{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47042e-10 0.0 0.0 ] "source-value" [ 5.47042 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] "source-value" [ 0.0146058 5.3888 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] "source-value" [ 0.134413 -0.103851 5.39218 ] } "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" [ [ -5.501461154259034e-10 -1.918185771827378e-09 1.429377386152182e-09 ] [ 1.555929632422946e-09 1.523281438550256e-09 4.705339270948189e-09 ] [ -1.222803307031927e-09 9.06774128796789e-10 -6.171661568234723e-09 ] [ 3.122863814965857e-09 2.281144625897693e-09 -2.915143538691082e-09 ] [ -6.919921629352409e-09 2.221010931877517e-10 2.310155237970518e-09 ] [ -2.963704710979219e-10 1.215794264968913e-09 -1.613128138873816e-09 ] [ 1.494143453436077e-10 -3.050816656028736e-11 1.552783438192681e-09 ] [ 4.161033730175751e-09 -4.200401613013738e-09 7.022777523183878e-10 ] ] "source-value" [ [ -0.3433742 -1.1972374 0.8921472 ] [ 0.9711349 0.9507575 2.9368418 ] [ -0.7632138 0.5659639 -3.8520482 ] [ 1.9491383 1.4237785 -1.8194895 ] [ -4.3190754 0.1386246 1.4418855 ] [ -0.1849799 0.7588391 -1.0068354 ] [ 0.0932571 -0.0190417 0.9691712 ] [ 2.597113 -2.6216845 0.4383273 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -8.13222e-12 6.58783e-12 -1.48119e-12 ] [ 1.29496e-10 1.3028e-10 1.25678e-10 ] [ 7.31236e-13 2.63688e-10 2.91411e-10 ] [ 1.38293e-10 3.97853e-10 4.11798e-10 ] [ 2.91023e-10 -2.59257e-14 2.64672e-10 ] [ 4.15592e-10 1.24599e-10 4.16086e-10 ] [ 2.63613e-10 2.74458e-10 -9.27687e-13 ] [ 4.0418e-10 4.10114e-10 1.35651e-10 ] ] "source-value" [ [ -0.0813222 0.0658783 -0.0148119 ] [ 1.29496 1.3028 1.25678 ] [ 0.00731236 2.63688 2.91411 ] [ 1.38293 3.97853 4.11798 ] [ 2.91023 -0.000259257 2.64672 ] [ 4.15592 1.24599 4.16086 ] [ 2.63613 2.74458 -0.00927687 ] [ 4.0418 4.10114 1.35651 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.73050816375094e-18 "source-value" -35.767019 } }