{ "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" [ 5.47042 0 0 ] "si-unit" "m" "si-value" [ 5.47042e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0146058 5.3888 0 ] "si-unit" "m" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.134413 -0.103851 5.39218 ] "si-unit" "m" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.517169 -0.7843483 0.3890975 ] [ 0.8594333 0.6480127 1.2957871 ] [ -0.4433729 -0.0356441 -1.7269271 ] [ 0.9072807 0.5121489 -0.3126503 ] [ -2.4257498 0.5531286 1.3071884 ] [ 0.0651036 0.4824769 -0.6056818 ] [ 0.0467478 -0.1979992 0.3912369 ] [ 1.5077262 -1.1777756 -0.7380508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.285960808025151e-10 -1.256664508824224e-09 6.23402917711728e-10 ] [ 1.376963940396993e-09 1.038230797921484e-09 2.076079797154232e-09 ] [ -7.103616946762963e-10 -5.710814368945727e-11 -2.766842225445944e-09 ] [ 1.453623926043059e-09 8.205529939484372e-10 -5.009210011461063e-10 ] [ -3.886479617470276e-09 8.862097112158349e-10 2.094346693460959e-09 ] [ 1.043074658499149e-10 7.730132092560594e-10 -9.704092196040615e-10 ] [ 7.489823223383425e-11 -3.172296891771033e-10 6.268306143742676e-10 ] [ 2.415643668207625e-09 -1.887004530868692e-09 -1.182487736722737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.841282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.902624070069987e-18 } }