{ "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" [ [ 0.489786 0.6379758 2.385139 ] [ 2.264964 0.0865491 0.9234604 ] [ 2.944507 2.806058 0.1090737 ] [ 1.576252 2.005156 0.0788695 ] [ 2.792909 2.291732 2.895835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.89786e-11 6.379758e-11 2.385139e-10 ] [ 2.264964e-10 8.654910000000001e-12 9.234604e-11 ] [ 2.944507e-10 2.806058e-10 1.090737e-11 ] [ 1.576252e-10 2.005156e-10 7.88695e-12 ] [ 2.792909e-10 2.291732e-10 2.895835e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.7641842 3.2043622 1.4384727 ] [ -0.2020726 -1.8698156 1.8740802 ] [ 6.3384545 4.7431743 5.1104123 ] [ -6.1629585 -2.6850793 -0.9783016 ] [ -4.7376076 -3.3926416 -7.4446636 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.633064605311982e-09 5.133954243712834e-09 2.304687348586891e-09 ] [ -3.237559980916284e-10 -2.99577486420869e-09 3.002607506682047e-09 ] [ 1.015532369557215e-08 7.599403034449305e-09 8.187783177166198e-09 ] [ -9.874148105011688e-09 -4.301971314897076e-09 -1.567411964524814e-09 ] [ -7.590484197780818e-09 -5.435611099056375e-09 -1.192766606791032e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.830384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.254565828004746e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4700045 1.0947946 2.3664191 ] [ 2.3305799 -0.3523246 1.1802236 ] [ 2.9896448 3.4656488 0.4911343 ] [ 1.3879389 1.7416667 0.0820634 ] [ 2.8902499 1.8776854 2.2725371 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.700045e-11 1.0947946e-10 2.3664191e-10 ] [ 2.3305799e-10 -3.523246e-11 1.1802236e-10 ] [ 2.9896448e-10 3.4656488e-10 4.911343e-11 ] [ 1.3879389e-10 1.7416667e-10 8.20634e-12 ] [ 2.890249900000001e-10 1.8776854e-10 2.2725371e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 6.8e-06 -8.8e-06 ] [ -4.2e-06 2.1e-06 -3.4e-06 ] [ -1.58e-05 -1.6e-06 -5.6e-06 ] [ 7.8e-06 -1.6e-06 4.8e-06 ] [ 1.41e-05 -5.7e-06 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204353268e-15 1.08948011112e-14 -1.40991543792e-14 ] [ -6.729141862799999e-15 3.364570931399999e-15 -5.4474005556e-15 ] [ -2.53143908172e-14 -2.5634826144e-15 -8.972189150399999e-15 ] [ 1.24969777452e-14 -2.5634826144e-15 7.690447843199998e-15 ] [ 2.25906905394e-14 -9.1324068138e-15 2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.499658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.483318988259117e-18 } }