{ "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" [ [ -8.319864 -10.1007461 -3.3811186 ] [ -15.248088 5.851331 13.2741983 ] [ 4.3565106 11.2430938 4.9278158 ] [ 1.9352259 6.7165378 -22.8185519 ] [ 17.2762155 -13.7102164 7.9976564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.332989158903557e-08 -1.618317925405678e-08 -5.417149173072028e-09 ] [ -2.443013010550103e-08 9.374865728762284e-09 2.12676101761231e-08 ] [ 6.97989943158738e-09 1.801342203182143e-08 7.89523126636885e-09 ] [ 3.100573692946639e-09 1.076107983587947e-08 -3.655935037469142e-08 ] [ 2.767954857000259e-08 -2.196618818218874e-08 1.281365810527149e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.8412228 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.154317365443915e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.571774 2.5517722 1.4441351 ] [ 1.9057567 4.4287974 3.1052716 ] [ 4.2651529 5.2799767 2.4457564 ] [ 3.4920425 4.5554105 0.0785866 ] [ 4.8575788 2.7634111 2.6509865 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.571774e-10 2.5517722e-10 1.4441351e-10 ] [ 1.9057567e-10 4.4287974e-10 3.1052716e-10 ] [ 4.265152900000001e-10 5.2799767e-10 2.4457564e-10 ] [ 3.4920425e-10 4.5554105e-10 7.858660000000001e-12 ] [ 4.8575788e-10 2.7634111e-10 2.6509865e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -1.36e-05 -6.8e-06 ] [ -2.71e-05 2.3e-05 2.31e-05 ] [ -6.3e-06 4.1e-06 6.2e-06 ] [ 1.19e-05 -6e-07 -1.55e-05 ] [ 2.68e-05 -1.3e-05 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 -2.178960204288e-14 -1.089480102144e-14 ] [ -4.341898642368e-14 3.68500622784e-14 3.701027994048e-14 ] [ -1.009371271104e-14 6.568924145279999e-15 9.93349504896e-15 ] [ 1.906590178752e-14 -9.6130597248e-16 -2.48337376224e-14 ] [ 4.293833343744e-14 -2.08282960704e-14 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5001568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522092911889414e-18 } }