## This Atoms file was generated by Demeter 0.9.25 ## Demeter written by and copyright (c) Bruce Ravel, 2006-2016 title = fe foil space = I m m m a = 2.83500 b = 2.83500 c = 2.92000 alpha = 90.00000 beta = 90.00000 gamma = 90.00000 rmax = 10.00000 core = fe # polarization = 0.0 0.0 0.0 shift = 0.00000 0.00000 0.00000 atoms # el. x y z tag Fe 0.00000 0.00000 0.00000 fe