{ "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" [ [ -0.0076219 -0.8524777 0.6598027 ] [ 0.4963158 0.424832 2.7760579 ] [ -0.1986987 0.5245379 -2.9559444 ] [ 2.0381948 1.4153521 -2.1338594 ] [ -3.1271636 1.3389235 1.0134655 ] [ -1.386458 -0.0215689 -0.2574994 ] [ 0.0998719 0.7650184 0.8918023 ] [ 2.0855597 -3.5946173 0.0061749 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.221162998607552e-11 -1.365819840693356e-09 1.057120460280716e-09 ] [ 7.951855712936486e-10 6.806558981677055e-10 4.447735065367144e-09 ] [ -3.18350411723353e-10 8.404023601035284e-10 -4.735945010064684e-09 ] [ 3.265548057196132e-09 2.267644044820184e-09 -3.418819642754315e-09 ] [ -5.010268409336763e-09 2.145191928739709e-09 1.623750730087382e-09 ] [ -2.221350593321126e-09 -3.455718731637312e-11 -4.125595185500275e-10 ] [ 1.600124232548755e-10 1.225694594961823e-09 1.428824795435668e-09 ] [ 3.341434992622662e-09 -5.759211798783219e-09 9.89328041577792e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -218.51971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.50107170545996e-17 } }