{ "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" [ [ 1.7479078 0.1458704 0.1501623 ] [ -0.3003208 0.3297028 -1.1204015 ] [ 0.8503095 0.6799574 -0.2376973 ] [ -2.1490422 2.5692659 -3.4945513 ] [ -0.9603171 0.2055974 2.253596 ] [ -0.8323098 0.2544494 -0.4912122 ] [ 1.148667 -2.6446438 2.5259586 ] [ 0.4951057 -1.5401996 0.4141453 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.800457012473962e-09 2.337101445467444e-10 2.405865263855559e-10 ] [ -4.811669644999526e-10 5.282421179722982e-10 -1.795081089209251e-09 ] [ 1.362346001344138e-09 1.089411849419954e-09 -3.808330568872838e-10 ] [ -3.443145169952597e-09 4.116417757598671e-09 -5.598888393046248e-09 ] [ -1.538597606174456e-09 3.29403347577266e-10 3.610658823928397e-09 ] [ -1.333507302822724e-09 4.076728798565875e-10 -7.870087026917338e-10 ] [ 1.840367412484474e-09 -4.237186466703671e-09 4.047031814028699e-09 ] [ 7.932467773648185e-10 -2.467671790485512e-09 6.635339172742022e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.40006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.428667581571725e-18 } }