{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46402e-10 0.0 0.0 ] "source-value" [ 5.46402 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] "source-value" [ 0.0122514 5.46447 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] "source-value" [ -0.0384841 0.0769758 5.42124 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.187192327814611e-09 6.429792729706349e-10 -7.051395601984608e-10 ] [ 1.717815961453509e-09 3.409791217278445e-09 1.067807298776776e-09 ] [ 2.019736853018869e-09 -1.207094766353293e-09 4.294982104381114e-10 ] [ -1.096150444069377e-09 -1.05681652737575e-10 -3.864022388429509e-09 ] [ 1.401693055886055e-10 -9.056096668287918e-10 -1.279730244545572e-09 ] [ 2.494792795451766e-09 -5.257653131342035e-10 -1.645161577577105e-09 ] [ -8.180080966039584e-10 -1.885891178334899e-09 4.175484401989394e-09 ] [ -1.271163886807141e-09 5.772720871396819e-10 1.821264019764027e-09 ] ] "source-value" [ [ -1.989289 0.4013161 -0.4401135 ] [ 1.0721764 2.1282243 0.6664729 ] [ 1.2606206 -0.7534093 0.2680717 ] [ -0.6841633 -0.0659613 -2.4117331 ] [ 0.0874868 -0.5652371 -0.7987448 ] [ 1.5571272 -0.3281569 -1.0268291 ] [ -0.5105605 -1.1770807 2.6061324 ] [ -0.7933981 0.3603049 1.1367436 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.748157100535025e-18 "source-value" -35.877175 } }