{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9581654 -2.0851841 -0.2621093 ] [ -1.4213844 -0.2106933 0.6085584 ] [ 0.7149062 2.8880054 0.7838079 ] [ -0.1036864 2.4684365 -4.111558 ] [ 3.7683299 -3.0605645 2.9813009 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.73950344433948e-09 -3.34083321508389e-09 -4.199453925542535e-10 ] [ -2.277308854849836e-09 -3.375678794192006e-10 9.750180408714548e-10 ] [ 1.145405999704969e-09 4.627094732624153e-09 1.255798692578344e-09 ] [ -1.661239259749171e-10 3.95487125022938e-09 -6.587442102663206e-09 ] [ 6.037530065241602e-09 -4.903564888350441e-09 4.776570601549998e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.553198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.690808711027332e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2666317 2.72773 1.2669196 ] [ 2.3080286 4.0654131 3.3387528 ] [ 3.9929755 5.5631443 2.3380747 ] [ 3.9515793 4.2254615 0.2662405 ] [ 4.5730899 2.9976191 2.5147485 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2666317e-10 2.727730000000001e-10 1.2669196e-10 ] [ 2.3080286e-10 4.0654131e-10 3.3387528e-10 ] [ 3.9929755e-10 5.5631443e-10 2.3380747e-10 ] [ 3.9515793e-10 4.2254615e-10 2.662405e-11 ] [ 4.5730899e-10 2.9976191e-10 2.5147485e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 8.7e-06 3.7e-06 ] [ 7.2e-06 -2e-06 -8.3e-06 ] [ -3e-06 -1.07e-05 -3.9e-06 ] [ -4.6e-06 -2.1e-06 1.14e-05 ] [ -8.9e-06 6.2e-06 -3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474002491136e-14 1.393893660096e-14 5.928053496960001e-15 ] [ 1.153567166976e-14 -3.2043532416e-15 -1.329806595264e-14 ] [ -4.8065298624e-15 -1.714328984256e-14 -6.24848882112e-15 ] [ -7.370012455680001e-15 -3.36457090368e-15 1.826481347712e-14 ] [ -1.425937192512e-14 9.93349504896e-15 -4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }