{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5214804 -0.6731518 -3.0176377 ] [ 1.3223237 -0.0162226 -0.1048804 ] [ -0.6713273 1.9835375 -0.1243955 ] [ 4.7062171 -6.7613523 -6.0931058 ] [ -2.2213531 -3.7365536 6.0073081 ] [ -1.8149984 4.8437779 -2.6755018 ] [ 3.2006184 4.359965 6.0082131 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.244210188285432e-09 -1.078508076209437e-09 -4.834788572984684e-09 ] [ 2.118596117269753e-09 -2.599147044859008e-11 -1.680369248601523e-10 ] [ -1.075584904964788e-09 3.17797740898008e-09 -1.993035618327264e-10 ] [ 7.540191010029176e-09 -1.083288058005231e-08 -9.76223166082088e-09 ] [ -3.559000003361604e-09 -5.986618820286075e-09 9.62476859176247e-09 ] [ -2.907948003269406e-09 7.760587707727722e-09 -4.286626432868318e-09 ] [ 5.127955972582303e-09 6.985433990506271e-09 9.626218561604292e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.611399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.86035120125805e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6846131 3.0277447 1.2077789 ] [ 0.6558364 2.3233244 0.398028 ] [ 3.2032538 4.8786757 4.7634869 ] [ 4.1667221 1.7945586 2.5941459 ] [ 3.9395247 2.4747046 5.0100412 ] [ 3.1520173 5.1075554 2.2543518 ] [ 5.2145538 4.0190895 3.3184414 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6846131e-10 3.0277447e-10 1.2077789e-10 ] [ 6.558364e-11 2.3233244e-10 3.98028e-11 ] [ 3.2032538e-10 4.8786757e-10 4.763486900000001e-10 ] [ 4.1667221e-10 1.7945586e-10 2.5941459e-10 ] [ 3.9395247e-10 2.4747046e-10 5.0100412e-10 ] [ 3.1520173e-10 5.1075554e-10 2.2543518e-10 ] [ 5.2145538e-10 4.0190895e-10 3.318441400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.14e-05 1.6e-05 6.39e-05 ] [ -2.55e-05 -1.37e-05 2.83e-05 ] [ -1.9e-05 -2.26e-05 -2.39e-05 ] [ 5.9e-06 1.64e-05 -4.1e-05 ] [ -2.89e-05 -2.05e-05 1.03e-05 ] [ 4.27e-05 1.07e-05 -2.56e-05 ] [ -2.66e-05 1.36e-05 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.235187830912e-14 2.56348259328e-14 1.0237908606912e-13 ] [ -4.08555038304e-14 -2.194981970496e-14 4.534159836864e-14 ] [ -3.04413557952e-14 -3.620919163008e-14 -3.829202123712e-14 ] [ 9.45284206272e-15 2.627569658112e-14 -6.56892414528e-14 ] [ -4.630290434112001e-14 -3.28446207264e-14 1.650241919424e-14 ] [ 6.841294170816001e-14 1.714328984256e-14 -4.101572149248001e-14 ] [ -4.261789811328e-14 2.178960204288e-14 -1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.713372 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.677777387313334e-18 } }