{ "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" [ [ -1.71355455616457e-08 -9.290809503029256e-08 -1.283607588872386e-07 ] [ 4.70515213671888e-10 -1.095534142799537e-07 -2.145106372508158e-09 ] [ 8.294474774588082e-10 -1.449970883238804e-08 1.836751011459536e-08 ] [ -1.609652553152081e-08 1.19178398204254e-08 -2.646383457408237e-08 ] [ 8.653618413536586e-08 5.234709209109168e-08 1.916222192226224e-08 ] [ -1.719881591694525e-07 -3.955465193124476e-08 -9.020700244835802e-08 ] [ 1.173840834361224e-07 1.92250938162362e-07 2.096469704055472e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 39.277396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.292932559710344e-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" [ [ 5.030834589312e-14 -1.92261194496e-14 -1.057436569728e-14 ] [ 2.194981970496e-14 -3.652962695424e-14 -4.373942174784e-14 ] [ -4.181680980288e-14 -1.12152363456e-15 6.552902379072e-14 ] [ -7.53023011776e-15 9.292624400640001e-15 -3.701027994048e-14 ] [ -1.025393037312e-14 1.249697764224e-14 -2.211003736704e-14 ] [ -4.758464563776e-14 -3.909310954752e-14 1.92261194496e-15 ] [ 3.492745033344e-14 7.418077754303999e-14 4.56620336928e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120207089015e-18 } }