{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2096469 -5.505747 -6.3481706 ] [ -5.1397078 -4.5329771 6.5151668 ] [ -2.7177824 4.0713883 2.7304715 ] [ 3.1739822 -0.5191863 -0.9298298 ] [ 2.124601 -1.184007 0.0559167 ] [ 0.2946612 -0.2596754 -0.3870272 ] [ 2.4738927 7.9302045 -1.6365273 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.358913645705345e-10 -8.821179196115599e-09 -1.017089060396576e-08 ] [ -8.234719742747545e-09 -7.262629992077081e-09 1.043844801357255e-08 ] [ -4.354367457576441e-09 6.523083202200981e-09 4.374697637102931e-09 ] [ 5.085280117571914e-09 -8.318281585529141e-10 -1.489751579156893e-09 ] [ 3.403986078773034e-09 -1.896988349892438e-09 8.958843019038779e-11 ] [ 4.720992895864008e-10 -4.160458583046035e-10 -6.200859365624448e-10 ] [ 3.963613078963171e-09 1.270558835274165e-08 -2.622005800963108e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.592165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.017487253447261e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5930897 2.1291584 1.1820246 ] [ 2.5257545 2.1588242 5.0800685 ] [ 2.0971583 3.7308397 3.118208 ] [ 4.8676379 2.6699645 2.2280304 ] [ 4.8060633 3.1825407 4.5751632 ] [ 5.1323806 5.0771917 1.42864 ] [ 3.8656717 5.2745028 3.6330213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5930897e-10 2.1291584e-10 1.1820246e-10 ] [ 2.5257545e-10 2.1588242e-10 5.0800685e-10 ] [ 2.0971583e-10 3.7308397e-10 3.118208e-10 ] [ 4.8676379e-10 2.6699645e-10 2.2280304e-10 ] [ 4.8060633e-10 3.1825407e-10 4.5751632e-10 ] [ 5.1323806e-10 5.0771917e-10 1.42864e-10 ] [ 3.8656717e-10 5.2745028e-10 3.6330213e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-05 1.56e-05 0.0001037 ] [ -1.85e-05 -4.02e-05 -1.65e-05 ] [ -8.85e-05 1.39e-05 -3.66e-05 ] [ 1.65e-05 -3.83e-05 -9.99e-05 ] [ 3.29e-05 -1.08e-05 5.6e-05 ] [ 8.4e-06 8e-06 1.18e-05 ] [ 1.43e-05 5.17e-05 -1.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.607618218999999e-14 2.49939554904e-14 1.661457169458e-13 ] [ -2.9640267729e-14 -6.44075006868e-14 -2.6435914461e-14 ] [ -1.41792632109e-13 2.22702552126e-14 -5.86396648044e-14 ] [ 2.6435914461e-14 -6.13633650822e-14 -1.600574457366e-13 ] [ 5.271161125859999e-14 -1.73035076472e-14 8.972189150399998e-14 ] [ 1.34582837256e-14 1.2817413072e-14 1.89056842812e-14 ] [ 2.29111258662e-14 8.28325319778e-14 -2.9640267729e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.707273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.997235568645908e-18 } }