{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0497067 -0.895362 1.2481506 ] [ -0.2974471 1.1687633 -1.7351326 ] [ -0.9323112 -0.2407343 0.5376152 ] [ -0.3238774 -0.6939161 0.7776558 ] [ 0.5257467 0.5719316 -1.6301898 ] [ 0.7736367 0.2529042 0.0872583 ] [ 0.2045455 -0.1635867 0.7146425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.963891329324779e-11 -1.434528075371508e-09 1.99975772703308e-09 ] [ -4.765627934710614e-10 1.872565249936732e-09 -2.779988908611668e-09 ] [ -1.493727220256501e-09 -3.856988704623462e-10 8.613545115232366e-10 ] [ -5.189088025606715e-10 -1.111776161376407e-09 1.245941952054577e-09 ] [ 8.423390781426078e-10 9.163354457662343e-10 -2.611852006545133e-09 ] [ 1.239502643944867e-09 4.051971998804628e-10 1.398032093825622e-10 ] [ 3.27718020689847e-10 -2.620947883731678e-10 1.144983515163345e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.266536005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.086839380655724e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3874794 2.38815 2.1687894 ] [ 3.2947689 4.1009375 0.9387955 ] [ 2.4468764 3.8032203 3.9753741 ] [ 5.4642755 3.2604481 1.4621763 ] [ 4.46913 1.5817005 2.6709737 ] [ 4.3871367 4.7981983 2.9634362 ] [ 4.6163841 2.9627313 4.4987508 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3874794e-10 2.38815e-10 2.1687894e-10 ] [ 3.2947689e-10 4.1009375e-10 9.387955e-11 ] [ 2.4468764e-10 3.8032203e-10 3.9753741e-10 ] [ 5.464275500000001e-10 3.2604481e-10 1.4621763e-10 ] [ 4.46913e-10 1.5817005e-10 2.6709737e-10 ] [ 4.3871367e-10 4.798198300000001e-10 2.9634362e-10 ] [ 4.616384100000001e-10 2.9627313e-10 4.4987508e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.15e-05 -2.22e-05 3.8e-06 ] [ -1.1e-06 2.44e-05 -1.49e-05 ] [ -1e-05 2.13e-05 1.63e-05 ] [ -1.78e-05 4.5e-06 -1.76e-05 ] [ 1.65e-05 -4.29e-05 4e-07 ] [ 1.54e-05 1.28e-05 5.4e-06 ] [ -2.45e-05 2e-06 6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.4446797631e-14 -3.55683212748e-14 6.088271209199999e-15 ] [ -1.7623942974e-15 3.909310986959999e-14 -2.38724318466e-14 ] [ -1.602176634e-14 3.41263623042e-14 2.61154791342e-14 ] [ -2.851874408519999e-14 7.209794853e-15 -2.81983087584e-14 ] [ 2.6435914461e-14 -6.873337759859999e-14 6.408706536e-16 ] [ 2.46735201636e-14 2.05078609152e-14 8.6517538236e-15 ] [ -3.925332753299999e-14 3.204353268e-15 1.05743657844e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }