{ "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" [ [ 8.111241845350291e-10 4.575675437462169e-10 6.49183862152345e-10 ] [ -3.374007723976512e-11 -2.88639968902562e-10 -2.782997613184118e-09 ] [ -1.10685522694359e-09 7.029316005973362e-10 5.520632799703526e-10 ] [ -9.883095378999494e-10 1.899122593740113e-09 -1.043058957168265e-09 ] [ 1.38673930061348e-09 -1.004063259959289e-10 -3.12873050509824e-12 ] [ 5.337590529483609e-10 -1.614658377764342e-09 -1.810524629874805e-09 ] [ -2.779037833665811e-10 -1.972017784762624e-09 3.063775220755429e-09 ] [ -3.248135922116602e-10 9.161007193417902e-10 1.374687407636498e-09 ] ] "source-value" [ [ 0.5062639 0.2855912 0.4051887 ] [ -0.0210589 -0.1801549 -1.7370105 ] [ -0.6908447 0.4387354 0.3445708 ] [ -0.6168543 1.1853391 -0.6510262 ] [ 0.8655346 -0.0626687 -0.0019528 ] [ 0.3331462 -1.0077905 -1.1300406 ] [ -0.1734539 -1.2308367 1.9122581 ] [ -0.2027327 0.5717851 0.8580124 ] ] } "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" -5.870483445750766e-18 "source-value" -36.640676 } }