{ "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" [ [ 4.40079177103069e-09 4.141157127018106e-10 4.199032553091264e-11 ] [ -7.651301798463994e-10 7.404275002715808e-10 -2.483793212079325e-09 ] [ 2.093668652315036e-09 1.59970093748554e-09 -6.61412475210601e-10 ] [ -6.696953918830466e-09 7.098181242141575e-09 -8.98123368393974e-09 ] [ -2.288111210280255e-09 9.350219445804517e-10 5.374753977509038e-09 ] [ -2.133623092013898e-09 5.946468915039475e-10 -1.093249222644432e-09 ] [ 4.296855849939139e-09 -7.273048726589184e-09 6.888198692478231e-09 ] [ 1.092502287903815e-09 -4.109045502095722e-09 9.147455983559175e-10 ] ] "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 ] ] } "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" -5.602625309796601e-18 "source-value" -34.968837 } }