{ "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" [ [ 0.0227232 -1.0839409 0.8560012 ] [ 0.9366874 1.0040528 2.1804012 ] [ -0.1577781 0.2038069 -2.5495892 ] [ 1.1732884 0.5083406 -1.1206823 ] [ -3.3533457 0.8583116 1.3648887 ] [ -0.5581327 0.7800703 -1.0698065 ] [ 0.0887397 -0.0310142 0.8643419 ] [ 1.8478179 -2.2396272 -0.525555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.640657978976256e-11 -1.736664768308911e-09 1.371465110016745e-09 ] [ 1.500738653277938e-09 1.608669922208778e-09 3.493387826604265e-09 ] [ -2.527883830942445e-10 3.265346503377235e-10 -4.084892208884176e-09 ] [ 1.879815243935839e-09 8.144514247234445e-10 -1.795530980404372e-09 ] [ -5.372652082000211e-09 1.375166778881441e-09 2.186792765134105e-09 ] [ -8.942271632439803e-10 1.249810397240442e-09 -1.714018963079875e-09 ] [ 1.421766726768058e-10 -4.969022615281536e-11 1.384828384557851e-09 ] [ 2.960530638875752e-09 -3.588278339147766e-09 -8.42031933944544e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.665157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.714188072256147e-18 } }