{ "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" [ [ 0.5757796 0.3109737 0.5626475 ] [ -0.1129547 -0.2481634 -1.8986396 ] [ -0.7563579 0.4846616 0.4487467 ] [ -0.7291888 1.4258386 -0.8488087 ] [ 0.9882373 -0.059794 0.0551924 ] [ 0.3694968 -1.1623554 -1.3894322 ] [ -0.0491213 -1.4580524 2.201392 ] [ -0.285891 0.7068914 0.868902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.225006138535756e-10 4.98234791823673e-10 9.014606702515681e-10 ] [ -1.809733795494778e-10 -3.976015976182387e-10 -3.041955978445064e-09 ] [ -1.211818944337385e-09 7.765134845195213e-10 7.189714714011514e-10 ] [ -1.168289247509207e-09 2.284445269954203e-09 -1.359941454671641e-09 ] [ 1.583330697862516e-09 -9.580054886411521e-11 8.842797292584194e-11 ] [ 5.919991344204135e-10 -1.862298646940632e-09 -2.226115787026709e-09 ] [ -7.870099844330304e-11 -2.33605746718133e-09 3.527018795616153e-09 ] [ -4.580478762971328e-10 1.132564874524581e-09 1.392134470166362e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.577122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.860300972454935e-18 } }