{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] "source-value" [ 5.41394 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] "source-value" [ 0.0321649 5.43167 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] "source-value" [ -0.034689 -0.0250046 5.52467 ] } "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" [ [ 1.167071913712723e-10 1.668058123447296e-10 9.970521350666687e-11 ] [ 1.529524319753203e-10 -7.425832289148672e-11 -2.994533793516653e-10 ] [ -2.102775103792339e-10 -2.5146162063456e-12 -8.25088916179584e-11 ] [ -2.187347598897888e-10 2.478604082439878e-10 -1.017729826534714e-10 ] [ 2.401326297488832e-10 -7.785472875219648e-11 -3.661069709125248e-11 ] [ 6.370510592560128e-11 -2.097204335681818e-10 -1.275262094385485e-10 ] [ -1.517437499325888e-10 -1.87286436088416e-10 3.397120723908173e-10 ] [ 7.2586611805344e-12 1.369683169179091e-10 2.084550344730739e-10 ] ] "source-value" [ [ 0.0728429 0.104112 0.0622311 ] [ 0.0954654 -0.0463484 -0.1869041 ] [ -0.1312449 -0.0015695 -0.051498 ] [ -0.1365235 0.1547023 -0.0635217 ] [ 0.149879 -0.0485931 -0.0228506 ] [ 0.0397616 -0.1308972 -0.0795956 ] [ -0.094711 -0.116895 0.2120316 ] [ 0.0045305 0.0854889 0.1301074 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.79854285172765e-18 "source-value" 29.950149 } }