MADNESS  0.10.1
distpm.h
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1 #ifndef MADNESS_DISTPM_H
2 #define MADNESS_DISTPM_H
3 
8 
9 
10 namespace madness {
11 
13  const std::vector<Function<double, 3>>& mo,
14  const std::vector<Function<double, 3>>& ao,
15  const std::vector<int>& set,
16  const std::vector<int>& at_to_bf,
17  const std::vector<int>& at_nbf,
18  const double thresh = 1e-9,
19  const double thetamax = 0.5,
20  const bool randomize = true,
21  const bool doprint = false);
22 }
23 
24 #endif // MADNESS_DISTPM_H
Manages data associated with a row/column/block distributed array.
Definition: distributed_matrix.h:388
A parallel world class.
Definition: world.h:132
File holds all helper structures necessary for the CC_Operator and CC2 class.
Definition: DFParameters.h:10
DistributedMatrix< double > distributed_localize_PM(World &world, const vecfuncT &mo, const vecfuncT &ao, const std::vector< int > &set, const std::vector< int > &at_to_bf, const std::vector< int > &at_nbf, const double thresh, const double thetamax, const bool randomize, const bool doprint)
Definition: distpm.cc:296
static std::vector< int > at_to_bf
Definition: preal.cc:19
static std::vector< int > at_nbf
Definition: preal.cc:19
static const double thresh
Definition: rk.cc:45
void e()
Definition: test_sig.cc:75