{ "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" [ [ 2.0596441 -0.6643238 0.6497125 ] [ -0.5957504 2.4636908 -0.0562204 ] [ 0.2045553 -0.6523802 -1.140982 ] [ -0.591615 -0.9819152 -1.132815 ] [ 0.7239453 -0.743736 -0.4049995 ] [ -1.8422747 2.6357287 -1.008172 ] [ 0.717676 -1.113075 0.3958947 ] [ -0.6761807 -0.9439894 2.6975817 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.299913651375959e-09 -1.064364069770089e-09 1.040954186317725e-09 ] [ -9.544973705761537e-10 3.947267833160767e-09 -9.00750112341336e-11 ] [ 3.277337220208602e-10 -1.045228312924247e-09 -1.828054700214588e-09 ] [ -9.4787172932391e-10 -1.573201590009437e-09 -1.81496972364471e-09 ] [ 1.15988824395412e-09 -1.191596441064624e-09 -6.48880735681683e-10 ] [ -2.951649477749359e-09 4.222902936703195e-09 -1.615269621453048e-09 ] [ 1.149843717982584e-09 -1.78334275688955e-09 6.342932378644396e-10 ] [ -1.083360917901764e-09 -1.512437759423679e-09 4.322002368045998e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.028313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.772372125103843e-18 } }