{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.9722698 -85.2596394 -10.0233995 ] [ -48.8022271 9.1914676 74.580385 ] [ -46.6810575 20.9318844 -66.3896305 ] [ -21.4429262 36.2091756 2.508958 ] [ 55.7576237 14.0802352 -58.7999122 ] [ 71.1408569 4.8468764 58.1235992 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.597733752986989e-08 -1.366010009445185e-07 -1.605925633983841e-08 ] [ -7.818978730259218e-08 1.472635449956069e-08 1.19490949217263e-07 ] [ -7.47912989607205e-08 3.353657581496824e-08 -1.063679138506506e-07 ] [ -3.435535503917978e-08 5.801349460476181e-08 4.019793850169126e-09 ] [ 8.9333561123504e-08 2.255902365280521e-08 -9.42078446319327e-08 ] [ 1.139802177088584e-07 7.76555205198727e-09 9.312427175498958e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 94.86065 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.519835156638916e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4176059 -0.4232536 1.3063453 ] [ 0.9286634 1.2169166 3.1203696 ] [ 0.7714142 1.4962959 -0.2531872 ] [ -0.0443793 2.9506309 1.6072866 ] [ 3.1063714 1.7789485 0.1620877 ] [ 3.2173609 1.5817808 2.5432254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.176059e-11 -4.232536e-11 1.3063453e-10 ] [ 9.286634e-11 1.2169166e-10 3.1203696e-10 ] [ 7.714142000000001e-11 1.4962959e-10 -2.531872e-11 ] [ -4.43793e-12 2.9506309e-10 1.6072866e-10 ] [ 3.1063714e-10 1.7789485e-10 1.620877e-11 ] [ 3.2173609e-10 1.5817808e-10 2.5432254e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.71e-05 -1.66e-05 2.6e-05 ] [ -2.12e-05 -2.37e-05 5.59e-05 ] [ 2.25e-05 -2.22e-05 -4.85e-05 ] [ -2.44e-05 2.22e-05 1.53e-05 ] [ 5.6e-05 4.35e-05 -4.06e-05 ] [ 1.42e-05 -3.1e-06 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.546251883968001e-14 -2.659613190528e-14 4.16565921408e-14 ] [ -3.396614436096001e-14 -3.797158591296e-14 8.956167310272e-14 ] [ 3.604897396800001e-14 -3.556832098176e-14 -7.77055661088e-14 ] [ -3.909310954752e-14 3.556832098176e-14 2.451330229824e-14 ] [ 8.97218907648e-14 6.969468300480001e-14 -6.504837080448e-14 ] [ 2.275090801536e-14 -4.96674752448e-15 -1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }