{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4265241 -2.4856912 -3.7050438 ] [ 6.7974086 -2.0341243 4.0777591 ] [ -3.3940197 1.3897595 4.3395031 ] [ 0.5911097 0.220726 -0.5586256 ] [ -6.4210227 2.90933 -4.1535928 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.887720182827762e-09 -3.982516327168297e-09 -5.936134555399991e-09 ] [ 1.089064914094486e-08 -3.259026397261166e-09 6.533290295274449e-09 ] [ -5.437819013874629e-09 2.226640179434697e-09 6.952650412709124e-09 ] [ 9.470621416681018e-10 3.536420368027009e-10 -8.950168761003726e-10 ] [ -1.028761245156609e-08 4.661260508192064e-09 -6.654789276483211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7397604 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.240046316347366e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.321143 1.1204165 2.0533066 ] [ 1.0974738 2.8437565 3.1897236 ] [ 1.2089158 -0.0775121 0.4326337 ] [ 3.0609878 -0.1590984 -0.765871 ] [ 2.913659 4.0768835 3.3125243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.21143e-11 1.1204165e-10 2.0533066e-10 ] [ 1.0974738e-10 2.8437565e-10 3.189723600000001e-10 ] [ 1.2089158e-10 -7.75121e-12 4.326337e-11 ] [ 3.0609878e-10 -1.590984e-11 -7.65871e-11 ] [ 2.913659e-10 4.0768835e-10 3.3125243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2885719 0.4099974 0.2101081 ] [ -0.2840321 -0.516557 -0.3049312 ] [ 0.8984233 0.0208918 -0.5348505 ] [ -0.9588269 -0.0906904 0.5004647 ] [ 0.0558637 0.176358 0.1292089 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.623431515998355e-10 6.568882488687859e-10 3.366302856607085e-10 ] [ -4.550695901767277e-10 -8.276155487105857e-10 -4.88553639592489e-10 ] [ 1.439432806841985e-09 3.347235352642944e-11 -8.569249667231905e-10 ] [ -1.53621004257414e-09 -1.453020386110003e-10 8.018328418756858e-10 ] [ 8.950351409138496e-11 2.825566644910464e-10 2.070154787792851e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.9074 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.747558127371392e-18 } }