{ "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" [ [ 1.933508508375723e-09 8.670044200623054e-10 1.151282142679415e-09 ] [ 4.806440140509235e-10 -1.352512642333978e-10 -6.166632015386708e-09 ] [ -2.495245410347142e-09 1.599355508206095e-09 1.74726220534953e-09 ] [ -2.777939221156929e-09 3.925673984580231e-09 -2.750074005150313e-09 ] [ 2.974282441247403e-09 -8.698205659086853e-10 8.777255451380506e-10 ] [ 1.126262232133678e-09 -2.86421963654025e-09 -3.868038244129544e-09 ] [ -5.847781243904678e-10 -3.951754055395951e-09 6.616156151843522e-09 ] [ -6.567346001308512e-10 1.429011769447315e-09 2.392318379873708e-09 ] ] "source-value" [ [ 1.2068011 0.5411416 0.7185738 ] [ 0.2999944 -0.0844172 -3.848909 ] [ -1.5574097 0.9982392 1.0905553 ] [ -1.7338533 2.450213 -1.7164612 ] [ 1.8564011 -0.5428993 0.5478332 ] [ 0.7029576 -1.7877053 -2.4142396 ] [ -0.3649898 -2.4664909 4.1294799 ] [ -0.4099015 0.891919 1.4931677 ] ] } "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" -5.813229664206479e-18 "source-value" -36.283326 } }