{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2705809 -0.1863069 -1.7628506 ] [ 1.6345173 0.9871976 -1.0722084 ] [ -0.6620032 -0.9373028 -0.551839 ] [ -0.5532144 -0.0713695 0.8067224 ] [ 0.9413011 0.2646009 1.2892676 ] [ -0.6405363 -0.1527942 1.495775 ] [ -0.4494835 0.0959749 -0.204867 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.335183955866906e-10 -2.984965619329746e-10 -2.82439804055288e-09 ] [ 2.618785425928768e-09 1.581664927860878e-09 -1.717867245258526e-09 ] [ -1.060646058673229e-09 -1.501724645142775e-09 -8.84143551529926e-10 ] [ -8.863471852723296e-10 -1.14346545280263e-10 1.292511779404401e-09 ] [ 1.508130627978497e-09 4.239373793153706e-10 2.065634423693258e-09 ] [ -1.026252293088814e-09 -2.448032970507228e-10 2.39649575472135e-09 ] [ -7.201519610685389e-10 1.537687422304866e-10 -3.282331204776779e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.902915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.349016199548811e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5882182 1.6974999 2.3686122 ] [ 2.5045143 4.7412738 3.8547239 ] [ 1.0072335 3.1859651 3.0934338 ] [ 4.0330586 2.9356568 1.0537657 ] [ 3.5395711 2.656316 4.320861 ] [ 3.9740579 5.0812793 2.101366 ] [ 5.3124616 3.3539991 2.9917204 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5882182e-10 1.6974999e-10 2.3686122e-10 ] [ 2.5045143e-10 4.7412738e-10 3.8547239e-10 ] [ 1.0072335e-10 3.1859651e-10 3.0934338e-10 ] [ 4.0330586e-10 2.9356568e-10 1.0537657e-10 ] [ 3.5395711e-10 2.656316e-10 4.320861e-10 ] [ 3.9740579e-10 5.081279300000001e-10 2.101366e-10 ] [ 5.3124616e-10 3.3539991e-10 2.991720400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 8e-06 2.74e-05 ] [ 2.86e-05 -2.24e-05 2.8e-06 ] [ 4.97e-05 8.2e-06 -4.08e-05 ] [ -2.16e-05 2.01e-05 2.31e-05 ] [ -2.6e-06 -3e-07 -1.27e-05 ] [ -2.67e-05 -1.75e-05 -6.8e-06 ] [ -2.25e-05 3.9e-06 6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665506599998e-15 1.2817413072e-14 4.389963977159999e-14 ] [ 4.58222517324e-14 -3.588875660159999e-14 4.486094575199999e-15 ] [ 7.96281787098e-14 1.31378483988e-14 -6.53688066672e-14 ] [ -3.46070152944e-14 3.22037503434e-14 3.70102802454e-14 ] [ -4.165659248399999e-15 -4.806529901999999e-16 -2.03476432518e-14 ] [ -4.277811612779999e-14 -2.8038091095e-14 -1.08948011112e-14 ] [ -3.6048974265e-14 6.248488872599999e-15 1.10550187746e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.704295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.637629094044303e-18 } }