# Test wavelet run on surface
#
natom 3
ntypat 2
znucl 1 8
typat 1 1 2
xangst .7285 0.620919 1.5
      2.2715 0.620919 1.5
      1.5    0.0      1.5
acell 3.0 3.0 3.0 angstrom

usewvl 1
ixc 11
wvl_hgrid 0.35
wvl_crmult 5
wvl_frmult 8
icoulomb 2
nwfshist 6
wvl_nprccg 7
wvl_bigdft_comp 1 #to follow the BigDFT workflow

nsym 1

tolwfr 1e-4

optstress 0
kptopt 0
nkpt 1
kpt   0 0 0
istwfk 1

prtden 0


## After modifying the following section, one might need to regenerate the pickle database with runtests.py -r
#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = abinit
#%% need_cpp_vars = !HAVE_MPI_IO_DEFAULT
#%% exclude_builders = ubu_intel_17.0_openmpi
#%% [files]
#%% files_to_test = 
#%%   t06.out, tolnlines = 2, tolabs = 1.100e-07, tolrel = 5.000e-04
#%% psp_files = HGH/1h.1.hgh, HGH/8o.6.hgh
#%% [paral_info]
#%% max_nprocs = 1
#%% [extra_info]
#%% authors = D. Caliste
#%% keywords = 
#%% description = Water molecule in a big box
#%% topics = Wavelets
#%%<END TEST_INFO>
