{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0192854 0.1973631 0.1519573 ] [ -0.3210079 0.4981241 -1.4079415 ] [ 0.9063277 0.9031302 -0.1228303 ] [ -2.016559 2.5607727 -3.690304 ] [ -1.1595043 0.0343379 2.7184576 ] [ -0.9642287 0.2179644 -0.552032 ] [ 0.9569463 -2.6990975 2.3550687 ] [ 0.5787405 -1.712595 0.5476242 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.235251885257343e-09 3.162105472338054e-10 2.434624354257281e-10 ] [ -5.143113567094086e-10 7.980827938522794e-10 -2.255770973338911e-09 ] [ 1.452097063686962e-09 1.446974103899747e-09 -1.967958366072102e-10 ] [ -3.230883710882406e-09 4.102810184925091e-09 -5.912518841156735e-09 ] [ -1.857730696482526e-09 5.501538104062859e-11 4.355449247239717e-09 ] [ -1.544864692972196e-09 3.492174687238295e-10 -8.844527716202878e-10 ] [ 1.533197001852754e-09 -4.324430947387815e-09 3.773236042604756e-09 ] [ 9.272445062494769e-10 -2.74387969250523e-09 8.773906974529428e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.416660292303476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.514156894064423e-18 } }