{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1074797 0.9236804 0.3879839 ] [ 0.6141463 -0.1894094 0.0897082 ] [ -2.8241277 -3.4343174 0.9068028 ] [ 3.3921042 2.7165571 -1.3744097 ] [ -1.0746431 -0.0165107 -0.0100853 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.722014639693298e-10 1.479899154163773e-09 6.216187389481925e-10 ] [ 9.839708517175542e-10 -3.034673149399596e-10 1.437283819181988e-10 ] [ -4.524751412372161e-09 -5.50238309201963e-09 1.452858257805775e-09 ] [ 5.434750089333262e-09 4.352404310546801e-09 -2.202047106882949e-09 ] [ -1.721768064709325e-09 -2.64530577509838e-11 -1.61584320068802e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -13.07777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.095289751882618e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3664602 2.435468 2.6135416 ] [ 1.3234862 0.0877603 2.8871948 ] [ 3.481144 1.1334703 2.6790689 ] [ 5.2637891 2.7495994 2.6279606 ] [ 3.2640275 3.3782778 3.720746 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3664602e-10 2.435468e-10 2.6135416e-10 ] [ 1.3234862e-10 8.77603e-12 2.8871948e-10 ] [ 3.481144e-10 1.1334703e-10 2.6790689e-10 ] [ 5.263789100000001e-10 2.7495994e-10 2.6279606e-10 ] [ 3.2640275e-10 3.3782778e-10 3.720746e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -1.2e-06 2.3e-06 ] [ 2.2e-06 9e-07 -2.5e-06 ] [ -4.3e-06 -9e-07 2.3e-06 ] [ 9e-07 8e-07 3e-07 ] [ 1.2e-06 4e-07 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-16 -1.9226119608e-15 3.685006258199999e-15 ] [ 3.5247885948e-15 1.4419589706e-15 -4.005441585e-15 ] [ -6.8893595262e-15 -1.4419589706e-15 3.685006258199999e-15 ] [ 1.4419589706e-15 1.2817413072e-15 4.806529901999999e-16 ] [ 1.9226119608e-15 6.408706536e-16 -3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.810758 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.212727376542857e-18 } }