{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6609177 -0.5789974 -0.6119955 ] [ -2.9100218 -6.9322895 2.7414245 ] [ -9.0381216 0.1471442 -3.3870058 ] [ 1.9918756 6.3600285 6.5624614 ] [ 1.1149631 -0.522441 -0.2505484 ] [ 4.8078141 5.4166335 -1.1891107 ] [ 3.3725729 -3.8900783 -3.8652255 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.058906887212908e-09 -9.27656097783986e-10 -9.805248821348064e-10 ] [ -4.662368893978334e-09 -1.110675216551732e-08 4.39224624158833e-09 ] [ -1.448066712346749e-08 2.357509971263194e-10 -5.426581507274001e-09 ] [ 3.191336517861972e-09 1.018988897032169e-08 1.051422222998244e-08 ] [ 1.786367811874692e-09 -8.370427559473729e-10 -4.014227888588467e-10 ] [ 7.702967348172594e-09 8.678403557142076e-09 -1.905165363083123e-09 ] [ 5.403457452323656e-09 -6.232592505341409e-09 -6.192773930219991e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.509535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.324683775567933e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1347551 1.2970894 2.3863813 ] [ 1.4191589 2.6996984 3.3846066 ] [ 1.4353009 4.0392507 1.356708 ] [ 3.1882511 4.1221451 4.2529341 ] [ 4.9097589 3.0019162 2.827153 ] [ 3.5673122 5.1680281 2.0137828 ] [ 3.5250538 2.9364366 0.5393398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1347551e-10 1.2970894e-10 2.3863813e-10 ] [ 1.4191589e-10 2.6996984e-10 3.3846066e-10 ] [ 1.4353009e-10 4.0392507e-10 1.356708e-10 ] [ 3.1882511e-10 4.1221451e-10 4.2529341e-10 ] [ 4.9097589e-10 3.0019162e-10 2.827153e-10 ] [ 3.5673122e-10 5.1680281e-10 2.0137828e-10 ] [ 3.5250538e-10 2.9364366e-10 5.393398e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -6.7e-06 -1e-07 ] [ 7.3e-06 1.3e-06 -4e-06 ] [ -2.1e-06 2.5e-06 -2.6e-06 ] [ 1e-07 3e-06 3.6e-06 ] [ -3.5e-06 7e-07 -2.6e-06 ] [ -9e-07 -8e-07 1.2e-06 ] [ -4e-07 -0.0 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 -1.073458335936e-14 -1.6021766208e-16 ] [ 1.169588933184e-14 2.08282960704e-15 -6.4087064832e-15 ] [ -3.36457090368e-15 4.005441552e-15 -4.16565921408e-15 ] [ 1.6021766208e-16 4.8065298624e-15 5.76783583488e-15 ] [ -5.6076181728e-15 1.12152363456e-15 -4.16565921408e-15 ] [ -1.44195895872e-15 -1.28174129664e-15 1.92261194496e-15 ] [ -6.408706483200001e-16 0.0 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }