{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.0529205 -13.0159901 -24.0118405 ] [ -19.7782812 29.6877971 -5.9465037 ] [ -6.4114434 -3.4599642 12.1742592 ] [ 7.4537266 -23.5759656 17.594022 ] [ 21.9480088 -3.5440351 -16.3335263 ] [ 10.8409097 13.9081579 16.5235894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.251526067906105e-08 -2.085391503478425e-08 -3.847120947147858e-08 ] [ -3.168829973824817e-08 4.756509443667404e-08 -9.527349203640699e-09 ] [ -1.027226472106246e-08 -5.543473750044975e-09 1.950531346579931e-08 ] [ 1.194218649635507e-08 -3.777286089710505e-08 2.818873071424086e-08 ] [ 3.516458657247266e-08 -5.678170180514589e-09 -2.616919397308193e-08 ] [ 1.736905206954394e-08 2.228332542577483e-08 2.64737086283787e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.860289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.623928030533142e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5751531 0.6576043 -0.4020846 ] [ -0.0384789 3.2073721 1.4112413 ] [ -0.072063 1.6845888 2.925202 ] [ 1.3200428 0.1932718 2.4507645 ] [ 3.5981447 2.2114759 0.2927924 ] [ 3.0455901 2.9314692 1.8940863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.751531e-11 6.576043e-11 -4.020846000000001e-11 ] [ -3.84789e-12 3.207372100000001e-10 1.4112413e-10 ] [ -7.2063e-12 1.6845888e-10 2.925202e-10 ] [ 1.3200428e-10 1.932718e-11 2.4507645e-10 ] [ 3.5981447e-10 2.2114759e-10 2.927924e-11 ] [ 3.0455901e-10 2.9314692e-10 1.8940863e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1178951 -0.4011306 1.4870012 ] [ 1.1416091 -3.1561368 2.1919074 ] [ -1.2805984 0.2795876 0.3554268 ] [ -2.136529 3.665674 -2.1648163 ] [ 1.9968916 0.4606116 -1.8448357 ] [ -0.8392685 -0.8486057 -0.0246834 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.791065393726878e-09 -6.426820692074765e-10 2.382438557741545e-09 ] [ 1.829059410112529e-09 -5.056688593006526e-09 3.511822791238514e-09 ] [ -2.051744817113887e-09 4.479487161855821e-10 5.694565093657575e-10 ] [ -3.423096813461203e-09 5.873057182274419e-09 -3.468418064186759e-09 ] [ 3.199373035791905e-09 7.379811367892813e-10 -2.955752627757203e-09 ] [ -1.344656369273885e-09 -1.359616212817619e-09 -3.954716640185473e-11 ] ] } "relaxed-potential-energy" { "source-value" -22.629079 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.625578132403625e-18 } }