{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39854e-10 0.0 0.0 ] "source-value" [ 5.39854 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] "source-value" [ 0.0197648 5.43736 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] "source-value" [ -0.0299081 -0.213673 5.1785 ] } "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" [ [ -9.36764632090896e-10 7.659950027427747e-09 -2.944097433711531e-09 ] [ -2.851350793704322e-09 2.991374141002773e-09 -9.026498217612921e-09 ] [ -2.903858928097801e-09 1.951607656790252e-09 5.290186449151014e-09 ] [ -1.268653916912995e-09 1.087874881387621e-09 -5.887662784567294e-09 ] [ 9.470424028521336e-09 -9.634093099477862e-09 6.837648097480046e-09 ] [ 2.523999674160639e-09 -3.434595154415698e-09 -4.519389370596845e-09 ] [ 1.325865240776832e-11 -2.412300566470664e-09 5.801191870383759e-09 ] [ -4.047053924066066e-09 1.790181953538169e-09 4.448621389473772e-09 ] ] "source-value" [ [ -0.5846825 4.7809648 -1.8375611 ] [ -1.7796732 1.8670689 -5.6338971 ] [ -1.8124462 1.2180977 3.3018747 ] [ -0.7918315 0.6789981 -3.6747901 ] [ 5.9109738 -6.013128 4.2677243 ] [ 1.5753567 -2.1437057 -2.820781 ] [ 0.0082754 -1.5056396 3.6208192 ] [ -2.5259724 1.1173437 2.7766111 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.831382065390982e-18 "source-value" -17.672097 } }