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Atomic-orbital Based Ab-initio Computation at UStc
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dm_trans_parallel.cpp File Reference
#include "dm_trans.h"
#include "source_base/module_external/scalapack_connector.h"
#include "source_base/tool_title.h"
#include "source_lcao/module_lr/utils/lr_util.h"
Include dependency graph for dm_trans_parallel.cpp:

Namespaces

namespace  LR
 

Functions

template<>
std::vector< container::TensorLR::cal_dm_trans_pblas (const double *const X_istate, const Parallel_2D &px, const psi::Psi< double > &c, const Parallel_2D &pc, const int naos, const int nocc, const int nvirt, const Parallel_2D &pmat, const double factor, const MO_TYPE type)
 
template<>
std::vector< container::TensorLR::cal_dm_trans_pblas (const std::complex< double > *const X_istate, const Parallel_2D &px, const psi::Psi< std::complex< double > > &c, const Parallel_2D &pc, const int naos, const int nocc, const int nvirt, const Parallel_2D &pmat, const std::complex< double > factor, const MO_TYPE type)