{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.7285029 -5.1540916 -1.9527982 ] [ -5.0300271 -0.8465727 5.0596155 ] [ -8.4867107 6.7166076 -7.2500245 ] [ -1.768641 6.8242074 4.4074833 ] [ 3.2373895 -5.9733396 -6.9245836 ] [ 11.2637972 -7.3388369 10.1089052 ] [ 7.512695 5.7720259 -3.4485976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.0780250039365e-08 -8.257765062981666e-09 -3.128727621180322e-09 ] [ -8.058991821610423e-09 -1.356358987747532e-09 8.106397664337302e-09 ] [ -1.35972094710332e-08 1.07611916678076e-08 -1.161581975412721e-08 ] [ -2.833675260788333e-09 1.093358555177035e-08 7.061566699826433e-09 ] [ 5.186869769323402e-09 -9.570345055218824e-09 -1.10944059526951e-08 ] [ 1.80465925352725e-08 -1.175811290504435e-08 1.619625157332355e-08 ] [ 1.203666428820106e-08 9.24780495163208e-09 -5.52526244926699e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8798282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.818346655560548e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9063802 1.6924744 2.4992757 ] [ 2.4624708 2.3933509 4.7689483 ] [ 1.4087659 3.901696 2.0934404 ] [ 2.8938296 4.4592531 3.7602478 ] [ 4.2272804 1.6337335 2.2138365 ] [ 4.4482711 1.2694354 4.4750258 ] [ 4.663055 3.8504986 2.4686825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9063802e-10 1.6924744e-10 2.4992757e-10 ] [ 2.4624708e-10 2.3933509e-10 4.7689483e-10 ] [ 1.4087659e-10 3.901696e-10 2.0934404e-10 ] [ 2.8938296e-10 4.4592531e-10 3.7602478e-10 ] [ 4.2272804e-10 1.6337335e-10 2.2138365e-10 ] [ 4.448271100000001e-10 1.2694354e-10 4.4750258e-10 ] [ 4.663055e-10 3.8504986e-10 2.4686825e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.91e-05 2.59e-05 1.4e-05 ] [ 1e-07 2.44e-05 -2.77e-05 ] [ 1.36e-05 1.66e-05 -6.4e-06 ] [ -2.08e-05 -2.94e-05 2.02e-05 ] [ -2.72e-05 -1.77e-05 -3.8e-06 ] [ 1.62e-05 7.9e-06 -9e-07 ] [ -4.09e-05 -2.77e-05 4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.468863828927999e-14 4.149637447872e-14 2.24304726912e-14 ] [ 1.6021766208e-16 3.909310954752e-14 -4.438029239616e-14 ] [ 2.178960204288e-14 2.659613190528e-14 -1.025393037312e-14 ] [ -3.332527371264e-14 -4.710399265152e-14 3.236396774016e-14 ] [ -4.357920408576e-14 -2.835852618816e-14 -6.08827115904e-15 ] [ 2.595526125696e-14 1.265719530432e-14 -1.44195895872e-15 ] [ -6.552902379072e-14 -4.438029239616e-14 7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }