{ "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" [ [ 2.7467582 0.2584707 0.0262083 ] [ -0.4775567 0.4621385 -1.5502618 ] [ 1.3067652 0.9984548 -0.4128212 ] [ -4.1799099 4.4303363 -5.6056452 ] [ -1.4281267 0.5835948 3.3546576 ] [ -1.3317028 0.3711494 -0.6823525 ] [ 2.6818865 -4.53948 4.2992755 ] [ 0.6818863 -2.5646645 0.5709393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.400791807287898e-09 4.141157161136237e-10 4.199032587686219e-11 ] [ -7.651301861501477e-10 7.40427506371809e-10 -2.483793232542781e-09 ] [ 2.093668669564337e-09 1.599700950665143e-09 -6.614124806598407e-10 ] [ -6.696953974005276e-09 7.098181300622013e-09 -8.981233757934256e-09 ] [ -2.288111229131528e-09 9.35021952283903e-10 5.374754021790518e-09 ] [ -2.133623109592375e-09 5.946468964031196e-10 -1.093249231651485e-09 ] [ 4.296855885340041e-09 -7.273048786510319e-09 6.888198749228666e-09 ] [ 1.092502296904714e-09 -4.109045535949293e-09 9.147456058923162e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.968837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.602625355955466e-18 } }