{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3485165 -0.8845242 0.7492789 ] [ -0.6308573 2.869432 -0.0612669 ] [ 0.2015312 -0.6760966 -1.2150671 ] [ -0.5973416 -0.9862288 -1.22723 ] [ 0.8828983 -0.9595115 -0.363713 ] [ -2.1434831 3.0753638 -1.284891 ] [ 0.7965516 -1.3654839 0.4427114 ] [ -0.8578156 -1.0729508 2.9601777 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.762738229863044e-09 -1.417163993771823e-09 1.200477136038741e-09 ] [ -1.010744817121012e-09 4.597336865375386e-09 -9.816039480889151e-11 ] [ 3.22888577001769e-10 -1.083226165922369e-09 -1.946752100323256e-09 ] [ -9.570467461512654e-10 -1.580112726119639e-09 -1.966239214344384e-09 ] [ 1.414559014804065e-09 -1.537306892688739e-09 -5.827324652810304e-10 ] [ -3.434238509899909e-09 4.927275980814647e-09 -2.058622320476333e-09 ] [ 1.276216350780833e-09 -2.187746380658806e-09 7.093018548416371e-10 ] [ -1.374372099277525e-09 -1.719056687028657e-09 4.742727504353516e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.888754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.750012260844248e-18 } }