{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.799229 1.39947 2.90942 ] [ 1.755424 3.290747 3.119725 ] [ 4.105166 3.028799 1.978791 ] [ 3.422089 4.791435 3.468124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.799229e-10 1.39947e-10 2.90942e-10 ] [ 1.755424e-10 3.290747e-10 3.119725e-10 ] [ 4.105166e-10 3.028799e-10 1.978791e-10 ] [ 3.422089e-10 4.791435e-10 3.468124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5370487 -3.4894405 -0.3435696 ] [ -2.6782171 1.6031053 0.7879167 ] [ 1.2624526 0.6890585 -0.2166344 ] [ 0.8787158 1.1972767 -0.2277127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.604468784600757e-10 -5.590700034833277e-09 -5.504591852727263e-10 ] [ -4.290976858399241e-09 2.56845785350156e-09 1.262381726278388e-09 ] [ 2.022672057252548e-09 1.103993428159089e-09 -3.470865738006096e-10 ] [ 1.407857922686617e-09 1.918248753172628e-09 -3.648359672050517e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7282877 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.23820819737696e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7211871 1.4913811 2.6127233 ] [ 1.4992373 3.2962232 3.5690207 ] [ 4.5417156 2.9590027 2.1690082 ] [ 3.319768 4.763844 3.1253078 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7211871e-10 1.4913811e-10 2.6127233e-10 ] [ 1.4992373e-10 3.2962232e-10 3.5690207e-10 ] [ 4.5417156e-10 2.9590027e-10 2.1690082e-10 ] [ 3.319768e-10 4.763844e-10 3.1253078e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.5e-06 -7.5e-06 -2e-06 ] [ 1.95e-05 1.3e-06 -6.8e-06 ] [ -1.04e-05 -3.2e-06 5.1e-06 ] [ -6.7e-06 9.4e-06 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.005441585e-15 -1.2016324755e-14 -3.204353268e-15 ] [ 3.1242444363e-14 2.0828296242e-15 -1.08948011112e-14 ] [ -1.66626369936e-14 -5.1269652288e-15 8.1711008334e-15 ] [ -1.07345834478e-14 1.50604603596e-14 6.088271209199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6375609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383889824873201e-18 } }