{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.33408e-10 0.0 0.0 ] "source-value" [ 5.33408 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] "source-value" [ 0.034982 5.4373 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] "source-value" [ 0.179208 0.185424 5.40079 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.874797206590772e-09 1.643733877990311e-10 2.038851460975661e-10 ] [ -5.134561105919213e-10 4.6985832125736e-10 -1.865737398621855e-09 ] [ 1.425641751143125e-09 1.142445978398041e-09 -4.605732270868377e-10 ] [ -3.528539261229293e-09 4.395078409200918e-09 -5.939424945526128e-09 ] [ -1.540777207249392e-09 3.948162135629779e-10 3.81245857693633e-09 ] [ -1.36197798137434e-09 5.162483840066514e-10 -7.55313964126082e-10 ] [ 1.821978910972228e-09 -4.465287230683332e-09 4.3101601643806e-09 ] [ 8.223328519564838e-10 -2.617533623759309e-09 6.945454877287449e-10 ] ] "source-value" [ [ 1.7943073 0.1025938 0.1272551 ] [ -0.3204741 0.2932625 -1.1645017 ] [ 0.8898156 0.7130587 -0.2874672 ] [ -2.202341 2.7431922 -3.7070975 ] [ -0.9616775 0.2464249 2.3795495 ] [ -0.8500798 0.3222169 -0.4714299 ] [ 1.1371898 -2.7870131 2.6901904 ] [ 0.5132598 -1.633736 0.4335012 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.288024492187628e-18 "source-value" -26.763744 } }