ID | Module | Source Location | Source Function | Level | Max Time Over Threads (s) | Time w.r.t. Wall Time (s) | Coverage (% app. time) | Speedup if no scalar integer | Speedup if FP arith vectorized | Speedup if fully vectorized | Speedup if FP only | Number of paths | Vectorization Ratio (%) | Vector Length Use (%) | Flops (GFLOP/s) | CQA cycles | CQA cycles if no scalar integer | CQA cycles if FP arith vectorized | CQA cycles if fully vectorized | CQA cycles if FP only |
○Loop 849 | exec | MultiBsplineRef.hpp:68-70 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | Innermost | 23.65 | 22.66 | 28.09 | 1.00 | 1.50 | 4.00 | 1.00 | 1 | 100.00 | 25.00 | 268.94 | 2.50 | 2.50 | 1.67 | 0.63 | 2.50 |
○Loop 2082 | exec | ParticleBConds3DSoa.h:280-298,SoaDistanceTableABOMPTarget.h:228-228 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Innermost | 7.84 | 7.46 | 9.25 | 1.00 | 3.33 | 6.67 | 1.00 | 1 | 12.77 | 14.10 | 389.68 | 15.00 | 15.00 | 4.50 | 2.25 | 15.00 |
○Loop 861 | exec | TinyVector.h:61-61,MultiBsplineRef.hpp:242-262 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Innermost | 9.03 | 7.18 | 8.9 | 1.00 | 2.00 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 748.83 | 11.50 | 11.50 | 5.75 | 5.75 | 11.50 |
○Loop 860 | exec | MultiBsplineRef.hpp:242-242,MultiBsplineRef.hpp:253-261 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Innermost | 7.7 | 4.81 | 5.96 | 1.00 | 1.06 | 2.00 | 1.41 | 1 | 100.00 | 50.00 | 580.11 | 6.33 | 6.33 | 6.00 | 3.17 | 4.50 |
○Loop 1852 | exec | VectorSoAContainer.h:244-244,VectorSoAContainer.h:263-263,TinyVector.h:182-182,OhmmsVector.h:223-223,SoaDistanceTableAAOMPTarget.h:440-442 | qmcplusplus::SoaDistanceTableAAOMPTarget::update(int) | Single | 4.55 | 4.25 | 5.27 | 1.46 | 1.00 | 8.00 | 5.83 | 1 | 54.55 | 15.91 | 0.00 | 5.83 | 4.00 | 5.83 | 0.73 | 1.00 |
○Loop 1363 | exec | ParticleBConds3DSoa.h:235-256 | void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer > >(qmcplusplus::TinyVector const&, qmcplusplus::VectorSoAContainer > const&, double*, qmcplusplus::VectorSoAContainer >&, int, int, int) const | Single | 1.75 | 1.43 | 1.77 | 1.00 | 1.67 | 1.67 | 1.00 | 1 | 97.00 | 48.88 | 1504.50 | 60.00 | 60.00 | 36.00 | 36.00 | 60.00 |
○Loop 388 | exec | TwoBodyJastrowRef.h:107-107,BsplineFunctor.h:236-241 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 1.26 | 1.08 | 1.34 | 1.75 | 1.00 | 3.81 | 17.50 | 2 | 80.74 | 40.21 | 0.78 | 17.50 | 10.00 | 17.50 | 4.59 | 1.00 |
○Loop 859 | exec | TinyVector.h:61-61,MultiBsplineRef.hpp:242-242 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | InBetween | 2.74 | 1 | 1.24 | 5.34 | 1.00 | 8.08 | 11.28 | 9 | 27.27 | 20.74 | 344.65 | 33.83 | 6.33 | 33.83 | 4.19 | 3.00 |
○Loop 2352 | exec | | __intel_avx_rep_memset | Single | 0.9 | 0.76 | 0.94 | 1.00 | 1.00 | 2.00 | 4.00 | 1 | 100.00 | 50.00 | 0.39 | 4.00 | 4.00 | 4.00 | 2.00 | 1.00 |
○Loop 851 | exec | einspline_spo_ref.hpp:223-227,VectorSoAContainer.h:231-231,VectorSoAContainer.h:271-271,TinyVector.h:145-145,OhmmsVector.h:223-223,stl_algobase.h:200-200,stl_vector.h:933-933 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Innermost | 0.81 | 0.63 | 0.79 | 2.18 | 1.00 | 12.26 | 4.02 | 1 | 20.00 | 13.13 | 0.00 | 6.17 | 2.83 | 6.17 | 0.50 | 1.53 |
○Loop 332 | exec | BsplineFunctor.h:291-297 | qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.55 | 0.39 | 0.49 | 1.65 | 1.00 | 3.42 | 19.00 | 2 | 83.48 | 42.77 | 0.37 | 19.00 | 11.50 | 19.00 | 5.56 | 1.00 |
○Loop 973 | exec | inner_product.hpp:155-155,OperatorTags.h:63-63,DiracDeterminantRef.cpp:157-157 | miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.42 | 0.36 | 0.45 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 176.51 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 960 | exec | inner_product.hpp:155-155,TinyVector.h:61-61,OperatorTags.h:63-63 | miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.47 | 0.35 | 0.44 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 181.82 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 853 | exec | MultiBsplineRef.hpp:276-286 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Innermost | 0.41 | 0.3 | 0.37 | 1.00 | 1.07 | 2.00 | 1.07 | 1 | 100.00 | 50.00 | 379.02 | 4.83 | 4.83 | 4.50 | 2.42 | 4.50 |
○Loop 864 | exec | inner_product.hpp:82-83 | qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&) | Innermost | 0.35 | 0.28 | 0.35 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 303.17 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 961 | exec | inner_product.hpp:155-155,OperatorTags.h:63-63,DiracDeterminantRef.cpp:109-109 | miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.34 | 0.23 | 0.28 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 275.11 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 363 | exec | TwoBodyJastrowRef.h:324-331 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.26 | 0.19 | 0.24 | 1.00 | 1.31 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 499.50 | 3.50 | 3.50 | 2.67 | 1.75 | 3.50 |
○Loop 361 | exec | TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.25 | 0.17 | 0.21 | 1.00 | 1.33 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 369.99 | 4.00 | 4.00 | 3.00 | 2.00 | 4.00 |
○Loop 975 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.24 | 0.17 | 0.21 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 123.68 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 357 | exec | TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.25 | 0.16 | 0.2 | 1.00 | 1.33 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 399.28 | 4.00 | 4.00 | 3.00 | 2.00 | 4.00 |
○Loop 359 | exec | TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.24 | 0.16 | 0.2 | 1.00 | 1.33 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 393.38 | 4.00 | 4.00 | 3.00 | 2.00 | 4.00 |
○Loop 352 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.16 | 0.12 | 0.15 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 350.96 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 350 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.18 | 0.12 | 0.14 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 350.16 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 351 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.2 | 0.11 | 0.14 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 382.63 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 386 | exec | BsplineFunctor.h:246-260 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.13 | 0.08 | 0.1 | 1.00 | 1.52 | 2.13 | 1.00 | 1 | 100.00 | 46.88 | 734.67 | 16.00 | 16.00 | 10.50 | 7.50 | 16.00 |
○Loop 958 | exec | inner_product.hpp:155-155,OperatorTags.h:63-63,DiracDeterminantRef.cpp:238-238 | miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&) | Innermost | 0.09 | 0.07 | 0.08 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 182.01 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 964 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.09 | 0.06 | 0.08 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 356.14 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 941 | exec | inner_product.hpp:211-212 | qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&) | Innermost | 0.06 | 0.06 | 0.07 | 1.11 | 1.00 | 2.40 | 3.50 | 1 | 85.71 | 41.07 | 0.00 | 3.50 | 3.17 | 3.50 | 1.46 | 1.00 |
○Loop 354 | exec | stl_numeric.h:126-127,stl_iterator.h:887-887 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.09 | 0.05 | 0.07 | 1.00 | 1.78 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 426.17 | 3.00 | 3.00 | 1.69 | 1.50 | 3.00 |
○Loop 330 | exec | BsplineFunctor.h:303-338 | qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.11 | 0.05 | 0.06 | 1.13 | 1.57 | 2.10 | 1.57 | 1 | 100.00 | 48.31 | 1147.11 | 31.50 | 28.00 | 20.00 | 15.00 | 20.00 |
○Loop 76 | exec | OhmmsVector.h:229-229,stl_vector.h:806-806,stl_vector.h:933-933,NonLocalPP.hpp:126-126,NonLocalPP.hpp:129-135,unique_ptr.h:150-150 | qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | InBetween | 0.08 | 0.05 | 0.06 | 2.48 | 1.00 | 12.15 | 3.42 | 3 | 0.00 | 11.70 | 0.81 | 4.56 | 1.83 | 4.56 | 0.38 | 1.33 |
○Loop 370 | exec | TwoBodyJastrowRef.h:393-398 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.08 | 0.04 | 0.05 | 1.00 | 1.00 | 8.00 | 1.56 | 1 | 0.00 | 12.50 | 318.48 | 4.67 | 4.67 | 4.67 | 0.58 | 3.00 |
○Loop 852 | exec | einspline_spo_ref.hpp:206-207,MultiBsplineData.hpp:68-79,VectorSoAContainer.h:265-265,MultiBsplineEvalHelper.hpp:45-47,TinyVector.h:61-61,stl_algobase.h:695-696,stl_vector.h:933-933,stl_vector.h:1056-1056,MultiBsplineRef.hpp:187-192,MultiBsplineRef.hpp:198-202,MultiBsplineRef.hpp:229-229,MultiBsplineRef.hpp:244-251,MultiBsplineRef.hpp:255-258,MultiBsplineRef.hpp:269-286 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Outermost | 0.06 | 0.03 | 0.03 | 1.61 | 1.80 | 6.63 | 2.22 | 192 | 40.19 | 23.36 | 18.93 | 91.00 | 56.50 | 50.63 | 13.72 | 41.00 |
○Loop 855 | exec | TinyVector.h:61-61,MultiBsplineRef.hpp:227-227,MultiBsplineRef.hpp:234-239,MultiBsplineRef.hpp:242-262 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | InBetween | 0.05 | 0.03 | 0.03 | 1.54 | 1.70 | 4.54 | 3.07 | 16 | 60.98 | 35.03 | 35.25 | 49.17 | 32.00 | 29.00 | 10.83 | 16.00 |
○Loop 308 | exec | OneBodyJastrowRef.h:134-134,BsplineFunctor.h:236-241 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.05 | 0.03 | 0.03 | 1.75 | 1.00 | 3.81 | 17.50 | 2 | 78.33 | 38.99 | 2.80 | 17.50 | 10.00 | 17.50 | 4.59 | 1.00 |
○Loop 374 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.05 | 0.02 | 0.03 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 207.46 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 378 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.05 | 0.02 | 0.03 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 205.88 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 376 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.05 | 0.02 | 0.03 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 212.78 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 956 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&) | Innermost | 0.04 | 0.02 | 0.02 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 211.23 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 385 | exec | ParticleSet.h:313-313,ParticleSet.h:316-316,TwoBodyJastrowRef.h:107-107,TwoBodyJastrowRef.h:127-129,TwoBodyJastrowRef.h:132-132,OhmmsVector.h:223-223,BsplineFunctor.h:229-229,BsplineFunctor.h:236-236,BsplineFunctor.h:240-241,BsplineFunctor.h:246-251,BsplineFunctor.h:256-260,stl_vector.h:951-951 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | InBetween | 0.05 | 0.02 | 0.02 | 1.00 | 1.02 | 4.71 | 3.33 | 67 | 52.83 | 26.26 | 349.69 | 40.00 | 40.00 | 39.13 | 8.50 | 12.00 |
○Loop 268 | exec | OneBodyJastrowRef.h:186-187 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.04 | 0.02 | 0.02 | 1.00 | 1.67 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 256.51 | 7.00 | 7.00 | 4.20 | 3.50 | 7.00 |
○Loop 380 | exec | TwoBodyJastrowRef.h:375-376 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.04 | 0.02 | 0.02 | 1.00 | 1.67 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 319.31 | 7.00 | 7.00 | 4.20 | 3.50 | 7.00 |
○Loop 983 | exec | stl_algobase.h:740-742 | miniqmcreference::DiracDeterminantRef >::resize(int, int) | Single | 0.04 | 0.02 | 0.02 | 1.00 | 1.00 | 2.00 | 3.00 | 1 | 100.00 | 50.00 | 0.00 | 3.00 | 3.00 | 3.00 | 1.50 | 1.00 |
○Loop 313 | exec | stl_algobase.h:752-754 | qmcplusplus::Vector >::resize(unsigned long, double) | Single | 0.04 | 0.02 | 0.02 | 1.00 | 1.00 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 0.00 | 1.00 | 1.00 | 1.00 | 0.50 | 1.00 |
○Loop 846 | exec | einspline_spo_ref.hpp:175-176,MultiBsplineData.hpp:54-57,MultiBsplineEvalHelper.hpp:45-47,stl_algobase.h:695-696,stl_vector.h:1056-1056,MultiBsplineRef.hpp:42-44,MultiBsplineRef.hpp:47-49,MultiBsplineRef.hpp:56-58,MultiBsplineRef.hpp:67-67,MultiBsplineRef.hpp:70-71 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | Outermost | 0.03 | 0.01 | 0.02 | 1.21 | 2.40 | 8.73 | 1.36 | 10 | 14.29 | 14.22 | 31.85 | 27.83 | 23.00 | 11.60 | 3.19 | 20.50 |
○Loop 372 | exec | TwoBodyJastrowRef.h:388-391 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.03 | 0.01 | 0.01 | 1.00 | 1.20 | 2.00 | 1.33 | 1 | 100.00 | 50.00 | 839.18 | 2.00 | 2.00 | 1.67 | 1.00 | 1.50 |
○Loop 36 | exec | refwrap.h:313-313,TinyVector.h:62-62,miniqmc.cpp:429-458 | main.extracted.110 | Innermost | 0.03 | 0.01 | 0.01 | 5.35 | 1.00 | 11.40 | 10.25 | 2 | 9.90 | 12.29 | 0.00 | 10.25 | 1.92 | 10.25 | 0.90 | 1.00 |
○Loop 329 | exec | shared_ptr_base.h:1308-1308,OneBodyJastrowRef.h:214-219,ParticleSet.h:313-316,OhmmsVector.h:223-223,stl_vector.h:933-933,stl_vector.h:1056-1056 | miniqmcreference::OneBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet&, int, double const*) | Single | 0.03 | 0.01 | 0.01 | 1.00 | 1.00 | 12.04 | 3.00 | 2 | 0.00 | 11.61 | 1.60 | 3.00 | 3.00 | 3.00 | 0.25 | 1.00 |
○Loop 854 | exec | MultiBsplineRef.hpp:226-226,MultiBsplineRef.hpp:234-236,MultiBsplineRef.hpp:244-244,MultiBsplineRef.hpp:250-250 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | InBetween | 0.04 | 0.01 | 0.01 | 4.38 | 1.00 | 8.00 | 8.14 | 16 | 0.00 | 12.35 | 4.95 | 9.50 | 2.17 | 9.50 | 1.19 | 1.17 |
○Loop 264 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.04 | 0.01 | 0.01 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 331.61 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 263 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.03 | 0.01 | 0.01 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 343.41 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 384 | exec | refwrap.h:313-313,shared_ptr_base.h:1308-1308,optional:897-897,optional:1213-1213,TwoBodyJastrowRef.h:107-108,TwoBodyJastrowRef.h:126-127,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OhmmsVector.h:249-249,stl_vector.h:806-806,stl_vector.h:933-933,stl_vector.h:951-951,stl_vector.h:1056-1056 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Outermost | 0.03 | 0.01 | 0.01 | 2.27 | 2.18 | 14.08 | 4.92 | 68 | 24.00 | 15.81 | 18.55 | 9.83 | 4.33 | 4.51 | 0.70 | 2.00 |
○Loop 77 | exec | VectorSoAContainer.h:231-231,TinyVector.h:145-145,OhmmsVector.h:229-229,OperatorTags.h:43-43,OperatorTags.h:63-63,stl_vector.h:806-806,stl_vector.h:933-933,NonLocalPP.hpp:131-132 | qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | Innermost | 0.03 | 0.01 | 0.01 | 1.00 | 1.69 | 7.06 | 2.14 | 1 | 30.00 | 16.25 | 2.40 | 5.00 | 5.00 | 2.96 | 0.71 | 2.33 |
○Loop 265 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.02 | 0.01 | 0.01 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 335.46 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 1217 | exec | stl_vector.h:806-806,ParticleSet.cpp:242-243,unique_ptr.h:150-150 | qmcplusplus::ParticleSet::update(bool) | Single | 0.02 | 0.01 | 0.01 | 1.00 | 1.00 | 8.00 | 2.00 | 1 | 0.00 | 12.50 | 0.00 | 2.00 | 2.00 | 2.00 | 0.25 | 1.00 |
○Loop 305 | exec | shared_ptr_base.h:1308-1308,OneBodyJastrowRef.h:134-134,OneBodyJastrowRef.h:143-146,ParticleSet.h:313-313,OhmmsVector.h:223-223,BsplineFunctor.h:229-229,BsplineFunctor.h:236-236,BsplineFunctor.h:240-240,BsplineFunctor.h:246-251,BsplineFunctor.h:256-260,stl_vector.h:951-951,stl_vector.h:1056-1056 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | InBetween | 0.02 | 0.01 | 0.01 | 1.00 | 1.02 | 4.71 | 3.33 | 68 | 48.08 | 25.28 | 32.65 | 40.00 | 40.00 | 39.13 | 8.50 | 12.00 |
○Loop 108 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,WaveFunction.cpp:263-263,WaveFunction.cpp:269-269,WaveFunction.cpp:272-273,stl_vector.h:806-806,stl_vector.h:933-933 | qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Outermost | 0.02 | 0.01 | 0.01 | 1.00 | 1.00 | 13.80 | 2.67 | 8 | 16.67 | 13.54 | 0.10 | 8.00 | 8.00 | 8.00 | 0.58 | 3.00 |
○Loop 847 | exec | MultiBsplineRef.hpp:63-63,MultiBsplineRef.hpp:66-66,MultiBsplineRef.hpp:70-70 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | InBetween | 0.02 | 0 | 0.01 | 3.25 | 1.00 | 10.15 | 3.71 | 5 | 0.00 | 12.15 | NA | 4.33 | 1.33 | 4.33 | 0.43 | 1.17 |
○Loop 102 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,WaveFunction.cpp:198-201,stl_vector.h:806-806,stl_vector.h:933-933 | qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.02 | 0 | 0.01 | 1.86 | 2.67 | 12.69 | 2.60 | 1 | 0.00 | 11.72 | NA | 4.33 | 2.33 | 1.63 | 0.34 | 1.67 |
○Loop 382 | exec | stl_numeric.h:126-127,stl_iterator.h:887-887 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.02 | 0 | 0.01 | 1.00 | 1.78 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | NA | 3.00 | 3.00 | 1.69 | 1.50 | 3.00 |
○Loop 862 | exec | inner_product.hpp:82-83,SPOSet.h:83-86,OhmmsVector.h:178-178,OhmmsVector.h:248-249,stl_vector.h:933-933 | qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&) | Outermost | 0.02 | 0 | 0.01 | 2.49 | 1.74 | 10.19 | 3.78 | 4 | 35.26 | 16.42 | NA | 4.25 | 1.71 | 2.44 | 0.42 | 1.13 |
○Loop 297 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.01 | 0 | 0.01 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | NA | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 303 | exec | OneBodyJastrowRef.h:134-135,OneBodyJastrowRef.h:141-141,OneBodyJastrowRef.h:146-146,OneBodyJastrowRef.h:151-153,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OhmmsVector.h:249-249,stl_vector.h:806-806,stl_vector.h:933-933,stl_vector.h:951-951,stl_vector.h:1056-1056 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Outermost | 0.02 | 0 | 0.01 | 3.17 | 2.47 | 11.62 | 6.33 | 72 | 22.73 | 14.49 | NA | 9.50 | 3.00 | 3.85 | 0.82 | 1.50 |
○Loop 355 | exec | shared_ptr_base.h:1308-1308,ParticleSet.h:313-316,TwoBodyJastrowRef.h:269-274,OhmmsVector.h:223-223 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 295 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 848 | exec | MultiBsplineRef.hpp:64-71 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | InBetween | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 101 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,OperatorTags.h:94-94,WaveFunction.cpp:185-188,stl_vector.h:806-806,stl_vector.h:933-933 | qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 845 | exec | einspline_spo_ref.hpp:183-187,stl_algobase.h:200-200,stl_algobase.h:366-368,stl_vector.h:933-933,stl_vector.h:1056-1056,stl_algo.h:782-782 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | Single | 0.04 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 296 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1047 | exec | stl_algobase.h:752-754 | qmcplusplus::Vector > >::resize(unsigned long, double) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 75 | exec | VectorSoAContainer.h:231-231,ParticleSet.h:277-277,TinyVector.h:170-170,OhmmsVector.h:229-229,stl_vector.h:951-951,NonLocalPP.hpp:122-122,NonLocalPP.hpp:126-126 | qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | Outermost | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 258 | exec | stl_numeric.h:126-127,stl_iterator.h:887-887 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 2084 | exec | SoaDistanceTableABOMPTarget.h:215-217,SoaDistanceTableABOMPTarget.h:222-222,SoaDistanceTableABOMPTarget.h:228-228 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | InBetween | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 104 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,WaveFunction.cpp:225-228,stl_vector.h:806-806,stl_vector.h:933-933 | qmcplusplus::WaveFunction::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1224 | exec | stl_vector.h:806-806,ParticleSet.cpp:343-344,unique_ptr.h:150-150 | qmcplusplus::ParticleSet::computeNewPosDistTables(int, qmcplusplus::TinyVector const&, bool) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 257 | exec | stl_numeric.h:127-127,stl_iterator.h:887-887 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 2085 | exec | SoaDistanceTableABOMPTarget.h:194-196 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 300 | exec | OneBodyJastrowRef.h:186-187 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 2083 | exec | ParticleBConds3DSoa.h:284-286,ParticleBConds3DSoa.h:289-289,ParticleBConds3DSoa.h:294-296,SoaDistanceTableABOMPTarget.h:214-214,SoaDistanceTableABOMPTarget.h:222-222 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Outermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 971 | exec | inner_product.hpp:82-83,inner_product.hpp:155-155,TinyVector.h:62-62,TinyVector.h:169-169,OperatorTags.h:94-94,DiracDeterminantRef.cpp:157-157,DiracDeterminantRef.cpp:173-173,DiracDeterminantRef.cpp:178-178,TinyVectorOps.h:131-131 | miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Outermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 365 | exec | shared_ptr_base.h:1308-1308,ParticleSet.h:313-316,TwoBodyJastrowRef.h:269-274,OhmmsVector.h:223-223 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1230 | exec | stl_vector.h:806-806,ParticleSet.cpp:389-390,unique_ptr.h:150-150 | qmcplusplus::ParticleSet::acceptMove(int) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 369 | exec | VectorSoAContainer.h:244-244,VectorSoAContainer.h:263-263,VectorSoAContainer.h:273-273,DistanceTable.h:268-268,TwoBodyJastrowRef.h:268-269,TwoBodyJastrowRef.h:364-364,TwoBodyJastrowRef.h:367-367,TwoBodyJastrowRef.h:375-376,TwoBodyJastrowRef.h:381-383,TwoBodyJastrowRef.h:386-393,TwoBodyJastrowRef.h:397-398,TwoBodyJastrowRef.h:420-420,stl_numeric.h:126-127,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OhmmsVector.h:249-249,stl_algobase.h:752-754,stl_iterator.h:784-784,stl_iterator.h:887-887,stl_vector.h:951-951,stl_vector.h:1056-1056 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | InBetween | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1553 | exec | NewTimer.h:119-124,stl_tree.h:787-787,stl_tree.h:795-795,stl_tree.h:1210-1210,stl_tree.h:1894-1895 | std::map, double, std::less >, std::allocator const, double> > >::operator[](qmcplusplus::StackKeyParam<2> const&) | Single | 0.06 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 353 | exec | stl_numeric.h:127-127,stl_iterator.h:887-887 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 968 | exec | DelayedUpdate.h:137-138 | miniqmcreference::DiracDeterminantRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 110 | exec | WaveFunction.cpp:273-274 | qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 850 | exec | einspline_spo_ref.hpp:219-219,einspline_spo_ref.hpp:222-223,VectorSoAContainer.h:231-231,stl_vector.h:933-933 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Outermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 302 | exec | stl_numeric.h:126-127,stl_iterator.h:887-887 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 866 | exec | OhmmsMatrix.h:217-217,SPOSet.h:106-111,OhmmsVector.h:56-56,OhmmsVector.h:144-144,OhmmsVector.h:210-212,OhmmsVector.h:287-287,new_allocator.h:125-125 | qmcplusplus::SPOSet::evaluate_notranspose(qmcplusplus::ParticleSet const&, int, int, qmcplusplus::Matrix >&, qmcplusplus::Matrix, std::allocator > >&, qmcplusplus::Matrix >&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1551 | exec | NewTimer.cpp:99-100 | qmcplusplus::TimerType::stop() | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 306 | exec | BsplineFunctor.h:246-260 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1847 | exec | OhmmsVector.h:223-223,OhmmsVector.h:248-248,SoaDistanceTableAAOMPTarget.h:184-185,stl_vector.h:933-933,unique_ptr.h:150-150 | qmcplusplus::SoaDistanceTableAAOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 43 | exec | random.h:1726-1726,random.h:1730-1730,random.h:1814-1814,random.h:1823-1823,RandomGenerator.h:51-55,random.tcc:419-419,random.tcc:3324-3324,random.tcc:3334-3335,random.tcc:3338-3338 | main.extracted.110 | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1549 | exec | NewTimer.cpp:53-54 | qmcplusplus::TimerType::start() | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1362 | exec | ParticleBConds3DSoa.h:235-256 | void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer > >(qmcplusplus::TinyVector const&, qmcplusplus::VectorSoAContainer > const&, double*, qmcplusplus::VectorSoAContainer >&, int, int, int) const | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 948 | exec | DelayedUpdate.h:160-160,DelayedUpdate.h:186-187 | qmcplusplus::DelayedUpdate::updateInvMat(qmcplusplus::Matrix >&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 940 | exec | inner_product.hpp:210-212 | qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&) | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 281 | exec | OneBodyJastrowRef.h:169-169,OperatorTags.h:94-94 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 967 | exec | DelayedUpdate.h:137-138 | miniqmcreference::DiracDeterminantRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 57 | exec | stl_algobase.h:740-742 | main.extracted.110 | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 863 | exec | inner_product.hpp:82-83 | qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1361 | exec | ParticleBConds3DSoa.h:235-255 | void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer > >(qmcplusplus::TinyVector const&, qmcplusplus::VectorSoAContainer > const&, double*, qmcplusplus::VectorSoAContainer >&, int, int, int) const | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 44 | exec | random.tcc:403-406,random.tcc:413-413,random.tcc:417-420,random.tcc:455-455,random.tcc:459-463,random.tcc:3329-3332 | main.extracted.110 | InBetween | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 347 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 51 | exec | random.tcc:403-406,random.tcc:413-413,random.tcc:417-420,random.tcc:455-455,random.tcc:459-463,random.tcc:3329-3332 | main.extracted.110 | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1554 | exec | NewTimer.h:119-124,stl_tree.h:787-787,stl_tree.h:795-795,stl_tree.h:1210-1210,stl_tree.h:1894-1895 | std::map, long, std::less >, std::allocator const, long> > >::operator[](qmcplusplus::StackKeyParam<2> const&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1276 | exec | OhmmsVector.h:178-178,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OperatorTags.h:43-43,VirtualParticleSet.cpp:119-120,stl_vector.h:951-951 | qmcplusplus::VirtualParticleSet::makeMoves(qmcplusplus::ParticleSet const&, int, std::vector, std::allocator > > const&, bool, int) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 47 | exec | random.tcc:403-406,random.tcc:413-413,random.tcc:417-420,random.tcc:455-455,random.tcc:459-463,random.tcc:3329-3332 | main.extracted.110 | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 49 | exec | random.tcc:409-414 | main.extracted.110 | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 367 | exec | TwoBodyJastrowRef.h:423-427,OperatorTags.h:94-94 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 383 | exec | shared_ptr_base.h:1308-1308,ParticleSet.h:313-316,TwoBodyJastrowRef.h:269-274,OhmmsVector.h:223-223,stl_algobase.h:200-200 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 48 | exec | random.tcc:401-406 | main.extracted.110 | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1540 | exec | PosTransformer.h:39-46 | qmcplusplus::RealSpacePositionsOMPTarget::setAllParticlePos(qmcplusplus::ParticleAttrib, std::allocator > > const&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 966 | exec | DelayedUpdate.h:147-148 | miniqmcreference::DiracDeterminantRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 331 | exec | BsplineFunctor.h:291-298 | qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 965 | exec | DelayedUpdate.h:147-148 | miniqmcreference::DiracDeterminantRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 379 | exec | TwoBodyJastrowRef.h:375-376 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1338 | exec | stl_uninitialized.h:526-526,OhmmsVector.h:47-47,OhmmsVector.h:287-287 | std::vector >, std::allocator > > >::_M_default_append(unsigned long) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 935 | exec | DiracMatrix.h:112-113 | qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 835 | exec | StdRandom.h:102-103,random.tcc:3325-3325,random.tcc:3334-3335,random.tcc:3338-3338 | miniqmcreference::einspline_spo_ref::set(int, int, int, int, int, bool) | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 963 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 106 | exec | TinyVector.h:164-164,OhmmsVector.h:379-379 | qmcplusplus::WaveFunction::evaluateGL(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 954 | exec | inner_product.hpp:82-83,inner_product.hpp:155-155,TinyVector.h:62-62,TinyVector.h:169-169,OperatorTags.h:94-94,DiracDeterminantRef.cpp:238-238,DiracDeterminantRef.cpp:247-247,DiracDeterminantRef.cpp:252-252,TinyVectorOps.h:131-131 | miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&) | Outermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 105 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,WaveFunction.cpp:252-256,stl_vector.h:806-806,stl_vector.h:933-933 | qmcplusplus::WaveFunction::evaluateGL(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 98 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,WaveFunction.cpp:172-175,stl_vector.h:806-806,stl_vector.h:933-933 | qmcplusplus::WaveFunction::evaluateLog(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 290 | exec | OneBodyJastrowRef.h:109-113,OneBodyJastrowRef.h:166-166,OneBodyJastrowRef.h:186-188,OneBodyJastrowRef.h:192-194,VectorSoAContainer.h:273-273,TinyVector.h:169-169,stl_numeric.h:126-127,OhmmsVector.h:223-223,OhmmsVector.h:249-249,stl_iterator.h:784-784,stl_iterator.h:887-887,stl_vector.h:951-951,stl_vector.h:1056-1056 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Outermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 373 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 285 | exec | OneBodyJastrowRef.h:171-172 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1316 | exec | VectorSoAContainer.h:150-153,stl_construct.h:107-107,Mallocator.hpp:78-78 | qmcplusplus::DistanceTableAA::~DistanceTableAA() | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 50 | exec | random.h:1726-1726,random.h:1730-1730,random.h:1814-1814,random.h:1823-1823,StdRandom.h:102-103,random.tcc:419-419,random.tcc:3325-3325,random.tcc:3334-3335,random.tcc:3338-3338 | main.extracted.110 | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 377 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 375 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1108 | exec | ParticleSet.h:127-127,ostream:564-564,OhmmsVector.h:223-223,TinyVectorTensorOps.h:150-152,OperatorTags.h:43-43,InfoStream.h:37-37,ParticleIOUtility.h:71-90,char_traits.h:329-329 | void qmcplusplus::expandSuperCell(qmcplusplus::ParticleSet&, qmcplusplus::Tensor const&) | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 836 | exec | random.tcc:404-406,random.tcc:417-420,random.tcc:455-455,random.tcc:459-463,random.tcc:3329-3332 | miniqmcreference::einspline_spo_ref::set(int, int, int, int, int, bool) | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 831 | exec | BsplineAllocator.hpp:179-180 | qmcplusplus::BsplineAllocator >::setCoefficientsForOrbitals(int, int, Array&, multi_UBspline_3d_d*) [clone .extracted] | Innermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 284 | exec | stl_numeric.h:126-127 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1098 | exec | random.h:1823-1823,StdRandom.h:102-103,random.tcc:406-406,random.tcc:3334-3335,random.tcc:3338-3338 | qmcplusplus::build_els(qmcplusplus::ParticleSet const&, StdRandom >&, bool) | Outermost | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 932 | exec | DiracMatrix.h:31-35,std_abs.h:71-71 | qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |