#  Isolated Bi atom. Spin-polarized, collinear.

  ndtset   6
  udtset   3 2

   nband1? 4 4
 nspinor1? 1
  nsppol1? 2
  nspden1? 2

   nband2? 8
 nspinor2? 2
  nsppol2? 1
  nspden2? 4
    nsym2? 1

   nband3? 8
 nspinor3? 2
  nsppol3? 1
  nspden3? 4
    nsym3? 1

  occopt?1 2
     occ?1 5*1 3*0

  occopt?2 7
  tsmear?2 0.02
  getwfk?2 -1

#Additional test for kinetic energy density

 prtkden   1
 usekden   1

#Common data
   acell   3*10   #This parameter is of course for testing purposes only
    xred   3*0.0

  kptopt 0
  ntypat   1
   znucl   83.d0
   natom   1
   typat   1
  spinat   0 0 3
  so_psp   0

    ecut   8
   nstep   20

  toldfe   1.0d-7



 pp_dirpath "$ABI_PSPDIR"
 pseudos "PseudosHGH_pwteter/83bi.5.hgh"

#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = abinit
#%% test_chain = t51.in, t52.in, t53.in
#%% [files]
#%% files_to_test = 
#%%   t51.out, tolnlines = 0, tolabs = 0.000e+00, tolrel = 0.000e+00
#%% [paral_info]
#%% max_nprocs = 1
#%% [extra_info]
#%% authors = L.E. Diaz, A. Lherbier
#%% keywords = 
#%% description = 
#%%   Bismuth atom, isolated, in a supercell.
#%%   Compares different spin treatments :
#%%   - spin-polarized collinear (nspinor=1, nspden=2, nsppol=2, no spin-orbit)
#%%   - spinor (nspinor=2, nspden=4, nsppol=1, no spin-orbit)
#%%   Both with fixed occupation numbers and metallic occupations.
#%%   This test has been contributed by L.E. Diaz.
#%%   Additional test added for kinetic energy density by A. Lherbier
#%% topics = spinpolarisation
#%%<END TEST_INFO>