{ "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" [ [ 1.616061 2.621535 1.403689 ] [ 0.7250895 5.039665 2.091083 ] [ 2.961807 4.812326 1.76803 ] [ 3.86556 2.819524 0.0440365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.616061e-10 2.621535000000001e-10 1.403689e-10 ] [ 7.250895e-11 5.039665000000001e-10 2.091083e-10 ] [ 2.961807e-10 4.812326e-10 1.76803e-10 ] [ 3.86556e-10 2.819524e-10 4.40365e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6519627 -1.6580636 0.1506675 ] [ -4.4791876 1.3104425 0.6332667 ] [ 4.7564641 -0.0541498 -0.5225398 ] [ 0.3746862 0.4017709 -0.2613943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.044559395573644e-09 -2.656510735719483e-09 2.41395946014384e-10 ] [ -7.176449652897263e-09 2.099560336402704e-09 1.014605101471167e-09 ] [ 7.620695578694512e-09 -8.675754358099585e-11 -8.372010509975078e-10 ] [ 6.003134697763929e-10 6.437079428977746e-10 -4.187998362703815e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9674147 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.116302893975825e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2234924 2.3846414 1.1200916 ] [ 0.9504279 4.7011799 2.153404 ] [ 3.360788 5.2618603 1.5333856 ] [ 3.6338093 2.9453684 0.4999573 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2234924e-10 2.3846414e-10 1.1200916e-10 ] [ 9.504279e-11 4.7011799e-10 2.153404e-10 ] [ 3.360788e-10 5.2618603e-10 1.5333856e-10 ] [ 3.6338093e-10 2.9453684e-10 4.999573e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.07e-05 1.58e-05 3.9e-06 ] [ -6.1e-06 -2.99e-05 3.3e-06 ] [ 1.64e-05 -9.2e-06 -2.27e-05 ] [ 2.03e-05 2.32e-05 1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.918682225856e-14 2.531439060864e-14 6.24848882112e-15 ] [ -9.77327738688e-15 -4.790508096192e-14 5.28718284864e-15 ] [ 2.627569658112e-14 -1.474002491136e-14 -3.636940929216e-14 ] [ 3.252418540224e-14 3.717049760256e-14 2.48337376224e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6094174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379380727698872e-18 } }