{ "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" [ 5.4 0 0 ] "si-unit" "m" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.386566 5.8038 0 ] "si-unit" "m" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.433064 -0.220286 5.20849 ] "si-unit" "m" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0990081 -0.244555 -0.290689 ] [ 1.37678 1.31208 1.41317 ] [ 0.146167 2.66383 2.23753 ] [ 1.10278 3.83154 3.71513 ] [ 2.55958 0.422069 2.77183 ] [ 3.95966 1.45431 4.3569 ] [ 2.78855 2.68274 0.381413 ] [ 4.33575 3.68618 1.46711 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.90081e-12 -2.44555e-11 -2.90689e-11 ] [ 1.37678e-10 1.31208e-10 1.41317e-10 ] [ 1.46167e-11 2.66383e-10 2.23753e-10 ] [ 1.10278e-10 3.83154e-10 3.71513e-10 ] [ 2.55958e-10 4.22069e-11 2.77183e-10 ] [ 3.95966e-10 1.45431e-10 4.356900000000001e-10 ] [ 2.78855e-10 2.68274e-10 3.81413e-11 ] [ 4.33575e-10 3.68618e-10 1.46711e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.10967660000000003 2.3554694000000005 -2.5769741000000006 ] [ -1.9358933000000005 7.219032900000002 10.643996400000002 ] [ -0.28366310000000006 2.8270408000000002 -10.873759800000002 ] [ -3.1342706000000007 -3.487328300000001 -4.549609700000001 ] [ -5.338100700000001 6.838404100000002 -5.448443800000001 ] [ -0.24002450000000006 -0.6421500000000001 2.7859192000000004 ] [ 2.3000048000000004 -1.8256493000000005 3.4650738000000008 ] [ 8.522271000000002 -13.284819600000004 6.553797800000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.757212858165644e-10 3.773878034782e-09 -4.12876768944318e-09 ] [ -3.101643011177152e-09 1.156616583245726e-08 1.705356232446012e-08 ] [ -4.544783907480054e-10 4.529418713124667e-09 -1.742168387528851e-08 ] [ -5.021655119953161e-09 -5.587315917346943e-09 -7.289278355159752e-09 ] [ -8.552580211479044e-09 1.09563312628698e-08 -8.72936934802217e-09 ] [ -3.84561645487533e-10 -1.0288377255231e-09 4.463534646451973e-09 ] [ 3.685013948647844e-09 -2.925012650338457e-09 5.55166027744559e-09 ] [ 1.365418346481582e-08 -2.128462755002523e-08 1.050034169912061e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.763520398437521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.564288424795896e-18 } }