evolve_psi.cpp File Reference

#include "evolve_psi.h"
#include "band_energy.h"
#include "middle_hamilt.h"
#include "norm_psi.h"
#include "propagator.h"
#include "solve_propagation.h"
#include "source_base/module_container/ATen/kernels/blas.h"
#include "source_base/module_container/ATen/kernels/lapack.h"
#include "source_esolver/esolver_ks_lcao_tddft.h"
#include "source_io/module_parameter/parameter.h"
#include "source_lcao/hamilt_lcao.h"
#include "source_pw/module_pwdft/global.h"
#include "upsi.h"
#include <complex>

Include dependency graph for evolve_psi.cpp:

Namespaces
namespace	module_rt

Functions
void	module_rt::evolve_psi (const int nband, const int nlocal, const Parallel_Orbitals *pv, hamilt::Hamilt< std::complex< double > > *p_hamilt, std::complex< double > *psi_k, std::complex< double > *psi_k_laststep, std::complex< double > *H_laststep, std::complex< double > *S_laststep, double *ekb, int htype, int propagator, std::ofstream &ofs_running, const int print_matrix)
template<typename Device >
void	module_rt::evolve_psi_tensor (const int nband, const int nlocal, const Parallel_Orbitals *pv, hamilt::Hamilt< std::complex< double > > *p_hamilt, ct::Tensor &psi_k, ct::Tensor &psi_k_laststep, ct::Tensor &H_laststep, ct::Tensor &S_laststep, ct::Tensor &ekb, int htype, int propagator, std::ofstream &ofs_running, const int print_matrix, const bool use_lapack)
template void	module_rt::evolve_psi_tensor< base_device::DEVICE_CPU > (const int nband, const int nlocal, const Parallel_Orbitals *pv, hamilt::Hamilt< std::complex< double > > *p_hamilt, ct::Tensor &psi_k, ct::Tensor &psi_k_laststep, ct::Tensor &H_laststep, ct::Tensor &S_laststep, ct::Tensor &ekb, int htype, int propagator, std::ofstream &ofs_running, const int print_matrix, const bool use_lapack)