{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3932337 -4.6751465 -1.9917431 ] [ 2.2745738 1.5656616 0.2307103 ] [ -0.116148 -0.8541266 -0.8091308 ] [ -5.0352734 -0.8041408 -4.7198647 ] [ 0.7554335 5.31744 4.1136779 ] [ -0.2881356 -0.6834143 0.3403397 ] [ 2.8027835 0.1337267 2.8360107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.300298458413658e-10 -7.49041048282688e-09 -3.191124255750725e-09 ] [ 3.644268994668589e-09 2.508466432271054e-09 3.696386518831302e-10 ] [ -1.86089611685832e-10 -1.368461680997864e-09 -1.296370461609727e-09 ] [ -8.067397387281735e-09 -1.288375600206067e-09 -7.562056937981419e-09 ] [ 1.210337902240839e-09 8.51947812069696e-09 6.590838611182187e-09 ] [ -4.616441257435703e-10 -1.094950422801466e-09 5.452843149625699e-10 ] [ 4.490554233860738e-09 2.142537940819278e-10 4.543790077313984e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.098441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.860995908602759e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3215203 2.9225487 1.8971124 ] [ 2.4415549 0.8080339 2.9342413 ] [ 2.6245987 2.6550039 4.2926272 ] [ 4.2525827 1.4193177 1.6574676 ] [ 4.8378324 2.1768276 3.7852726 ] [ 4.3957764 3.6240867 0.9348326 ] [ 3.9269286 4.2331934 3.133605 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3215203e-10 2.9225487e-10 1.8971124e-10 ] [ 2.4415549e-10 8.080339e-11 2.9342413e-10 ] [ 2.6245987e-10 2.6550039e-10 4.2926272e-10 ] [ 4.2525827e-10 1.4193177e-10 1.6574676e-10 ] [ 4.8378324e-10 2.1768276e-10 3.7852726e-10 ] [ 4.3957764e-10 3.6240867e-10 9.348326e-11 ] [ 3.9269286e-10 4.233193400000001e-10 3.133605e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-05 6.6e-06 2.3e-06 ] [ 6.45e-05 3.48e-05 1.75e-05 ] [ -2e-05 1.54e-05 2.28e-05 ] [ 1.01e-05 7.7e-06 1.88e-05 ] [ -5.39e-05 -6.54e-05 -4.93e-05 ] [ -6.2e-06 -7e-06 -2.42e-05 ] [ -2.46e-05 7.8e-06 1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-14 1.05743657844e-14 3.685006258199999e-15 ] [ 1.03340392893e-13 5.575574686319999e-14 2.8038091095e-14 ] [ -3.204353268e-14 2.46735201636e-14 3.65296272552e-14 ] [ 1.61819840034e-14 1.23367600818e-14 3.012092071919999e-14 ] [ -8.635732057259999e-14 -1.047823518636e-13 -7.89873080562e-14 ] [ -9.9334951308e-15 -1.1215236438e-14 -3.877267454279999e-14 ] [ -3.94135451964e-14 1.24969777452e-14 1.93863372714e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.235906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.84432621010204e-18 } }