{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.4377169e-10 2.4676406e-10 -1.8187977e-10 ] [ -2.4196181e-10 -4.02378e-12 3.9544371e-10 ] [ 4.160608500000001e-10 4.2139005e-10 8.187885e-10 ] [ -1.3286463e-10 7.2234012e-10 4.2223533e-10 ] [ 8.5865078e-10 1.3340704e-10 -3.98997e-12 ] [ 4.5058074e-10 -2.332994e-10 4.851213200000001e-10 ] [ 5.5314369e-10 7.8024082e-10 1.6481688e-10 ] ] "source-value" [ [ 1.4377169 2.4676406 -1.8187977 ] [ -2.4196181 -0.0402378 3.9544371 ] [ 4.1606085 4.2139005 8.187885 ] [ -1.3286463 7.2234012 4.2223533 ] [ 8.5865078 1.3340704 -0.0398997 ] [ 4.5058074 -2.332994 4.8512132 ] [ 5.5314369 7.8024082 1.6481688 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ -4.8065298624e-16 -3.2043532416e-16 0.0 ] [ 0.0 0.0 0.0 ] [ -6.408706483200001e-16 4.8065298624e-16 3.2043532416e-16 ] [ 4.8065298624e-16 -4.8065298624e-16 -3.2043532416e-16 ] [ 1.6021766208e-16 -3.2043532416e-16 3.2043532416e-16 ] [ 4.8065298624e-16 6.408706483200001e-16 -1.6021766208e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -3e-07 -2e-07 -0.0 ] [ 0.0 0.0 0.0 ] [ -4e-07 3e-07 2e-07 ] [ 3e-07 -3e-07 -2e-07 ] [ 1e-07 -2e-07 2e-07 ] [ 3e-07 4e-07 -1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.670017985432635e-31 "source-value" 3.5389469e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.101455009968299e-09 -2.108073341659663e-09 -1.413506833373653e-08 ] [ -1.275308877942812e-08 -7.616167827564132e-09 1.384182066509021e-09 ] [ 4.061361841942796e-09 1.914495959069675e-09 1.420452621503677e-08 ] [ -1.007182617731156e-08 1.093568408270828e-08 2.837359946580849e-09 ] [ 1.244185571690735e-08 -3.518998139234767e-09 -6.344998172921157e-09 ] [ 4.453821093478916e-09 -1.257491215938791e-08 5.753690858365606e-09 ] [ 6.969331314378921e-09 1.296797158628618e-08 -3.699692579834563e-09 ] ] "source-value" [ [ -3.1840778 -1.3157559 -8.8224158 ] [ -7.959852 -4.7536381 0.8639385 ] [ 2.5349027 1.1949344 8.865768 ] [ -6.2863395 6.8255172 1.7709408 ] [ 7.7655956 -2.1963859 -3.9602364 ] [ 2.7798565 -7.8486429 3.5911714 ] [ 4.3499145 8.0939713 -2.3091665 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 9.186738470383274e-18 "source-value" 57.339112 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] } "instance-id" 1 }