************************************************************************ Output generated by CrystalDiffract 5.2.6 (c) 1995-2013 CrystalMaker Software Ltd ************************************************************************ (This file looks best in a mono-spaced font e.g., Monaco or Courier) X-ray wavelength: 1.7889 A Filename: austenite (volume fraction: 100.00%) UNIT CELL DATA a: 3.5670 b: 3.5670 c: 3.5670 A alpha: 90.000 beta: 90.000 gamma: 90.000 degrees cell volume: 45.385 A**3 calculated density: 8222.18 kg / m**3 RECIPROCAL UNIT CELL DATA a*: 0.2803 b*: 0.2803 c*: 0.2803 1/A alpha*: 90.000 beta*: 90.000 gamma*: 90.000 degrees Lattice type: F ASYMMETRIC UNIT label ------- Site Occupancy ------- x y z Num In Cell T1 Si 1.000 0.0000 0.0000 0.0000 4 T2 Si 1.000 0.0000 0.0000 0.0000 4 Total of: 8 atoms in the unit cell REFLECTIONS LIST Notes: 1. Intensities are relative to 1 cubic Angstrom of material 2. multiplicities may show unexpected values if two reflections with different sets of Miller Indices have the same d-spacing. In these cases, CrystalDiffract lists the SUM of the multiplicities for all reflections with the same d-spacing ref no. (N) h k l d(hkl) 2-Theta Intensity I/Imax m(hkl) [ 1] 3 1 1 1 2.05941 51.4845 4.27467e-01 100.0 8 [ 2] 4 0 0 2 1.78350 60.2004 2.02083e-01 47.3 6 [ 3] 8 0 2 2 1.26112 90.3475 1.28595e-01 30.1 12 [ 4] 11 1 1 3 1.07549 112.5407 1.64743e-01 38.5 24 [ 5] 12 2 2 2 1.02970 120.6037 5.04710e-02 11.8 8 *****************************************************************