{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5417903 0.5857551 0.1534459 ] [ -0.3959749 -0.9844766 -0.4724275 ] [ -2.23013 0.6467756 0.9304852 ] [ -5.4402285 1.9818291 -1.2026857 ] [ 1.8178844 -2.0105302 2.1614896 ] [ 2.7265346 -3.9763285 -5.3076732 ] [ 2.980124 3.7569755 3.7373657 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.680437520362182e-10 9.38483126734366e-10 2.458474335376147e-10 ] [ -6.344217272036179e-10 -1.577305392244673e-09 -7.569122955229921e-10 ] [ -3.573062147344704e-09 1.036248745223892e-09 1.490801633440412e-09 ] [ -8.716206914509853e-09 3.175240250441105e-09 -1.926914910710482e-09 ] [ 2.912571884997036e-09 -3.221224481852348e-09 3.463088103222343e-09 ] [ 4.368389991922279e-09 -6.370780559320733e-09 -8.503829911886723e-09 ] [ 4.77468499988498e-09 6.01933831101839e-09 5.987919947919827e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.113355 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.421426404285079e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9855272 3.1121061 1.1525032 ] [ 1.3182406 1.3874094 2.5372009 ] [ 1.2150324 2.82452 4.3431042 ] [ 1.6702996 4.5425785 2.9066113 ] [ 3.4116963 2.9338274 5.0502019 ] [ 4.2577181 3.2496037 1.5468276 ] [ 3.8920738 4.5204678 3.4411443 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9855272e-10 3.1121061e-10 1.1525032e-10 ] [ 1.3182406e-10 1.3874094e-10 2.5372009e-10 ] [ 1.2150324e-10 2.82452e-10 4.3431042e-10 ] [ 1.6702996e-10 4.5425785e-10 2.9066113e-10 ] [ 3.4116963e-10 2.9338274e-10 5.0502019e-10 ] [ 4.2577181e-10 3.2496037e-10 1.5468276e-10 ] [ 3.8920738e-10 4.5204678e-10 3.4411443e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.2e-06 1.2e-05 7.8e-06 ] [ -1.62e-05 -2.83e-05 -2.22e-05 ] [ 3.61e-05 2.25e-05 3.08e-05 ] [ 6.2e-06 -2.41e-05 -1.24e-05 ] [ -3.13e-05 2.54e-05 -1.25e-05 ] [ -2.5e-06 3e-06 -3.19e-05 ] [ 4e-07 -1.04e-05 4.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.153567166976e-14 1.92261194496e-14 1.249697764224e-14 ] [ -2.595526125696e-14 -4.534159836864e-14 -3.556832098176e-14 ] [ 5.783857601088001e-14 3.604897396800001e-14 4.934703992064001e-14 ] [ 9.93349504896e-15 -3.861245656128e-14 -1.986699009792e-14 ] [ -5.014812823104e-14 4.069528616832e-14 -2.002720776e-14 ] [ -4.005441552e-15 4.8065298624e-15 -5.110943420352001e-14 ] [ 6.408706483200001e-16 -1.666263685632e-14 6.488815314240001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }