{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7393289 -8.6347747 4.6001942 ] [ -6.9119547 12.9403064 -2.1266275 ] [ -12.3096386 -4.4093809 -1.71028 ] [ 0.8593236 -5.8618779 -12.4742176 ] [ 3.5687159 2.9388698 13.1056845 ] [ 2.9289125 -2.4093046 0.427074 ] [ 9.1253124 5.4361619 -1.8218275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.388888720261781e-09 -1.383443415021533e-08 7.370323598379759e-09 ] [ -1.107417222436868e-08 2.073265638006861e-08 -3.407232861650352e-09 ] [ -1.972221517541724e-08 -7.064606990182064e-09 -2.740170631021824e-09 ] [ 1.376788181621691e-09 -9.391763725364201e-09 -1.998589980149189e-08 ] [ 5.71771318125723e-09 4.708588485135171e-09 2.099762130548094e-08 ] [ 4.692635131868881e-09 -3.860131502505896e-09 6.842479781515392e-10 ] [ 1.462036218477634e-08 8.709691503063707e-09 -2.918889427630512e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7545302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.242412699172755e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6451044 2.3920285 3.8085834 ] [ 1.6040393 5.4187062 2.7077757 ] [ 0.9742145 3.1633263 2.1971101 ] [ 2.5191246 2.6194047 0.4477886 ] [ 2.9102624 4.5667877 4.7968176 ] [ 4.2891158 2.826021 2.0500308 ] [ 4.1727765 5.1573286 2.5937839 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6451044e-10 2.3920285e-10 3.8085834e-10 ] [ 1.6040393e-10 5.4187062e-10 2.7077757e-10 ] [ 9.742145000000001e-11 3.1633263e-10 2.1971101e-10 ] [ 2.5191246e-10 2.6194047e-10 4.477886e-11 ] [ 2.9102624e-10 4.5667877e-10 4.7968176e-10 ] [ 4.2891158e-10 2.826021e-10 2.0500308e-10 ] [ 4.172776500000001e-10 5.1573286e-10 2.5937839e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.64e-05 -4.02e-05 -1.72e-05 ] [ -8e-06 2.18e-05 -1.01e-05 ] [ -5.55e-05 -1.65e-05 1.85e-05 ] [ 1.94e-05 8.4e-06 2.9e-06 ] [ -1.08e-05 2.72e-05 1.15e-05 ] [ 5.5e-06 -2.39e-05 -9.1e-06 ] [ 3.3e-05 2.34e-05 3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.627569658112e-14 -6.440750015616e-14 -2.755743787776e-14 ] [ -1.28174129664e-14 3.492745033344e-14 -1.618198387008e-14 ] [ -8.892080245440001e-14 -2.64359142432e-14 2.96402674848e-14 ] [ 3.108222644352e-14 1.345828361472e-14 4.646312200320001e-15 ] [ -1.730350750464e-14 4.357920408576e-14 1.84250311392e-14 ] [ 8.8119714144e-15 -3.829202123712e-14 -1.457980724928e-14 ] [ 5.28718284864e-14 3.749093292672001e-14 5.6076181728e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }