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Atomic-orbital Based Ab-initio Computation at UStc
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Namespaces | Functions
cal_edm_tddft.cpp File Reference
#include "cal_edm_tddft.h"
#include "source_base/module_container/ATen/core/tensor.h"
#include "source_base/module_container/ATen/kernels/blas.h"
#include "source_base/module_container/ATen/kernels/lapack.h"
#include "source_base/module_container/ATen/kernels/memory.h"
#include "source_base/module_device/memory_op.h"
#include "source_base/module_external/lapack_connector.h"
#include "source_base/module_external/scalapack_connector.h"
#include "source_io/module_parameter/parameter.h"
Include dependency graph for cal_edm_tddft.cpp:

Namespaces

namespace  elecstate
 

Functions

void elecstate::print_local_matrix (std::ostream &os, const std::complex< double > *matrix_data, int local_rows, int local_cols, const std::string &matrix_name="", int rank=-1)
 
void elecstate::cal_edm_tddft (Parallel_Orbitals &pv, LCAO_domain::Setup_DM< std::complex< double > > &dmat, K_Vectors &kv, hamilt::Hamilt< std::complex< double > > *p_hamilt)
 
void elecstate::cal_edm_tddft_tensor (Parallel_Orbitals &pv, LCAO_domain::Setup_DM< std::complex< double > > &dmat, K_Vectors &kv, hamilt::Hamilt< std::complex< double > > *p_hamilt)