{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.294147 0.068876 1.2160203 ] [ 0.5256169 1.684899 -0.4469967 ] [ -0.7887635 -2.1819423 0.1435153 ] [ -0.1230744 -0.1045137 -0.8491655 ] [ -0.9079261 0.532681 -0.0633734 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.073452067278458e-09 1.103515169342208e-10 1.948279295078202e-09 ] [ 8.421311086773715e-10 2.699505786209299e-09 -7.161676623147513e-10 ] [ -1.263738439040381e-09 -3.495856940994579e-09 2.299368583870983e-10 ] [ -1.971869262989875e-10 -1.67449406693305e-10 -1.360513111289942e-09 ] [ -1.454657970834123e-09 8.534490445443648e-10 -1.015353798606067e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.768076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.205888948059758e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3878433 2.8036412 0.7791512 ] [ 1.421625 1.4044677 2.6803265 ] [ 2.5637508 4.4622758 1.9789295 ] [ 2.5975245 3.063106 3.8801131 ] [ 3.5413004 2.2298873 1.7843949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3878433e-10 2.8036412e-10 7.791512e-11 ] [ 1.421625e-10 1.4044677e-10 2.6803265e-10 ] [ 2.563750800000001e-10 4.4622758e-10 1.9789295e-10 ] [ 2.5975245e-10 3.063106e-10 3.8801131e-10 ] [ 3.5413004e-10 2.2298873e-10 1.7843949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.4e-06 -5.7e-06 1.8e-06 ] [ 4e-07 -1.2e-06 3.3e-06 ] [ 6e-07 8.3e-06 8.9e-06 ] [ -4.6e-06 4.8e-06 -2.3e-06 ] [ -4.9e-06 -6.3e-06 -1.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.345828361472e-14 -9.13240673856e-15 2.88391791744e-15 ] [ 6.408706483200001e-16 -1.92261194496e-15 5.28718284864e-15 ] [ 9.6130597248e-16 1.329806595264e-14 1.425937192512e-14 ] [ -7.370012455680001e-15 7.69044777984e-15 -3.68500622784e-15 ] [ -7.850665441919999e-15 -1.009371271104e-14 -1.890568412544e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }