{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6951664 -57.9886723 -80.1164848 ] [ 0.2936725 -68.3778635 -1.3388701 ] [ 0.5177004 -9.0500065 11.4640982 ] [ -10.0466611 7.4385306 -16.5174265 ] [ 54.0116383 32.6724853 11.9601183 ] [ -107.3465665 -24.6880721 -56.3027829 ] [ 73.2653828 119.9935985 130.8513479 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.713554570282189e-08 -9.290809579574303e-08 -1.283607599447761e-07 ] [ 4.705152175483649e-10 -1.095534151825414e-07 -2.145106390181243e-09 ] [ 8.294474842924534e-10 -1.449970895184812e-08 1.836751026592146e-08 ] [ -1.609652566413674e-08 1.1917839918614e-08 -2.64638347921124e-08 ] [ 8.653618484831948e-08 5.234709252236848e-08 1.91622220801358e-08 ] [ -1.719881605864271e-07 -3.955465225712731e-08 -9.020700319155475e-08 ] [ 1.173840844032255e-07 1.922509397462774e-07 2.09646972132785e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 39.277396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.292932611556506e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.67387 2.7723749 2.8442117 ] [ 5.0267551 1.0823745 1.5408877 ] [ 5.29333 2.2685569 4.4070677 ] [ 3.151832 0.6437871 3.5877208 ] [ 6.0187719 3.7932396 2.017671 ] [ 3.4204208 3.3959027 0.7328088 ] [ 3.6869562 4.5820666 3.5990003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.67387e-10 2.7723749e-10 2.8442117e-10 ] [ 5.0267551e-10 1.0823745e-10 1.5408877e-10 ] [ 5.29333e-10 2.2685569e-10 4.4070677e-10 ] [ 3.151832e-10 6.437871e-11 3.5877208e-10 ] [ 6.0187719e-10 3.793239600000001e-10 2.017671e-10 ] [ 3.4204208e-10 3.3959027e-10 7.328088000000001e-11 ] [ 3.6869562e-10 4.5820666e-10 3.5990003e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.14e-05 -1.2e-05 -6.6e-06 ] [ 1.37e-05 -2.28e-05 -2.73e-05 ] [ -2.61e-05 -7e-07 4.09e-05 ] [ -4.7e-06 5.8e-06 -2.31e-05 ] [ -6.4e-06 7.8e-06 -1.38e-05 ] [ -2.97e-05 -2.44e-05 1.2e-06 ] [ 2.18e-05 4.63e-05 2.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.030834630759999e-14 -1.9226119608e-14 -1.05743657844e-14 ] [ 2.19498198858e-14 -3.65296272552e-14 -4.37394221082e-14 ] [ -4.18168101474e-14 -1.1215236438e-15 6.552902433059999e-14 ] [ -7.530230179799999e-15 9.2926244772e-15 -3.70102802454e-14 ] [ -1.02539304576e-14 1.24969777452e-14 -2.21100375492e-14 ] [ -4.75846460298e-14 -3.909310986959999e-14 1.9226119608e-15 ] [ 3.492745062119999e-14 7.41807781542e-14 4.5662034069e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120232572589e-18 } }