{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5485971 0.5343947 2.664941 ] [ 1.37313 2.35631 1.443365 ] [ 2.145447 0.6526892 0.5854964 ] [ 2.929696 0.0722677 2.986283 ] [ 2.995983 2.738917 0.2990299 ] [ 2.823077 2.78342 2.858653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.485971e-11 5.343947e-11 2.664941e-10 ] [ 1.37313e-10 2.35631e-10 1.443365e-10 ] [ 2.145447e-10 6.526892e-11 5.854964e-11 ] [ 2.929696e-10 7.22677e-12 2.986283e-10 ] [ 2.995983e-10 2.738917e-10 2.990299e-11 ] [ 2.823077e-10 2.78342e-10 2.858653e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8757806 -0.4506981 -0.755575 ] [ -12.5012478 2.3260551 2.3033919 ] [ 1.3049636 -5.7699178 0.1838189 ] [ -1.5467925 3.1413414 -1.7365604 ] [ 6.3728665 2.0412183 -1.2461554 ] [ 4.4944296 -1.2879988 1.2510801 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.005331823070196e-09 -7.220979588589805e-10 -1.21056460026096e-09 ] [ -2.002920695598743e-08 3.726751099912606e-09 3.690440650720091e-09 ] [ 2.090782170915003e-09 -9.24442740309777e-09 2.945103440411732e-10 ] [ -2.478234780728784e-09 5.032983749031142e-09 -2.782276473487096e-09 ] [ 1.021045771377952e-08 3.270392238209121e-09 -1.996561047763672e-09 ] [ 7.200870028951496e-09 -2.063601564978455e-09 2.004451286968126e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.191253 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.395213012205786e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7844861 0.5900308 2.610795 ] [ 1.0038354 2.5365578 1.3676274 ] [ 1.9819196 0.4854761 0.622525 ] [ 3.0767361 0.3873488 2.6792166 ] [ 3.214214 2.4508808 0.6570878 ] [ 2.7547389 2.6877044 2.9005165 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.844861e-11 5.900308e-11 2.610795e-10 ] [ 1.0038354e-10 2.536557800000001e-10 1.3676274e-10 ] [ 1.9819196e-10 4.854761000000001e-11 6.22525e-11 ] [ 3.0767361e-10 3.873488e-11 2.6792166e-10 ] [ 3.214214e-10 2.4508808e-10 6.570878e-11 ] [ 2.7547389e-10 2.6877044e-10 2.9005165e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.9e-06 -7.6e-06 -1.8e-06 ] [ 1.28e-05 4.2e-06 1.81e-05 ] [ -1.65e-05 3.5e-05 1.7e-06 ] [ 1.76e-05 1.3e-05 3e-06 ] [ 1.42e-05 -3.27e-05 1.67e-05 ] [ -3.81e-05 -1.19e-05 -3.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586154854592e-14 -1.217654231808e-14 -2.88391791744e-15 ] [ 2.050786074624e-14 6.72914180736e-15 2.899939683648e-14 ] [ -2.64359142432e-14 5.6076181728e-14 2.72370025536e-15 ] [ 2.819830852608e-14 2.08282960704e-14 4.8065298624e-15 ] [ 2.275090801536e-14 -5.239117550016001e-14 2.675634956736e-14 ] [ -6.104292925248e-14 -1.906590178752e-14 -6.040205860416e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.007871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.166920287298232e-18 } }