quick update lappy

usnistgov · Mar 20, 2024 · a6fa888 · a6fa888
1 parent ccf8a3b
commit a6fa888
Showing 1 changed file with 2 additions and 1 deletion.
diff --git a/src/FitTB_laguerre.jl b/src/FitTB_laguerre.jl
@@ -1490,6 +1490,7 @@ end
         """
 function do_fitting_recursive(list_of_tbcs ; weights_list = missing, dft_list=missing, kpoints = [0 0 0; 0 0 0.5; 0 0.5 0.5; 0.5 0.5 0.5; 0 0 0.25; 0 0.25 0; 0.25 0 0 ; 0.25 0.25 0.25; 0.25 0 0.25], starting_database = missing,  update_all = false, fit_threebody=true, fit_threebody_onsite=true, fit_eam=false, do_plot = false, energy_weight = missing, rs_weight=missing,ks_weight=missing, niters=50, lambda=0.0, leave_one_out=false, prepare_data = missing, RW_PARAM=0.0, NLIM = 100, refit_database = missing, start_small = false, fit_to_dft_eigs=false)
 
+    println("hi")
     if !ismissing(dft_list)
         println("top")
         KPOINTS, KWEIGHTS, nk_max = get_k(dft_list, length(dft_list), list_of_tbcs, NLIM=NLIM)
@@ -1511,7 +1512,7 @@ function do_fitting_recursive(list_of_tbcs ; weights_list = missing, dft_list=mi
             starting_database_t = starting_database
         end
 
-        pd = do_fitting_linear(list_of_tbcs; kpoints = KPOINTS, mode=:kspace, dft_list = dft_list,  fit_threebody=fit_threebody, fit_threebody_onsite=fit_threebody_onsite, fit_eam=fit_eamdo_plot = false, starting_database=starting_database_t, return_database=false, NLIM=NLIM, refit_database=refit_database)
+        pd = do_fitting_linear(list_of_tbcs; kpoints = KPOINTS, mode=:kspace, dft_list = dft_list,  fit_threebody=fit_threebody, fit_threebody_onsite=fit_threebody_onsite, fit_eam=fit_eam, do_plot = false, starting_database=starting_database_t, return_database=false, NLIM=NLIM, refit_database=refit_database)
     else
         println("SKIP LINEAR MISSING")
         pd = prepare_data