{ "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" [ [ 8.50423173778322e-10 4.822641350498765e-10 9.342279058471834e-10 ] [ -3.322044329634105e-10 -4.233703655165376e-10 -2.804833197696015e-09 ] [ -1.153217732255003e-09 7.605279275031514e-10 6.487346118278727e-10 ] [ -1.067974085363002e-09 2.272911200461064e-09 -1.279701084931073e-09 ] [ 1.579637680751572e-09 -3.66922478812512e-11 3.205763157026304e-11 ] [ 5.927584059210106e-10 -1.843606212523421e-09 -2.272263280235612e-09 ] [ 2.710274015277696e-11 -2.427438251619306e-09 3.416124461242806e-09 ] [ -4.965255898046035e-10 1.215403974744086e-09 1.325652952374576e-09 ] ] "source-value" [ [ 0.5307924 0.3010056 0.5830992 ] [ -0.2073457 -0.264247 -1.7506392 ] [ -0.7197819 0.4746842 0.4049083 ] [ -0.666577 1.4186396 -0.7987266 ] [ 0.9859323 -0.0229015 0.0200088 ] [ 0.3699707 -1.1506885 -1.4182352 ] [ 0.0169162 -1.5150878 2.1321772 ] [ -0.3099069 0.7585955 0.8274075 ] ] } "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" -5.860846353376655e-18 "source-value" -36.580526 } }