#Test linear chain of atoms
#Two different psps (Si+Ge), differ from those of
#preceeding test

 npsp        2            # Two pseudopotentials to be read
 znucl       14.0  32.0   # znucl(npsp) : Silicon then Germanium

   ntypat    1            # Only one type of pseudo-atom
 ntypalch    1            # This pseudo-atom is alchemical
  mixalch    0.5   0.5
    typat    1 1

#Ground state
 nqpt 0

#Common data
 acell   3*10.00
 amu 1.0d0
 densty  1.1    ! This is needed to have exactly the same initialisation as previous tests
 diemac 1.5
 ecut  1.20
 ixc 3
  kptopt 0
 kpt
   0.00000   0.00000  -0.37500
   0.00000   0.00000  -0.12500
   0.00000   0.00000   0.12500
   0.00000   0.00000   0.37500
 natom  2 nband 4
 ngfft  3*16  nkpt  4
 nstep 30
 nsym   1
 occopt 1
 rprim   1.0  0.0  0.0
         0.0  1.0  0.0
         0.0  0.0  1.0
 symrel  1  0  0   0  1  0   0  0  1
 xred    0.0  0.0 -0.15
         0.0  0.0  0.15
 tnons 3*0.0
 toldfe  1.e-12
 wtk 4*0.25

 pp_dirpath "$ABI_PSPDIR"
 pseudos "PseudosGTH_pwteter/14si.pspgth, 32ge_lda.fhi"

#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = abinit
#%% [files]
#%% files_to_test = 
#%%   t96.out, tolnlines = 0, tolabs = 0.000e+00, tolrel = 0.000e+00
#%% [paral_info]
#%% max_nprocs = 4
#%% [extra_info]
#%% authors = Unknown
#%% keywords = 
#%% description = 
#%%   Linear chain of X2 molecules (2 atoms per unit cell),
#%%   using alchemical atoms, GS only. 
#%%   The first psp is Si, the second one is Ge, the
#%%   mixing coefficients are 0.5 and 0.5 . The 
#%%   pseudopotentials differ from the ones of test #93 .
#%% topics = AtomTypes
#%%<END TEST_INFO>