{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.50208 -2.7205834 -0.0517663 ] [ -3.4912592 -1.3257044 0.4290007 ] [ -0.8741053 0.9787406 -1.313436 ] [ 5.3671019 -3.5654132 2.10346 ] [ -3.5678708 1.9356447 -2.1697425 ] [ 2.7827713 -0.574696 2.5259326 ] [ -2.7187178 5.2720117 -1.5234486 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.008774112398719e-09 -4.358855154328275e-09 -8.29387562886342e-11 ] [ -5.593613913477532e-09 -2.12401261327099e-09 6.873348975096438e-10 ] [ -1.40047108731556e-09 1.56811532006714e-09 -2.104356469454424e-09 ] [ 8.599045256477003e-09 -5.712421719595168e-09 3.37011446255364e-09 ] [ -5.716359228890886e-09 3.10124471006594e-09 -3.476310735296745e-09 ] [ 4.458491154625803e-09 -9.207645028532638e-10 4.046990190778868e-09 ] [ -4.355866133599884e-09 8.446693959914617e-09 -2.440833750020012e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.533445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.008079272252413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.598576 2.3094647 0.5780337 ] [ 2.4473953 1.2619126 4.3195278 ] [ 1.3806539 4.8664435 2.8059985 ] [ 2.2211016 3.6113362 4.649411 ] [ 4.1780122 1.3553316 2.683668 ] [ 3.2368455 4.5355947 1.3482937 ] [ 4.3063405 3.6946697 3.3781433 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.598576e-10 2.3094647e-10 5.780337e-11 ] [ 2.4473953e-10 1.2619126e-10 4.319527800000001e-10 ] [ 1.3806539e-10 4.8664435e-10 2.8059985e-10 ] [ 2.2211016e-10 3.6113362e-10 4.649411e-10 ] [ 4.178012200000001e-10 1.3553316e-10 2.683668e-10 ] [ 3.2368455e-10 4.5355947e-10 1.3482937e-10 ] [ 4.3063405e-10 3.6946697e-10 3.3781433e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.74e-05 8.2e-06 3.7e-05 ] [ -1.76e-05 4.5e-05 -1.48e-05 ] [ 1.27e-05 -1.82e-05 4.4e-06 ] [ -4.7e-06 -8.1e-06 3.6e-06 ] [ 1.27e-05 -4.85e-05 -1.73e-05 ] [ -4.62e-05 2.04e-05 -2.17e-05 ] [ 2.56e-05 1.3e-06 8.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.78778734316e-14 1.31378483988e-14 5.9280535458e-14 ] [ -2.81983087584e-14 7.209794852999999e-14 -2.37122141832e-14 ] [ 2.03476432518e-14 -2.915961473879999e-14 7.0495771896e-15 ] [ -7.530230179799999e-15 -1.29776307354e-14 5.767835882399999e-15 ] [ 2.03476432518e-14 -7.770556674899999e-14 -2.77176557682e-14 ] [ -7.40205604908e-14 3.26844033336e-14 -3.476723295779999e-14 ] [ 4.10157218304e-14 2.0828296242e-15 1.40991543792e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.392428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.946791838412735e-18 } }