#   Al in Box : fhi pseudopotential

 acell  3*12    ecut 13.5
 diemac 1.0d0
 diemix 1.0d0
 enunit 2
 intxc 1
 ixc 7
 kptopt 0

 kpt   3*0.25   kptnrm 1
 natom  1 nband 4
 nkpt  1
 nline 3  nstep 8
 nsym  8  ntypat 1
 occopt 0 occ 1*2.0d0 3*0.33333333333333d0
 rprim  1 0 0 0 1 0 0 0 1
 symrel
       1  0  0    0  1  0    0  0  1
      -1  0  0    0  1  0    0  0  1
       1  0  0    0 -1  0    0  0  1
      -1  0  0    0 -1  0    0  0  1
       1  0  0    0  1  0    0  0 -1
      -1  0  0    0  1  0    0  0 -1
       1  0  0    0 -1  0    0  0 -1
      -1  0  0    0 -1  0    0  0 -1
 tnons  24*0d0
 tolwfr 1.0d-16
 typat  1
 wtk   1
 xred  0.0 0.0 0.0
 znucl 13


 pp_dirpath "$ABI_PSPDIR"
 pseudos "13al.981214.fhi"

#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = abinit
#%% [files]
#%% files_to_test = t37.out, tolnlines = 0, tolabs = 0.000e+00, tolrel = 0.000e+00
#%% [paral_info]
#%% max_nprocs = 1
#%% [extra_info]
#%% keywords = NC
#%% authors = Unknown
#%% description = 
#%%   Isolated aluminum atom, with fhi pseudopotential. kpt=1/4 1/4 1/4
#%%   Spherically symmetric, without spin-polarisation. ixc=7 (CA Perdew Wang).
#%%   Here, computed with a 12x12x12 box, and ecut=13.5, one gets a
#%%   minimum sp separation of 4.959 eV, and a p-degeneracy lifting of 0.090 eV.
#%%   The sp separation from an atomic code is 5.046 eV. 
#%%   Computed in ABINIT with a 16x16x16 box, and ecut=20, one gets 
#%%   a minimum sp separation of 5.039 eV, and a p-degeneracy lifting of 0.008 eV.
#%%<END TEST_INFO>