{ "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" [ [ 1.3684024 1.2642957 -2.6133816 ] [ -0.7311572 0.4647281 0.4381177 ] [ -0.5927892 -0.8124062 -1.5700472 ] [ -1.6003821 -1.3087566 3.893746 ] [ 3.7603625 2.0027522 -2.2238237 ] [ -0.1195653 -1.875907 -0.3452242 ] [ -0.3473223 1.07112 0.1865727 ] [ -1.7375487 -0.8058262 2.2340403 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.19242233312661e-09 2.025625012317971e-09 -4.187098900748897e-09 ] [ -1.17144297196959e-09 7.445764968488044e-10 7.019419360986681e-10 ] [ -9.497529973027355e-10 -1.301618220232969e-09 -2.515492917392502e-09 ] [ -2.564094784966807e-09 -2.096859226837697e-09 6.238468808533517e-09 ] [ 6.02476488323304e-09 3.208762752095766e-09 -3.562958340920953e-09 ] [ -1.915647283189382e-10 -3.005534338195066e-09 -5.531101421743833e-10 ] [ -5.564716689424837e-10 1.716123422071296e-09 2.989224180195322e-10 ] [ -2.783859904641433e-09 -1.291075898068105e-09 3.579327138585019e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.821903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.739301549916538e-18 } }