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Atomic-orbital Based Ab-initio Computation at UStc
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Namespaces | Functions
norm_psi.cpp File Reference
#include "norm_psi.h"
#include "source_base/module_container/ATen/kernels/blas.h"
#include "source_base/module_external/blas_connector.h"
#include "source_base/module_external/scalapack_connector.h"
#include "source_base/global_function.h"
#include <complex>
#include <iostream>
#include <cassert>
Include dependency graph for norm_psi.cpp:

Namespaces

namespace  module_rt
 

Functions

int module_rt::globalIndex (int localindex, int nblk, int nprocs, int myproc)
 
void module_rt::norm_psi (const Parallel_Orbitals *pv, const int nband, const int nlocal, const std::complex< double > *Stmp, std::complex< double > *psi_k, std::ofstream &ofs_running, const int print_matrix)
 normalize the wave function
 
void module_rt::norm_psi_tensor (const Parallel_Orbitals *pv, const int nband, const int nlocal, const ct::Tensor &Stmp, ct::Tensor &psi_k, std::ofstream &ofs_running, const int print_matrix)
 
template<typename Device >
void module_rt::norm_psi_tensor_lapack (const Parallel_Orbitals *pv, const int nband, const int nlocal, const ct::Tensor &Stmp, ct::Tensor &psi_k, std::ofstream &ofs_running, const int print_matrix)
 
template void module_rt::norm_psi_tensor_lapack< base_device::DEVICE_CPU > (const Parallel_Orbitals *pv, const int nband, const int nlocal, const ct::Tensor &Stmp, ct::Tensor &psi_k, std::ofstream &ofs_running, const int print_matrix)