{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.617948 3.024291 1.012928 ] [ 1.30973 1.622672 3.703727 ] [ 2.879916 3.04735 3.836046 ] [ 0.9226834 3.798669 3.025472 ] [ 3.183378 1.61886 2.358361 ] [ 3.567629 4.016165 2.010815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.617948e-10 3.024291e-10 1.012928e-10 ] [ 1.30973e-10 1.622672e-10 3.703727e-10 ] [ 2.879916000000001e-10 3.04735e-10 3.836046e-10 ] [ 9.226834e-11 3.798669e-10 3.025472e-10 ] [ 3.183378e-10 1.61886e-10 2.358361e-10 ] [ 3.567629e-10 4.016165e-10 2.010815e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0682048 -0.538892 0.5920933 ] [ -2.8284527 -2.367086 -0.112562 ] [ 2.5427737 3.8569476 5.5947606 ] [ -1.0309613 1.181952 -0.4667407 ] [ 0.780466 -2.5594149 -3.9697519 ] [ -0.5320305 0.4264934 -1.6377993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.71145275678634e-09 -8.634001635361537e-10 9.486380425923207e-10 ] [ -4.531680788978637e-09 -3.792489848622989e-09 -1.803442047904896e-10 ] [ 4.073972574125113e-09 6.17951127237067e-09 8.96379463229298e-09 ] [ -1.651782091809575e-09 1.893695861307801e-09 -7.478010375158266e-10 ] [ 1.250444378529293e-09 -4.100634715707171e-09 -6.36024368455638e-09 ] [ -8.524068286525344e-10 6.833177544055028e-10 -2.624043748022606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.35339193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.017925601381155e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5178295 2.6635481 1.1610559 ] [ 1.2162726 1.7034686 3.3068492 ] [ 2.9759319 3.0457876 4.1547271 ] [ 1.1446602 4.0574864 3.041162 ] [ 3.3491013 1.6518493 2.274621 ] [ 3.2774888 4.0058671 2.0089338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5178295e-10 2.6635481e-10 1.1610559e-10 ] [ 1.2162726e-10 1.7034686e-10 3.3068492e-10 ] [ 2.9759319e-10 3.0457876e-10 4.1547271e-10 ] [ 1.1446602e-10 4.0574864e-10 3.041162e-10 ] [ 3.3491013e-10 1.6518493e-10 2.274621e-10 ] [ 3.2774888e-10 4.0058671e-10 2.0089338e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 -3e-07 -3e-07 ] [ -7e-07 -7e-07 4e-07 ] [ 3e-07 -2e-07 5e-07 ] [ -1.2e-06 8e-07 4e-07 ] [ 5e-07 -6e-07 -3e-07 ] [ 1.3e-06 9e-07 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 -4.8065298624e-16 -4.8065298624e-16 ] [ -1.12152363456e-15 -1.12152363456e-15 6.408706483200001e-16 ] [ 4.8065298624e-16 -3.2043532416e-16 8.010883104e-16 ] [ -1.92261194496e-15 1.28174129664e-15 6.408706483200001e-16 ] [ 8.010883104e-16 -9.6130597248e-16 -4.8065298624e-16 ] [ 2.08282960704e-15 1.44195895872e-15 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }