{ "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" [ [ -4.0569448 -2.8205497 -0.0735101 ] [ 2.4400889 -9.8620786 0.6687959 ] [ -1.789051 -0.6163899 0.1738807 ] [ 0.685849 1.4700633 -1.4659601 ] [ 4.6831703 3.4946868 0.6533977 ] [ -3.6686119 3.3302643 -7.8528825 ] [ 1.7054996 5.0040038 7.8962783 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.499942163987803e-09 -4.519018824375709e-09 -1.177761645830034e-10 ] [ 3.909453420462762e-09 -1.580079189559143e-08 1.071529163895e-09 ] [ -2.866375709234334e-09 -9.875654952135965e-10 2.785875946435638e-10 ] [ 1.098851242252266e-09 2.355301069760932e-09 -2.348727018596303e-09 ] [ 7.503266027702768e-09 5.599105534108231e-09 1.046858527649342e-09 ] [ -5.877764265394345e-09 5.335671646504365e-09 -1.25817048510475e-08 ] [ 2.732511608416346e-09 8.017297964807208e-09 1.265123258782124e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.086521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897780133655031e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9618631 2.74193 2.8142964 ] [ 4.912138 1.338585 1.7731818 ] [ 5.1121101 2.3242249 4.1023686 ] [ 3.2485873 0.8979188 3.4842066 ] [ 5.756651 3.6408804 2.108136 ] [ 3.540317 3.3045675 1.0589927 ] [ 3.7402696 4.2901958 3.388186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9618631e-10 2.74193e-10 2.8142964e-10 ] [ 4.912138e-10 1.338585e-10 1.7731818e-10 ] [ 5.1121101e-10 2.3242249e-10 4.1023686e-10 ] [ 3.2485873e-10 8.979188000000001e-11 3.4842066e-10 ] [ 5.756651e-10 3.6408804e-10 2.108136e-10 ] [ 3.540317e-10 3.3045675e-10 1.0589927e-10 ] [ 3.7402696e-10 4.2901958e-10 3.388186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.74e-05 2.82e-05 4.08e-05 ] [ 1.45e-05 -1.98e-05 -2.18e-05 ] [ 1.38e-05 1.63e-05 1.35e-05 ] [ 1.3e-05 2.65e-05 -2.8e-05 ] [ 3.44e-05 -1.1e-05 8.7e-06 ] [ 4.3e-06 -1.6e-05 -1.76e-05 ] [ -4.27e-05 -2.41e-05 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.99214061116e-14 4.51813810788e-14 6.53688066672e-14 ] [ 2.3231561193e-14 -3.17230973532e-14 -3.492745062119999e-14 ] [ 2.21100375492e-14 2.61154791342e-14 2.162938455899999e-14 ] [ 2.082829624199999e-14 4.2457680801e-14 -4.486094575199999e-14 ] [ 5.51148762096e-14 -1.7623942974e-14 1.39389367158e-14 ] [ 6.8893595262e-15 -2.5634826144e-14 -2.81983087584e-14 ] [ -6.84129422718e-14 -3.86124568794e-14 7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.563325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615043210034805e-18 } }