{ "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" [ [ 0.6628403 2.876785 2.898563 ] [ 2.674482 0.2424727 1.042802 ] [ 2.274992 1.1385 2.859862 ] [ 1.854823 2.68523 0.2527791 ] [ 2.130586 2.70202 1.965626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628403e-11 2.876785e-10 2.898563e-10 ] [ 2.674482e-10 2.424727e-11 1.042802e-10 ] [ 2.274992e-10 1.1385e-10 2.859862e-10 ] [ 1.854823e-10 2.68523e-10 2.527791e-11 ] [ 2.130586e-10 2.70202e-10 1.965626e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.000708 1.7212832 11.5477447 ] [ -0.510913 1.4545027 -3.4233986 ] [ 0.5071047 -12.2187978 10.3043569 ] [ -3.5447795 -3.1807933 -27.2923003 ] [ 21.5492957 12.2238052 8.8635973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.884031375305687e-08 2.757799723536748e-09 1.850152673373734e-08 ] [ -8.185728706068419e-10 2.330370240029912e-09 -5.484889245788313e-09 ] [ 8.124713013315796e-10 -1.95766723307306e-08 1.650939985357667e-08 ] [ -5.679362887582203e-09 -5.096192702843752e-09 -4.372708582877119e-08 ] [ 3.452577804969667e-08 1.95846950700077e-08 1.420104848724549e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.0267934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.645104393425416e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0537234 3.3036138 3.0342219 ] [ 2.559645 0.0111527 0.6494446 ] [ 2.8219052 0.8210129 3.0612057 ] [ 1.9981601 2.4103958 -0.035839 ] [ 2.2717364 3.0988324 2.3105989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.37234e-12 3.3036138e-10 3.0342219e-10 ] [ 2.559645e-10 1.11527e-12 6.494446e-11 ] [ 2.8219052e-10 8.210129000000001e-11 3.0612057e-10 ] [ 1.9981601e-10 2.4103958e-10 -3.583900000000001e-12 ] [ 2.2717364e-10 3.0988324e-10 2.3105989e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.6e-06 -5.6e-06 -9.1e-06 ] [ 1.4e-06 -5.4e-06 -2.9e-06 ] [ 1.1e-06 -1.71e-05 9.4e-06 ] [ -1.44e-05 -1e-07 -9.7e-06 ] [ 1.76e-05 2.82e-05 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.972189150399999e-15 -8.972189150399999e-15 -1.45798073694e-14 ] [ 2.2430472876e-15 -8.6517538236e-15 -4.6463122386e-15 ] [ 1.7623942974e-15 -2.73972204414e-14 1.50604603596e-14 ] [ -2.30713435296e-14 -1.602176634e-16 -1.55411133498e-14 ] [ 2.81983087584e-14 4.51813810788e-14 1.97067725982e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.649402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.866439968447287e-18 } }