{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.8053693 7.1456079 -0.51937 ] [ 2.6009999 0.7809701 -2.0779523 ] [ -5.8124168 -9.6168182 -1.6464583 ] [ 2.8813778 -2.3406462 -0.2538454 ] [ 2.3500455 1.1538618 -7.590735 ] [ 9.7518553 2.8419735 1.859806 ] [ -3.9664925 0.0350512 10.2285551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.250558031220093e-08 1.144852601310581e-08 -8.321224784005799e-10 ] [ 4.167261264816337e-09 1.251252046072643e-09 -3.329246621626559e-09 ] [ -9.31251838402905e-09 -1.540784141346594e-08 -2.637917017115362e-09 ] [ 4.616476184886324e-09 -3.750128650100891e-09 -4.067051685283836e-10 ] [ 3.765187988936846e-09 1.848690414825181e-09 -1.216169825188599e-08 ] [ 1.562419469980906e-08 4.553343536147199e-09 2.979737716973004e-09 ] [ -6.355021602436245e-09 5.615821363366079e-11 1.638795198080153e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9309008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.591105721633191e-18 } "relaxed-configuration-positions" { "source-value" [ [ 4.030903 5.9992239 2.3833012 ] [ 5.8214509 3.4729332 0.6619588 ] [ 3.2311674 2.4216266 2.8788544 ] [ 5.6712012 2.7596883 3.0898328 ] [ 3.3774925 4.1027061 1.1256274 ] [ 5.0600474 4.8484549 4.1783112 ] [ 2.8162774 3.8546771 4.9282692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.030903e-10 5.9992239e-10 2.3833012e-10 ] [ 5.8214509e-10 3.4729332e-10 6.619588e-11 ] [ 3.2311674e-10 2.4216266e-10 2.8788544e-10 ] [ 5.6712012e-10 2.7596883e-10 3.0898328e-10 ] [ 3.3774925e-10 4.1027061e-10 1.1256274e-10 ] [ 5.0600474e-10 4.8484549e-10 4.1783112e-10 ] [ 2.8162774e-10 3.8546771e-10 4.9282692e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-06 8e-07 2.7e-06 ] [ -9e-07 -6.4e-06 1.9e-06 ] [ 2e-06 -1.1e-06 8e-07 ] [ -3.1e-06 7e-07 -5.8e-06 ] [ -3e-07 8e-07 1.6e-06 ] [ 3.4e-06 6.3e-06 7.9e-06 ] [ 1.8e-06 -1.1e-06 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.6463122386e-15 1.2817413072e-15 4.3258769118e-15 ] [ -1.4419589706e-15 -1.02539304576e-14 3.0441356046e-15 ] [ 3.204353268e-15 -1.7623942974e-15 1.2817413072e-15 ] [ -4.9667475654e-15 1.1215236438e-15 -9.2926244772e-15 ] [ -4.806529901999999e-16 1.2817413072e-15 2.5634826144e-15 ] [ 5.4474005556e-15 1.00937127942e-14 1.26571954086e-14 ] [ 2.8839179412e-15 -1.7623942974e-15 -1.47400250328e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.978138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040632926042749e-18 } }