{ "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" [ [ 3.8128886 -0.6873502 2.0380916 ] [ 2.6633154 -0.7214228 1.1739795 ] [ 1.1550893 -0.6801892 -2.7110671 ] [ -7.0544687 -0.0118131 2.8055032 ] [ -0.8573185 2.3100766 -1.2197548 ] [ 0.1814695 0.1699095 0.6109889 ] [ 0.0990244 -0.3792109 -2.6977413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.108921022964971e-09 -1.101256429815227e-09 3.265382739471674e-09 ] [ 4.267101702852363e-09 -1.155846753394855e-09 1.880922523695003e-09 ] [ 1.850657086643416e-09 -1.089783242939153e-09 -4.343608360826141e-09 ] [ -1.130250491642435e-08 -1.89266727951054e-11 4.494911673652229e-09 ] [ -1.373575668595929e-09 3.701150751270164e-09 -1.954262639769343e-09 ] [ 2.90746192683663e-10 2.722250307946229e-10 9.789121392133625e-10 ] [ 1.586545798758696e-10 -6.075628433381106e-10 -4.322258075436784e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.342204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.540921700486133e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3975111 2.1279397 1.6556774 ] [ 3.1443127 4.2821569 1.3044572 ] [ 2.6968925 3.5147141 3.5729999 ] [ 5.1557224 3.179727 1.5999564 ] [ 4.200919 1.6314021 3.0055313 ] [ 4.6137102 4.9319437 3.0037672 ] [ 4.856983 3.2275026 4.5359066 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3975111e-10 2.1279397e-10 1.6556774e-10 ] [ 3.1443127e-10 4.2821569e-10 1.3044572e-10 ] [ 2.6968925e-10 3.5147141e-10 3.5729999e-10 ] [ 5.155722400000001e-10 3.179727e-10 1.5999564e-10 ] [ 4.200919e-10 1.6314021e-10 3.0055313e-10 ] [ 4.6137102e-10 4.9319437e-10 3.0037672e-10 ] [ 4.856983e-10 3.2275026e-10 4.5359066e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1636905 -0.0496272 0.0254856 ] [ 0.0356163 0.0074037 -0.0298252 ] [ -0.0244402 0.0307763 0.0325677 ] [ 0.1738917 0.0574178 -0.1674738 ] [ 0.0336287 -0.0159936 -0.0206011 ] [ -0.0441618 -0.0112432 -0.0165765 ] [ -0.0108442 -0.0187339 0.1764234 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.62261094307777e-10 -7.95115402508448e-11 4.08324328234704e-11 ] [ 5.706360364953419e-11 1.18620351451458e-11 -4.77852385443768e-11 ] [ -3.91575173702868e-11 4.93090687409742e-11 5.217920796312179e-11 ] [ 2.786052185865377e-10 9.19934575356852e-11 -2.683226091671892e-10 ] [ 5.38791173717958e-11 -2.56245722135424e-11 -3.30066010546974e-11 ] [ -7.07550040753812e-11 -1.80135923313888e-11 -2.6558480973501e-11 ] [ -1.73743238544228e-11 -3.00150168436926e-11 2.826614491708356e-10 ] ] } "relaxed-potential-energy" { "source-value" -30.397889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.870278747872562e-18 } }