esolver_lrtd_lcao.cpp File Reference

#include "esolver_lrtd_lcao.h"
#include "utils/gint_move.hpp"
#include "utils/lr_util.h"
#include "hamilt_casida.h"
#include "hamilt_ulr.hpp"
#include "source_lcao/module_lr/potentials/pot_hxc_lrtd.h"
#include "source_lcao/module_lr/hsolver_lrtd.hpp"
#include "source_lcao/module_lr/lr_spectrum.h"
#include <memory>
#include "source_lcao/hamilt_lcao.h"
#include "source_io/read_wfc_nao.h"
#include "source_io/cube_io.h"
#include "source_io/print_info.h"
#include "source_cell/module_neighbor/sltk_atom_arrange.h"
#include "source_lcao/module_lr/utils/lr_util_print.h"
#include "source_base/module_external/scalapack_connector.h"
#include "source_io/module_parameter/parameter.h"
#include "source_lcao/module_lr/ri_benchmark/ri_benchmark.h"
#include "source_lcao/module_lr/operator_casida/operator_lr_diag.h"

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Functions
int	cal_nupdown_form_occ (const ModuleBase::matrix &wg)
void	setup_2center_table (TwoCenterBundle &two_center_bundle, LCAO_Orbitals &orb, UnitCell &ucell)

Function Documentation

cal_nupdown_form_occ()

int cal_nupdown_form_occ ( const ModuleBase::matrix &  wg )

inline

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setup_2center_table()

void setup_2center_table ( TwoCenterBundle &  two_center_bundle, LCAO_Orbitals &  orb, UnitCell &  ucell  )

inline

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