{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5443767 0.3078675 0.5867407 ] [ -0.19086 -0.2472367 -1.8056092 ] [ -0.7333554 0.4866218 0.4178778 ] [ -0.6821144 1.4345844 -0.8116654 ] [ 1.0056102 -0.0345754 0.0305607 ] [ 0.3769443 -1.1656456 -1.4371685 ] [ -0.0091666 -1.5480749 2.1762161 ] [ -0.3114349 0.7664589 0.8430479 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.721876216482555e-10 4.93258110804144e-10 9.400622320118267e-10 ] [ -3.05791429845888e-10 -3.961168605437433e-10 -2.892904846541391e-09 ] [ -1.174964876617432e-09 7.796540711316134e-10 6.695140415113383e-10 ] [ -1.092867744391019e-09 2.298457586244396e-09 -1.30043132779228e-09 ] [ 1.611165152078012e-09 -5.539589753480832e-11 4.896363905528256e-11 ] [ 6.039313448038215e-10 -1.867570128458388e-09 -2.302597770850205e-09 ] [ -1.468651221222528e-11 -2.480289412027298e-09 3.486682557228555e-09 ] [ -4.989737156811859e-10 1.228002530384085e-09 1.350711635594536e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.575689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.860071380545173e-18 } }