{ "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" [ [ 2.3120319 0.205529 0.3845512 ] [ -0.3709623 0.422489 -1.8176767 ] [ 1.2183788 1.2180021 -0.2785296 ] [ -1.597974 3.0154223 -4.5414444 ] [ -1.5699942 -0.2926228 3.4226729 ] [ -1.1397187 0.1641555 -0.7302342 ] [ 0.3587179 -2.9047506 2.8471287 ] [ 0.7895206 -1.8282243 0.7135321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.704283456723804e-09 3.292937586964032e-10 6.16118942140585e-10 ] [ -5.943471242581958e-10 6.769019983451712e-10 -2.912239112912895e-09 ] [ 1.952058028638359e-09 1.951454488705304e-09 -4.462536133207757e-10 ] [ -2.560236583446259e-09 4.831239110898964e-09 -7.276196042343082e-09 ] [ -2.5154080020316e-09 -4.688334088730343e-10 5.483726501025736e-09 ] [ -1.826030655428569e-09 2.630061042757344e-10 -1.169964162948591e-09 ] [ 5.747294328424724e-10 -4.653923500574773e-09 4.561603039548697e-09 ] [ 1.264951446959989e-09 -2.929138231038445e-09 1.143204448810328e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.485446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.685395195986089e-18 } }