{ "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" [ [ 2.2799796 0.33761 -0.2643913 ] [ -0.4206915 0.2581365 -1.1912387 ] [ 1.1052392 1.1940682 -0.5957823 ] [ -2.0262091 2.4138236 -3.4664168 ] [ -1.1066007 0.5024117 2.7449784 ] [ -1.1639609 0.0618302 -0.2729694 ] [ 0.7396688 -2.4585561 2.2058293 ] [ 0.5925745 -2.309324 0.8399909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.652930011020936e-09 5.40910848948288e-10 -4.236015596029191e-10 ] [ -6.740220858692833e-10 4.135802652751392e-10 -1.908574794932185e-09 ] [ 1.770788406631695e-09 1.913108153680739e-09 -9.545484721464518e-10 ] [ -3.246344848872209e-09 3.867371738655292e-09 -5.55381195490835e-09 ] [ -1.772969770100915e-09 8.049522797563834e-10 4.39794021708099e-09 ] [ -1.864870941505327e-09 9.906290089938817e-11 -4.373451908738035e-10 ] [ 1.185080058495191e-09 -3.939041104345227e-09 3.53412813393563e-09 ] [ 9.494090099822496e-10 -3.69994492265234e-09 1.345813781664751e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.475525 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.683805676560592e-18 } }