{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4 0 0 ] "si-unit" "m" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.386566 5.8038 0 ] "si-unit" "m" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.433064 -0.220286 5.20849 ] "si-unit" "m" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0990081 -0.244555 -0.290689 ] [ 1.37678 1.31208 1.41317 ] [ 0.146167 2.66383 2.23753 ] [ 1.10278 3.83154 3.71513 ] [ 2.55958 0.422069 2.77183 ] [ 3.95966 1.45431 4.3569 ] [ 2.78855 2.68274 0.381413 ] [ 4.33575 3.68618 1.46711 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.90081e-12 -2.44555e-11 -2.90689e-11 ] [ 1.37678e-10 1.31208e-10 1.41317e-10 ] [ 1.46167e-11 2.66383e-10 2.23753e-10 ] [ 1.10278e-10 3.83154e-10 3.71513e-10 ] [ 2.55958e-10 4.22069e-11 2.77183e-10 ] [ 3.95966e-10 1.45431e-10 4.356900000000001e-10 ] [ 2.78855e-10 2.68274e-10 3.81413e-11 ] [ 4.33575e-10 3.68618e-10 1.46711e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7734028000000002 -0.7511818000000002 1.8167331000000004 ] [ -0.31505180000000005 -3.707436000000001 -5.3803844000000005 ] [ 2.4112335000000003 -4.569120300000001 6.386840300000002 ] [ 2.1383853000000004 1.9125677000000005 2.3754630000000003 ] [ 2.7933957000000005 -3.696649700000001 3.516023600000001 ] [ -0.18603770000000003 0.6003390000000001 -2.2314224000000005 ] [ -1.9240283000000005 0.7139843000000001 -2.6857854000000003 ] [ -5.691299600000001 9.497496800000002 -3.797467800000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.239127894830175e-09 -1.203525927846062e-09 2.910727323034386e-09 ] [ -5.047686324596412e-10 -5.939967331250425e-09 -8.62032616761811e-09 ] [ 3.863221972818039e-09 -7.320537782595071e-09 1.023284629374955e-08 ] [ 3.42607096214908e-09 3.064271279883122e-09 3.805911313531543e-09 ] [ 4.475513320056074e-09 -5.922685773423111e-09 5.633290856512563e-09 ] [ -2.980652559831018e-10 9.61849118278926e-10 -3.575132829864202e-09 ] [ -3.082633185414743e-09 1.143928962502846e-09 -4.303102611818343e-09 ] [ -9.118467236213546e-09 1.521666745444977e-08 -6.084214177527387e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.82815207419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.696167204666611e-18 } }