{ "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" [ [ 2.058884 2.441785 3.519822 ] [ 1.92668 3.148467 1.175123 ] [ 5.519963 2.275692 0.7370638 ] [ 3.694005 1.670931 2.395445 ] [ 3.953137 3.917443 1.57665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.058884e-10 2.441785e-10 3.519822e-10 ] [ 1.92668e-10 3.148467e-10 1.175123e-10 ] [ 5.519963e-10 2.275692e-10 7.370638000000001e-11 ] [ 3.694005e-10 1.670931e-10 2.395445e-10 ] [ 3.953137e-10 3.917443e-10 1.57665e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -40.9768366 18.2719385 28.6726748 ] [ -29.5980694 -6.8432582 -7.8682981 ] [ 5.1148637 -1.6858217 -3.7738026 ] [ 40.721065 -25.9937143 -21.5667787 ] [ 24.7389773 16.2508557 4.5362045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.565212959486177e-08 2.927487268139542e-08 4.593868922036131e-08 ] [ -4.742133481349589e-08 -1.096410829813789e-08 -1.260640326130506e-08 ] [ 8.194915038718585e-09 -2.700984114577311e-09 -6.046298297234254e-09 ] [ 6.524233831707715e-08 -4.164652133921464e-08 -3.455378861910742e-08 ] [ 3.96362110525619e-08 2.603674107053442e-08 7.267800797067753e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0578235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.501349943032828e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0190123 2.0501049 3.8224605 ] [ 1.7792024 3.6483462 1.7848955 ] [ 5.8817862 2.4157286 1.5830771 ] [ 3.4554935 1.4799265 1.7261497 ] [ 4.0171746 3.8602119 0.487521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0190123e-10 2.0501049e-10 3.8224605e-10 ] [ 1.7792024e-10 3.6483462e-10 1.7848955e-10 ] [ 5.8817862e-10 2.4157286e-10 1.5830771e-10 ] [ 3.4554935e-10 1.4799265e-10 1.7261497e-10 ] [ 4.0171746e-10 3.8602119e-10 4.87521e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.8e-06 -9.2e-06 -5.2e-06 ] [ 3.4e-06 1.39e-05 -6.4e-06 ] [ 2.34e-05 -1.02e-05 1.28e-05 ] [ -1.26e-05 -2.65e-05 2.05e-05 ] [ -2.11e-05 3.19e-05 -2.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.089480102144e-14 -1.474002491136e-14 -8.33131842816e-15 ] [ 5.44740051072e-15 2.227025502912e-14 -1.025393037312e-14 ] [ 3.749093292672001e-14 -1.634220153216e-14 2.050786074624e-14 ] [ -2.018742542208e-14 -4.24576804512e-14 3.28446207264e-14 ] [ -3.380592669888e-14 5.110943420352001e-14 -3.476723267136e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.367078 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.622294972241002e-18 } }