{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4003792 1.8293474 -2.8966132 ] [ -1.0157543 0.2283737 0.820487 ] [ -0.6195067 -0.7838639 -2.059575 ] [ -1.798779 -1.7975646 4.3467252 ] [ 3.8759702 2.6843647 -2.5730727 ] [ -0.2830193 -2.0865751 0.0831529 ] [ 0.0348821 1.277753 -0.0513624 ] [ -1.5941721 -1.3518353 2.3302581 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.243654814494607e-09 2.930937635601266e-09 -4.640885948540675e-09 ] [ -1.627417791937069e-09 3.65895002945593e-10 1.31456508907033e-09 ] [ -9.925591511689593e-10 -1.255888414469109e-09 -3.29980291378416e-09 ] [ -2.881961659786003e-09 -2.880015976497704e-09 6.964221492482204e-09 ] [ 6.2099888373575e-09 4.300826364040806e-09 -4.122516923558732e-09 ] [ -4.534469056951814e-10 -3.343061842763422e-09 1.332256323317203e-10 ] [ 5.588728510440768e-11 2.047185983757062e-09 -8.229163646817793e-11 ] [ -2.55414526815164e-09 -2.165878912832155e-09 3.733485048249828e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.556912 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.857062973504297e-18 } }