{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.233852 -96.711546 -15.4915098 ] [ -42.4742813 14.7699329 63.6197746 ] [ -31.7618365 22.2670533 -51.0802839 ] [ -12.2440923 25.1764922 0.2374606 ] [ 40.5693446 18.135568 -51.7667699 ] [ 65.1447175 16.3624996 54.4813284 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.081602825621416e-08 -1.549489792392162e-07 -2.482013502694201e-08 ] [ -6.805130104480314e-08 2.366404137812785e-08 1.019301163244667e-07 ] [ -5.088807229322834e-08 3.567575250529259e-08 -8.183963732266639e-08 ] [ -1.961719858759932e-08 4.033718752892325e-08 3.804538248156203e-10 ] [ 6.499925597481407e-08 2.905638329391811e-08 -8.29395091514345e-08 ] [ 1.043733442070309e-07 2.621561453295435e-08 8.72887113517606e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 70.183082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.12445694082506e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.3909603 -0.2791686 1.2515593 ] [ 0.4882965 1.2211213 3.1069073 ] [ 0.3779815 1.5637335 -0.2069654 ] [ 0.3213492 3.1882979 1.6437608 ] [ 2.876478 1.541159 0.0823894 ] [ 2.9419711 1.366176 2.6084761 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3909603e-10 -2.791686e-11 1.2515593e-10 ] [ 4.882965000000001e-11 1.2211213e-10 3.1069073e-10 ] [ 3.779815000000001e-11 1.5637335e-10 -2.069654e-11 ] [ 3.213492e-11 3.1882979e-10 1.6437608e-10 ] [ 2.876478e-10 1.541159e-10 8.238940000000001e-12 ] [ 2.9419711e-10 1.366176e-10 2.6084761e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.02e-05 1.3e-06 -3.8e-06 ] [ -1.42e-05 -1e-05 3e-07 ] [ 9.7e-06 2e-06 2.81e-05 ] [ 1.65e-05 1.3e-06 -1.9e-05 ] [ -1.87e-05 3.9e-06 -2.3e-06 ] [ -3.4e-06 1.6e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.63422016668e-14 2.0828296242e-15 -6.088271209199999e-15 ] [ -2.27509082028e-14 -1.602176634e-14 4.806529901999999e-16 ] [ 1.55411133498e-14 3.204353268e-15 4.50211634154e-14 ] [ 2.6435914461e-14 2.0828296242e-15 -3.0441356046e-14 ] [ -2.99607030558e-14 6.248488872599999e-15 -3.685006258199999e-15 ] [ -5.4474005556e-15 2.5634826144e-15 -5.1269652288e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.642267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.506167469018928e-18 } }