############################################################################## #Test for multibinit bound_model = 3 ############################################################################## #print options prt_model = 4 dipdip_prt = 0 # Construction of harmonic lattice part ngqpt = 2 2 2 dipdip = 1 ncell = 2 2 2 # Optimize a coefficient in th effective potential bound_model = 3 bound_rangePower = 6 6 #%% #%% [setup] #%% executable = multibinit #%% system_xml = t100_model.xml #%% md_hist = t98.nc #%% test_chain = t98.in, t99.in, t100.in #%% [files] #%% files_to_test = #%% t100.out, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy; #%% t100_coeffs.xml, tolnlines = 0, tolabs = 0.0, tolrel = 0.0, fld_options = -easy; #%% [paral_info] #%% max_nprocs = 1 #%% [extra_info] #%% authors = M. M. Schmitt #%% keywords = Effective potential, multibinit #%% description = #%% Test the bound_model option 3: Create the equivalent high order terms for #%% diverging low order terms. #%% topics = LatticeModel,DynamicsMultibinit #%%