764224e-14 -1.009371271104e-14 2.739722021568e-14 ] [ 4.88663869344e-14 -2.739722021568e-14 -2.48337376224e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }