{ "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" [ [ 1.504182 0.6046597 2.321872 ] [ 1.745959 3.100925 2.68757 ] [ 3.896834 1.31316 2.432517 ] [ 4.079685 3.860896 1.604541 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.504182e-10 6.046597e-11 2.321872e-10 ] [ 1.745959e-10 3.100925e-10 2.68757e-10 ] [ 3.896834e-10 1.31316e-10 2.432517e-10 ] [ 4.079685e-10 3.860896e-10 1.604541e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1635237 1.5766193 0.1786781 ] [ 1.2593972 -0.4831387 -0.8706174 ] [ -0.6218625 1.2490912 -0.6131311 ] [ -1.8010585 -2.3425718 1.3050704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.864170485245226e-09 2.526022603173436e-09 2.862738768275154e-10 ] [ 2.017776766765024e-09 -7.740735361211356e-10 -1.394882855433831e-09 ] [ -9.963335670608248e-10 2.001264734375021e-09 -9.823443219987173e-10 ] [ -2.885613845167089e-09 -3.753213801427321e-09 2.090953300605033e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.449009646151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.193462920150492e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8201801 0.9805719 2.5256397 ] [ 1.5704593 3.2346767 2.4060888 ] [ 4.0429624 1.2051816 2.1176807 ] [ 3.7930581 3.4592105 1.9970907 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8201801e-10 9.805719000000001e-11 2.5256397e-10 ] [ 1.5704593e-10 3.2346767e-10 2.4060888e-10 ] [ 4.0429624e-10 1.2051816e-10 2.1176807e-10 ] [ 3.7930581e-10 3.459210500000001e-10 1.9970907e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 1.9e-06 1.7e-05 ] [ 1.25e-05 -1.59e-05 -1.87e-05 ] [ -2.01e-05 1.19e-05 -1.5e-05 ] [ 4.4e-06 2.1e-06 1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.1269652288e-15 3.0441356046e-15 2.723700277799999e-14 ] [ 2.0027207925e-14 -2.54746084806e-14 -2.99607030558e-14 ] [ -3.22037503434e-14 1.90659019446e-14 -2.403264951e-14 ] [ 7.0495771896e-15 3.364570931399999e-15 2.67563497878e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }