{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1336803 -2.2725794 -4.5096148 ] [ 0.3841946 -2.1505492 -2.2770394 ] [ -0.5946242 2.7732564 2.0023609 ] [ 0.1647089 1.1147454 1.7292946 ] [ 4.1794009 0.5351268 3.0549987 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.622885934521531e-09 -3.641073583591692e-09 -7.225199401373667e-09 ] [ 6.155476059576078e-10 -3.445559650120143e-09 -3.648219291320459e-09 ] [ -9.526929914019035e-10 4.443246567563973e-09 3.208135820384047e-09 ] [ 2.638927488176851e-10 1.786019018024345e-09 2.770635378595688e-09 ] [ 6.696138410930479e-09 8.573676481235175e-10 4.894647493714393e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.398388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.986440738920727e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9733239 2.5110648 0.2222818 ] [ 1.7009274 2.8372403 2.7350487 ] [ 2.7247361 0.7839797 1.8202404 ] [ 2.4077183 4.7017489 1.2773196 ] [ 4.0244112 2.880296 1.6890297 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9733239e-10 2.5110648e-10 2.222818e-11 ] [ 1.7009274e-10 2.8372403e-10 2.7350487e-10 ] [ 2.7247361e-10 7.839797e-11 1.8202404e-10 ] [ 2.4077183e-10 4.7017489e-10 1.2773196e-10 ] [ 4.0244112e-10 2.880296e-10 1.6890297e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.78e-05 -1.57e-05 -2.1e-06 ] [ 4e-07 -1.99e-05 3.2e-06 ] [ -1.69e-05 4.45e-05 1.01e-05 ] [ -1.93e-05 1.89e-05 1.14e-05 ] [ 7.9e-06 -2.78e-05 -2.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.454051005824e-14 -2.515417294656e-14 -3.36457090368e-15 ] [ 6.408706483200001e-16 -3.188331475392e-14 5.126965186560001e-15 ] [ -2.707678489152e-14 7.129685962560001e-14 1.618198387008e-14 ] [ -3.092200878144e-14 3.028113813312e-14 1.826481347712e-14 ] [ 1.265719530432e-14 -4.454051005824e-14 -3.620919163008e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.299971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.2911079214318e-18 } }