{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6624345 -1.2551933 1.8458404 ] [ 0.4171093 -3.5579227 -3.0423033 ] [ 1.6572223 4.7145548 2.0812048 ] [ -1.2412894 3.8292223 -5.9735964 ] [ 3.8293923 -3.7306612 5.0888545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.470043613455471e-09 -2.011041376413352e-09 2.957362358973213e-09 ] [ 6.682827742840961e-10 -5.700420615518192e-09 -4.874307260801092e-09 ] [ 2.655162846403738e-09 7.553549540272542e-09 3.334457701128643e-09 ] [ -1.988764872711879e-09 6.135090495451738e-09 -9.570756573026517e-09 ] [ 6.135362865479517e-09 -5.9771782040104e-09 8.153243773725753e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.483588 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.000091300208279e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3890037 2.2220062 1.3047725 ] [ 2.2656156 4.2892391 2.8109131 ] [ 4.4479177 5.6097405 2.5851212 ] [ 3.4844053 4.4066766 0.5402711 ] [ 4.5053626 3.0517057 2.4836583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3890037e-10 2.2220062e-10 1.3047725e-10 ] [ 2.2656156e-10 4.2892391e-10 2.8109131e-10 ] [ 4.4479177e-10 5.6097405e-10 2.5851212e-10 ] [ 3.4844053e-10 4.4066766e-10 5.402711000000001e-11 ] [ 4.5053626e-10 3.0517057e-10 2.4836583e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.33e-05 3.98e-05 5e-06 ] [ -1.19e-05 9.7e-06 8.6e-06 ] [ -4.5e-06 8e-06 1.32e-05 ] [ -1.94e-05 -2.59e-05 -2.44e-05 ] [ 2.5e-06 -3.16e-05 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.33524819122e-14 6.376663003319999e-14 8.010883169999999e-15 ] [ -1.90659019446e-14 1.55411133498e-14 1.37787190524e-14 ] [ -7.209794853e-15 1.2817413072e-14 2.11487315688e-14 ] [ -3.10822266996e-14 -4.149637482059999e-14 -3.909310986959999e-14 ] [ 4.005441585e-15 -5.06287816344e-14 -4.165659248399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }