{ "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" [ [ 2.279778 0.7751999 2.437046 ] [ 2.78251 2.893695 2.394675 ] [ 4.420807 1.465039 1.355448 ] [ 4.595919 1.28038 3.495826 ] [ 3.524345 3.582501 0.1223867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.279778e-10 7.751999000000001e-11 2.437046e-10 ] [ 2.78251e-10 2.893695e-10 2.394675e-10 ] [ 4.420807e-10 1.465039e-10 1.355448e-10 ] [ 4.595919e-10 1.28038e-10 3.495826e-10 ] [ 3.524345e-10 3.582501e-10 1.223867e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3463501 -10.4930525 -0.2836937 ] [ -2.5199686 12.0305313 -0.9066146 ] [ 3.5152262 -0.2367839 -10.1828623 ] [ 8.4746249 -2.707747 12.7535062 ] [ -0.1235324 1.4070522 -1.3803357 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.497450362003174e-08 -1.681172339632699e-08 -4.54527413608249e-10 ] [ -4.037434776070107e-09 1.927503598466263e-08 -1.452556716195944e-09 ] [ 5.632013234463625e-09 -3.793696287618451e-10 -1.631474390988572e-08 ] [ 1.357784588482954e-08 -4.338288938441338e-09 2.043336946686785e-08 ] [ -1.979207231913139e-10 2.254346139085206e-09 -2.211541587395603e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5036503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.041999646051891e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9842067 0.8746273 2.4021239 ] [ 1.6003534 3.3670468 1.8366554 ] [ 4.2549368 1.1418081 1.4336071 ] [ 5.7806601 1.0730911 3.2818763 ] [ 3.983202 3.5402417 0.8511191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9842067e-10 8.746273e-11 2.4021239e-10 ] [ 1.6003534e-10 3.3670468e-10 1.8366554e-10 ] [ 4.254936800000001e-10 1.1418081e-10 1.4336071e-10 ] [ 5.780660100000001e-10 1.0730911e-10 3.2818763e-10 ] [ 3.983202e-10 3.540241700000001e-10 8.511191000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.45e-05 1.93e-05 -3.7e-06 ] [ 8.1e-06 -1.09e-05 4e-07 ] [ -1.27e-05 5.2e-06 -1.85e-05 ] [ 6.6e-06 -8.1e-06 2.08e-05 ] [ -1.65e-05 -5.6e-06 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.32315610016e-14 3.092200878144e-14 -5.928053496960001e-15 ] [ 1.297763062848e-14 -1.746372516672e-14 6.408706483200001e-16 ] [ -2.034764308416e-14 8.33131842816e-15 -2.96402674848e-14 ] [ 1.057436569728e-14 -1.297763062848e-14 3.332527371264e-14 ] [ -2.64359142432e-14 -8.972189076479999e-15 1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }