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Atomic-orbital Based Ab-initio Computation at UStc
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diag_hs_para.h
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3
4#ifdef __MPI
5#include <mpi.h>
6#endif
7
8namespace hsolver
9{
10
11
12#ifdef __MPI
13
33template <typename T>
34void diago_hs_para(T* h,
35 T* s,
36 const int lda,
37 const int nband,
38 typename GetTypeReal<T>::type* const ekb,
39 T* const wfc,
40 const MPI_Comm& comm,
41 const int diag_subspace,
42 const int block_size = 0);
43#endif
44
45} // namespace hsolver
46
#define T
Definition exp.cpp:237
Definition diag_comm_info.h:9
void diago_hs_para(T *h, T *s, const int lda, const int nband, typename GetTypeReal< T >::type *const ekb, T *const wfc, const MPI_Comm &comm, const int diag_subspace, const int block_size)
Parallel do the generalized eigenvalue problem.
Definition diag_hs_para.cpp:74
T type
Definition macros.h:8