{ "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" [ [ 1.7892631 1.0189621 -0.3298498 ] [ -0.2320283 0.2373167 -0.2289465 ] [ 0.6840948 1.1616561 -0.4620036 ] [ -1.7936362 1.1113968 -1.754309 ] [ -1.0986249 0.1391834 1.3601369 ] [ -1.0256305 -0.7725249 -0.3532618 ] [ 1.3431236 -1.3852135 0.9739828 ] [ 0.3334383 -1.5107768 0.794251 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.866715507280132e-09 1.632557254101272e-09 -5.284776379355559e-10 ] [ -3.717503176239686e-10 3.802232684654073e-10 -3.668127297139872e-10 ] [ 1.096040694970852e-09 1.861178244829707e-09 -7.402113666454349e-10 ] [ -2.873721985860553e-09 1.780653969391934e-09 -2.810712865459027e-09 ] [ -1.760191129808738e-09 2.229963894834547e-10 2.179179542267388e-09 ] [ -1.643241208679414e-09 -1.237721333765858e-09 -5.659877969817255e-10 ] [ 2.151921230764731e-09 -2.219356684516541e-09 1.560492471221322e-09 ] [ 5.342270487392966e-10 -2.420531268207037e-09 1.272530383247021e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 670.44011 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.07416346988858e-16 } }