{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7257286 -1.2651552 -3.3353387 ] [ 0.397509 -0.5965951 2.5489444 ] [ -1.4023093 -0.6041986 -2.2395512 ] [ -5.1071401 -5.1793431 6.4478802 ] [ 2.7545497 7.0614595 -3.1656864 ] [ -0.3422666 0.3556589 -2.9287862 ] [ 5.4253858 0.2281736 2.672538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.764922039545532e-09 -2.027002099823597e-09 -5.343801731615935e-09 ] [ 6.36879631604706e-10 -9.558507291788933e-10 4.083859159045149e-09 ] [ -2.246747194100896e-09 -9.680328792155125e-10 -3.588156603286661e-09 ] [ -8.182540534784422e-09 -8.298222494289124e-09 1.033064299527125e-08 ] [ 4.41327516653171e-09 1.131370541283732e-08 -5.071988780651577e-09 ] [ -5.483715491186243e-10 5.698283792541425e-10 -4.69243281562165e-09 ] [ 8.692426359195397e-09 3.655744104156624e-10 4.281877937077091e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.60305 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.98053720311337e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8742017 1.0831019 2.5895349 ] [ 2.5220885 2.6573228 0.7520224 ] [ 0.9300388 2.7180124 2.5947068 ] [ 2.151862 2.2479901 4.7282269 ] [ 2.7073974 4.2048904 3.3728049 ] [ 4.4759568 3.1232336 2.1217005 ] [ 4.5074078 1.8935817 4.2187572 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8742017e-10 1.0831019e-10 2.5895349e-10 ] [ 2.5220885e-10 2.6573228e-10 7.520224e-11 ] [ 9.300388e-11 2.7180124e-10 2.5947068e-10 ] [ 2.151862e-10 2.2479901e-10 4.7282269e-10 ] [ 2.7073974e-10 4.2048904e-10 3.3728049e-10 ] [ 4.4759568e-10 3.1232336e-10 2.1217005e-10 ] [ 4.5074078e-10 1.8935817e-10 4.2187572e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.3e-06 -7.3e-06 8.7e-06 ] [ 1.24e-05 -2.73e-05 -2.82e-05 ] [ 1.18e-05 1.53e-05 -1.6e-05 ] [ -1.98e-05 1.3e-05 1.7e-06 ] [ 2.6e-06 -3.6e-06 4.9e-05 ] [ -3.15e-05 9.4e-06 -2e-07 ] [ 3.38e-05 5e-07 -1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.49002426962e-14 -1.16958894282e-14 1.39389367158e-14 ] [ 1.98669902616e-14 -4.37394221082e-14 -4.51813810788e-14 ] [ 1.89056842812e-14 2.45133025002e-14 -2.5634826144e-14 ] [ -3.17230973532e-14 2.082829624199999e-14 2.7237002778e-15 ] [ 4.165659248399999e-15 -5.767835882399999e-15 7.850665506599998e-14 ] [ -5.046856397099999e-14 1.50604603596e-14 -3.204353268e-16 ] [ 5.415357022919999e-14 8.010883169999999e-16 -2.41928671734e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.08929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.539094429964985e-18 } }