################################################################################
#
#  FHI-aims code project
#  VB, Fritz-Haber Institut, 2009
#
#  Suggested "light" defaults for Fm atom (to be pasted into control.in file)
#  Be sure to double-check any results obtained with these settings for post-processing,
#  e.g., with the "tight" defaults and larger basis sets.
#
#
################################################################################
  species        Fm
#     global species definitions
    nucleus             100
    mass                257
#
    l_hartree           4
#
    cut_pot             4.0  1.5  1.0
    basis_dep_cutoff    1e-4
#
    radial_base         78 5.5
    radial_multiplier   1
    angular_grids specified
      division   0.0735  110
      division   0.1138  194
      division   0.1445  302
#      division   0.2429  434
#      division   1.0077  590
#      division   1.0799  770
#      division   7.7672  974
#      outer_grid  974
      outer_grid 302
################################################################################
#
#  Definition of "minimal" basis
#
################################################################################
#     valence basis states
    valence      7  s   2.
    valence      6  p   6.
    valence      6  d   0.
    valence      5  f  12.
#     ion occupancy
    ion_occ     7  s    1.
    ion_occ     6  p    6.
    ion_occ     6  d    0.
    ion_occ     5  f   11.
################################################################################
#
#  Suggested additional basis functions. For production calculations, 
#  uncomment them one after another (the most important basis functions are
#  listed first).
#
#  Constructed for dimers: 1.98, 2.375, 2.75, 3.25, 4.25 AA
#
################################################################################
#
#  Necessary addition to the minimal basis
   confined 6 d  auto
#  "First tier" - max. impr. -424.25 meV, min. impr. -12.95 meV
     hydro 3 d 5.2
     hydro 5 g 12
     hydro 4 f 8
     hydro 2 p 1.5
     hydro 4 s 4.6  
#  "Second tier" - max. impr. -27.52  meV, min. impr. -0.98 meV
#     hydro 6 h 15.6 # -27.52 meV; switched with s above
#     hydro 3 d 3.6
#     hydro 4 f 5.4
#     hydro 5 g 27.2
#     hydro 2 p 2.3 
#     hydro 5 s 5.8 
#  "Third tier" - max. impr. -2.07 meV, min. impr. -0.30 meV
#     hydro 5 g 10
#     hydro 6 h 15.2
#     hydro 5 d 12.8
#     hydro 4 p 6.4
#     hydro 5 g 52.4
#     hydro 4 f 9.4
#     hydro 1 s 14.8
#  Could add further functions if required.