{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8983294 -16.4946568 2.2833684 ] [ -16.0745319 4.9053953 4.0897599 ] [ -9.6213459 13.0675746 2.4283257 ] [ -1.4193462 -11.3687216 -24.9390938 ] [ 8.8209728 -1.6242301 18.9681515 ] [ 6.0552594 11.9354219 -7.7727148 ] [ 13.1373212 -0.4207833 4.9422031 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.439282362457292e-09 -2.642735349307974e-08 3.658359467153503e-09 ] [ -2.575423920048381e-08 7.859309665442203e-09 6.552517696465346e-09 ] [ -1.541509546160993e-08 2.093656251467991e-08 3.890606664227795e-09 ] [ -2.274043298461321e-09 -1.821469995590397e-08 -3.995683303029823e-08 ] [ 1.413275639287271e-08 -2.602303493019646e-09 3.039032887309245e-08 ] [ 9.701595043559435e-09 1.912265392756431e-08 -1.245326193270615e-08 ] [ 2.10483088865802e-08 -6.741691656830727e-10 7.918282262065285e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.813896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.412141810936264e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9138126 0.7735916 3.27163 ] [ 1.5312999 3.865903 4.861907 ] [ 1.8438969 5.0483099 2.834453 ] [ 3.2264035 1.9559958 1.2441744 ] [ 3.3692196 2.3798152 4.9468214 ] [ 3.8328941 4.1336864 1.9394804 ] [ 5.0569584 3.6686728 3.9078557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9138126e-10 7.735916000000001e-11 3.27163e-10 ] [ 1.5312999e-10 3.865903e-10 4.861907000000001e-10 ] [ 1.8438969e-10 5.0483099e-10 2.834453e-10 ] [ 3.2264035e-10 1.9559958e-10 1.2441744e-10 ] [ 3.3692196e-10 2.3798152e-10 4.9468214e-10 ] [ 3.8328941e-10 4.1336864e-10 1.9394804e-10 ] [ 5.0569584e-10 3.6686728e-10 3.9078557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 -1.62e-05 -3e-07 ] [ 4.4e-06 1.6e-06 -9.6e-06 ] [ -7e-06 1.8e-06 -7.1e-06 ] [ 1.5e-06 5.3e-06 6.5e-06 ] [ -2.7e-06 -1.13e-05 1.19e-05 ] [ -5.4e-06 1.02e-05 2.5e-06 ] [ 1.97e-05 8.5e-06 -3.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.68228545184e-14 -2.595526125696e-14 -4.8065298624e-16 ] [ 7.04957713152e-15 2.56348259328e-15 -1.538089555968e-14 ] [ -1.12152363456e-14 2.88391791744e-15 -1.137545400768e-14 ] [ 2.4032649312e-15 8.491536090240001e-15 1.04141480352e-14 ] [ -4.32587687616e-15 -1.810459581504e-14 1.906590178752e-14 ] [ -8.65175375232e-15 1.634220153216e-14 4.005441552e-15 ] [ 3.156287942976e-14 1.36185012768e-14 -6.24848882112e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }