##############################################################################
#Test for multibinit, read the ddb and generate the effective potential into XML file
# Generate coefficients for the anharmonic part and run the fit process
##############################################################################
energy_reference = -173.52217240339399
prt_model = 2

dipdip = 0
dipdip_prt = 1
ncell = 2 2 2

#---------------------------------------------------------------
#Inputs for the fitted coefficients
#---------------------------------------------------------------
fit_coeff = 1
fit_rangePower = 3 3
fit_cutoff = 5.4
fit_ncoeff = 2
fit_SPCoupling = 1
fit_SPC_maxS = 2
fit_anhaStrain = 1 
fit_iatom = 0 
fit_EFS = 1 1 1 
sel_EFS = 1 1 1

#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = multibinit
#%% need_cpp_vars = HAVE_NETCDF
#%% input_ddb = t103_ddb.in
#%% md_hist = t103_HIST
#%% [files]
#%% files_to_test = 
#%%   t103.out, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy;
#%%   t103_sys.xml, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy;
#%%   t103_coeffs.xml, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy;
#%% [paral_info]
#%% max_nprocs = 1
#%% [extra_info]
#%% authors = A. Martin, M.M. Schmitt
#%% keywords = Effective potential, multibinit
#%% description = 
#%%   Read ddb and HIST, fit the anharmonic part on energies and generate effective potential
#%% topics = FitProcess,LatticeModel
#%%<END TEST_INFO>