{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.2374074 -198.5031445 96.2672333 ] [ -556.2183606 248.7798144 -69.1167475 ] [ 40.5082736 82.8674705 112.2776275 ] [ 287.7073772 212.4001919 -162.1457458 ] [ 253.2401172 -345.5443323 22.7176326 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.043478443901868e-08 -3.180370998934255e-07 1.542371118130867e-07 ] [ -8.91160060755106e-07 3.985892056425366e-07 -1.107372378625779e-07 ] [ 6.490140944559905e-08 1.327683249537843e-07 1.798885913014558e-07 ] [ 4.609580371792642e-07 3.40302624519296e-07 -2.597861252232636e-07 ] [ 4.057353985692614e-07 -5.536230552221914e-07 3.639766013151667e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 138.98761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.226827011575047e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.409924 -0.055547 2.5043954 ] [ -0.0843311 2.8659 0.9616958 ] [ 0.4659757 2.6735371 4.0378398 ] [ 2.7431565 -0.1982678 0.9398322 ] [ 2.3236276 2.2815593 -0.3696507 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09924e-11 -5.5547e-12 2.5043954e-10 ] [ -8.43311e-12 2.8659e-10 9.616958e-11 ] [ 4.659757e-11 2.6735371e-10 4.037839800000001e-10 ] [ 2.7431565e-10 -1.982678e-11 9.398322e-11 ] [ 2.3236276e-10 2.2815593e-10 -3.696507e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-06 3.8e-06 -1.1e-05 ] [ -4.1e-06 1.01e-05 4.6e-06 ] [ -1.4e-06 3.4e-06 -3.3e-06 ] [ 1.36e-05 -2.07e-05 6e-06 ] [ -1.24e-05 3.4e-06 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.8893595262e-15 6.088271209199999e-15 -1.7623942974e-14 ] [ -6.568924199399999e-15 1.61819840034e-14 7.370012516399999e-15 ] [ -2.2430472876e-15 5.4474005556e-15 -5.2871828922e-15 ] [ 2.17896022224e-14 -3.316505632379999e-14 9.613059803999999e-15 ] [ -1.98669902616e-14 5.4474005556e-15 5.9280535458e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.673165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.870247220782661e-18 } }