{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0415784 1.91187 -20.9448468 ] [ -6.2473473 -7.5355666 18.4513068 ] [ -0.6594262 1.2211557 -19.2384726 ] [ 24.749964 -5.3134921 12.059815 ] [ -20.884769 9.716033 9.6721976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.873145842959106e-09 3.063153441245579e-09 -3.355734414566967e-08 ] [ -1.000935386854299e-08 -1.207330873047082e-08 2.956225262172531e-08 ] [ -1.056517249487411e-09 1.956507129015913e-09 -3.082343127356923e-08 ] [ 3.965381401314117e-08 -8.513152887563592e-09 1.932195380336271e-08 ] [ -3.346108889828754e-08 1.556680104777292e-08 1.549656899415088e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.800166567310328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.730377451745259e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4302398 1.3837785 0.9692286 ] [ 1.5348746 0.2168992 2.7284955 ] [ 2.6881759 1.8989576 0.4096219 ] [ 2.9110202 2.1615252 2.7672157 ] [ 0.7888384 3.2020981 2.4665472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.302398e-11 1.3837785e-10 9.692286000000001e-11 ] [ 1.5348746e-10 2.168992e-11 2.7284955e-10 ] [ 2.6881759e-10 1.8989576e-10 4.096219e-11 ] [ 2.9110202e-10 2.1615252e-10 2.7672157e-10 ] [ 7.888384000000001e-11 3.2020981e-10 2.4665472e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.42e-05 -7.6e-06 -1.23e-05 ] [ 3e-07 -1.38e-05 8.6e-06 ] [ 1.05e-05 2.6e-06 -5.6e-06 ] [ 5.1e-06 4.1e-06 5e-07 ] [ -1.7e-06 1.47e-05 8.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.27509082028e-14 -1.21765424184e-14 -1.97067725982e-14 ] [ 4.806529901999999e-16 -2.21100375492e-14 1.37787190524e-14 ] [ 1.6822854657e-14 4.165659248399999e-15 -8.972189150399999e-15 ] [ 8.1711008334e-15 6.568924199399999e-15 8.010883169999999e-16 ] [ -2.7237002778e-15 2.35519965198e-14 1.42593720426e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }