{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8841458 -7.4279384 -0.7773676 ] [ -4.0748574 5.4953502 -4.0120179 ] [ -3.1030461 1.826705 6.6214651 ] [ -0.7966867 0.082857 -0.4056855 ] [ 9.8587361 0.0230262 -1.426394 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.018734350938513e-09 -1.190086924522256e-08 -1.245480194487406e-09 ] [ -6.528641259373874e-09 8.804521613548604e-09 -6.427961281611112e-09 ] [ -4.971627914684619e-09 2.926704044098464e-09 1.060875657866313e-08 ] [ -1.276432804842303e-09 1.327515482696256e-10 -6.499798234975584e-10 ] [ 1.579543649005697e-08 3.689203930586496e-11 -2.285335118849395e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6802771 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.230516041088562e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4530225 -0.0350284 2.3214708 ] [ 1.0192385 3.4712693 0.955369 ] [ -0.5643217 2.0551252 1.9643796 ] [ 2.6660334 0.0900228 1.5352289 ] [ 3.015857 2.2569205 0.6905901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.530225e-11 -3.50284e-12 2.3214708e-10 ] [ 1.0192385e-10 3.4712693e-10 9.553690000000001e-11 ] [ -5.643217e-11 2.0551252e-10 1.9643796e-10 ] [ 2.6660334e-10 9.00228e-12 1.5352289e-10 ] [ 3.015857e-10 2.2569205e-10 6.905901e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.13e-05 1.87e-05 5.36e-05 ] [ 1.75e-05 2.41e-05 2.33e-05 ] [ -2.38e-05 -3.99e-05 -3.63e-05 ] [ 1.3e-06 -6.3e-06 -3.13e-05 ] [ 1.63e-05 3.4e-06 -9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.810459581504e-14 2.996070280896e-14 8.587666687488e-14 ] [ 2.8038090864e-14 3.861245656128e-14 3.733071526464e-14 ] [ -3.813180357504e-14 -6.392684716992e-14 -5.815901133504e-14 ] [ 2.08282960704e-15 -1.009371271104e-14 -5.014812823104e-14 ] [ 2.611547891904e-14 5.44740051072e-15 -1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }