#
# Lead crystal
#

#Definition of the unit cell
acell 10.0 10.0 10.0
rprim
    0.0  0.5  0.5
    0.5  0.0  0.5
    0.5  0.5  0.0

#Definition of the atom types and pseudopotentials
ntypat 1
znucl  82
pp_dirpath "$ABI_PSPDIR"
pseudos "Pseudodojo_nc_sr_04_pw_standard_psp8/Pb.psp8"

#Definition of the atoms and atoms positions
natom  1
typat  1 
xred
  0.000   0.000   0.000

#Numerical parameters of the calculation : planewave basis set and k point grid
ecut  24.0
ngkpt 12 12 12
nshiftk 4
shiftk
   0.5 0.5 0.5
   0.5 0.0 0.0
   0.0 0.5 0.0
   0.0 0.0 0.5
occopt 7
tsmear 0.01
nband  7

#Parameters for the SCF procedure
nstep   10
tolvrs  1.0d-10

##############################################################
# This section is used only for regression testing of ABINIT #
##############################################################
#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = abinit
#%% [files]
#%% files_to_test = tbasepar_1.abo, tolnlines=0, tolabs=0.0, tolrel=0.0
#%% [paral_info]
#%% max_nprocs = 4
#%% [extra_info]
#%% authors = Unknown
#%% keywords = NC
#%% description = Lead crystal. Parallelism over k-points
#%%<END TEST_INFO>
