ao_mo_transf.cxx File Reference

#include <ctf.hpp>
#include <float.h>

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Functions
template<typename dtype >
Tensor< dtype >	ao_mo_transf_naive (Tensor< dtype > &U, Matrix< dtype > &C)
	naive implementation of AO-MO orbital transformation LIMITATIONS: (1) does not exploit output (syrk-like) symmetry in 3rd and 4th products. that may increase flop cost by 1.5X (2) multiple buffers and no auxiliary blocking to minimize memory usage More...
template<typename dtype >
Tensor< dtype >	ao_mo_transf_slice (Tensor< dtype > &U, Matrix< dtype > &C)
	AO-MO orbital transformation applied to a slice. More...
void	test_ao_mo_transf (int n, int m, int k, MPI_Comm cm=MPI_COMM_WORLD, bool flt_test=true, bool ns_test=true)
template<typename dtype >
void	bench_ao_mo_transf (int n, int m, int k)
char *	getCmdOption (char **begin, char **end, const std::string &option)
int	main (int argc, char **argv)