{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9973965 0.8777579 -0.5605921 ] [ 0.9123639 -0.8392838 0.0015603 ] [ 0.9018605 -2.5451844 0.9728853 ] [ -0.5295313 0.390865 -1.0051701 ] [ 0.7127034 2.1158454 0.5913166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.200182001133381e-09 1.406323197688908e-09 -8.981675638249913e-10 ] [ 1.461768122285113e-09 -1.344680893654729e-09 2.4998762020302e-12 ] [ 1.444939820227557e-09 -4.077834974901309e-09 1.55873409522208e-09 ] [ -8.484026758316442e-10 6.2623477004841e-10 -1.610460047415443e-09 ] [ 1.141876734452355e-09 3.389958061036383e-09 9.473936398163244e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.428554432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831056287245252e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5041161 1.6368965 0.0737754 ] [ 0.6119994 2.5153138 2.28592 ] [ 2.6356257 0.7331072 0.6364985 ] [ 1.5004821 0.3426633 2.6946199 ] [ 2.8668549 2.8930623 1.6152445 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.041161e-11 1.6368965e-10 7.377540000000001e-12 ] [ 6.119994e-11 2.5153138e-10 2.28592e-10 ] [ 2.6356257e-10 7.331071999999999e-11 6.364985e-11 ] [ 1.5004821e-10 3.426633e-11 2.6946199e-10 ] [ 2.8668549e-10 2.8930623e-10 1.6152445e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.36e-05 1.04e-05 -9.9e-06 ] [ 2.66e-05 1.77e-05 8e-06 ] [ 2.83e-05 -6.93e-05 -5.2e-06 ] [ -1.66e-05 -3.61e-05 -1.6e-06 ] [ -1.47e-05 7.72e-05 8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.78113685624e-14 1.66626369936e-14 -1.58615486766e-14 ] [ 4.26178984644e-14 2.83585264218e-14 1.2817413072e-14 ] [ 4.53415987422e-14 -1.110308407362e-13 -8.331318496799998e-15 ] [ -2.65961321244e-14 -5.783857648740001e-14 -2.5634826144e-15 ] [ -2.35519965198e-14 1.236880361448e-13 1.39389367158e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }