Fix circular dependencies of header files.

Author: mohanchen

source/source_lcao/hamilt_lcao.cpp

@@ -416,13 +416,13 @@ HamiltLCAO<TK, TR>::HamiltLCAO(Gint_Gamma* GG_in,
 
 		if(GlobalC::exx_info.info_ri.real_number)
 		{
-            exx_two_level_step = exx_nao.exd->two_level_step;
-			Hexxd = exx_nao.exd->get_Hexxs();
+            exx_two_level_step = &exx_nao.exd->two_level_step;
+			Hexxd = &exx_nao.exd->get_Hexxs();
 		}
 		else
 		{
-            exx_two_level_step = exx_nao.exc->two_level_step;
-			Hexxc = exx_nao.exc->get_Hexxs();
+            exx_two_level_step = &exx_nao.exc->two_level_step;
+			Hexxc = &exx_nao.exc->get_Hexxs();
 		}
 
         // Peize Lin add 2016-12-03

source/source_lcao/hamilt_lcao.h

@@ -21,6 +21,7 @@
 #endif
 
 #include "source_lcao/setup_exx.h" // for exx, mohan add 20251022
+
 namespace hamilt
 {
 

source/source_lcao/module_ri/Exx_LRI_interface.hpp

@@ -4,7 +4,6 @@
 
 #include "Exx_LRI_interface.h"
 #include "source_lcao/module_ri/exx_abfs-jle.h"
-#include "source_lcao/hamilt_lcao.h"
 #include "source_lcao/module_operator_lcao/op_exx_lcao.h"
 #include "source_base/parallel_common.h"
 #include "source_base/formatter.h"
@@ -17,33 +16,6 @@
 #include <stdexcept>
 #include <string>
 
-/*
-template<typename T, typename Tdata>
-void Exx_LRI_Interface<T, Tdata>::write_Hexxs_cereal(const std::string& file_name) const
-{
-    ModuleBase::TITLE("Exx_LRI_Interface", "write_Hexxs_cereal");
-    ModuleBase::timer::tick("Exx_LRI_Interface", "write_Hexxs_cereal");
-    std::ofstream ofs(file_name + "_" + std::to_string(GlobalV::MY_RANK), std::ofstream::binary);
-    cereal::BinaryOutputArchive oar(ofs);
-    oar(this->exx_ptr->Hexxs);
-    ModuleBase::timer::tick("Exx_LRI_Interface", "write_Hexxs_cereal");
-}
-
-template<typename T, typename Tdata>
-void Exx_LRI_Interface<T, Tdata>::read_Hexxs_cereal(const std::string& file_name)
-{
-    ModuleBase::TITLE("Exx_LRI_Interface", "read_Hexxs_cereal");
-    ModuleBase::timer::tick("Exx_LRI_Interface", "read_Hexxs_cereal");
-    const std::string file_name_rank = file_name + "_" + std::to_string(GlobalV::MY_RANK);
-    std::ifstream ifs(file_name_rank, std::ofstream::binary);
-    if(!ifs.is_open())
-        { ModuleBase::WARNING_QUIT("Exx_LRI_Interface", file_name_rank+" not found."); }
-    cereal::BinaryInputArchive iar(ifs);
-    iar(this->exx_ptr->Hexxs);
-    ModuleBase::timer::tick("Exx_LRI_Interface", "read_Hexxs_cereal");
-}
-*/
-
 template<typename T, typename Tdata>
 void Exx_LRI_Interface<T, Tdata>::init(const MPI_Comm &mpi_comm,
                                        const UnitCell &ucell,