{ "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" [ [ -0.9488875 -2.0702438 -0.0666748 ] [ 0.2529709 -4.6981385 1.027918 ] [ -1.3565756 -0.4126948 -0.2585289 ] [ 0.7871549 1.6670881 -1.3671657 ] [ 2.2742904 1.533938 0.6127877 ] [ -1.9394966 1.6972985 -4.0945117 ] [ 0.9305435 2.2827525 4.1461755 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.52028536826936e-09 -3.316896215716151e-09 -1.068248057565159e-10 ] [ 4.053040617227348e-10 -7.52724766598038e-09 1.646906187699495e-09 ] [ -2.173473710667733e-09 -6.612099600857319e-10 -4.142089593811412e-10 ] [ 1.261161177728162e-09 2.670969578633892e-09 -2.190440921299667e-09 ] [ 3.64381490778988e-09 2.457639601356711e-09 9.817941264538043e-10 ] [ -3.107416108641089e-09 2.719371975218909e-09 -6.560130919332064e-09 ] [ 1.490895040337405e-09 3.657372686572752e-09 6.642905451833751e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.223601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.56061339521875e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1279692 2.9885547 2.6981551 ] [ 4.980015 1.3242624 1.804869 ] [ 5.175219 2.2701764 4.0766362 ] [ 3.230238 1.0340699 3.4172475 ] [ 5.4129546 3.7359961 2.1046722 ] [ 3.5439671 2.968469 0.8149019 ] [ 3.8015732 4.2167739 3.8128861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1279692e-10 2.9885547e-10 2.6981551e-10 ] [ 4.980015e-10 1.3242624e-10 1.804869e-10 ] [ 5.175219000000001e-10 2.2701764e-10 4.076636200000001e-10 ] [ 3.230238e-10 1.0340699e-10 3.417247500000001e-10 ] [ 5.4129546e-10 3.7359961e-10 2.1046722e-10 ] [ 3.5439671e-10 2.968469e-10 8.149019e-11 ] [ 3.8015732e-10 4.2167739e-10 3.8128861e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-06 -2.6e-06 4.6e-06 ] [ 1.91e-05 -1.48e-05 5.4e-06 ] [ -7.7e-06 8.6e-06 -9.5e-06 ] [ -2.3e-06 1.6e-06 6.4e-06 ] [ -1.05e-05 -1.26e-05 -1.33e-05 ] [ 8.8e-06 2.15e-05 -6.1e-06 ] [ 1.5e-06 -1.8e-06 1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.425937192512e-14 -4.16565921408e-15 7.370012455680001e-15 ] [ 3.060157345728e-14 -2.371221398784e-14 8.65175375232e-15 ] [ -1.233675998016e-14 1.377871893888e-14 -1.52206778976e-14 ] [ -3.68500622784e-15 2.56348259328e-15 1.025393037312e-14 ] [ -1.68228545184e-14 -2.018742542208e-14 -2.130894905664e-14 ] [ 1.409915426304e-14 3.44467973472e-14 -9.77327738688e-15 ] [ 2.4032649312e-15 -2.88391791744e-15 2.018742542208e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }