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 846 | exec | MultiBsplineRef.hpp:68-70 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | Innermost | 28.67 | 27.25 | 24.14 | 1.00 | 1.50 | 4.00 | 1.00 | 1 | 100.00 | 25.00 | 223.58 | 2.50 | 2.50 | 1.67 | 0.63 | 2.50 |
○Loop 860 | 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 | 13.72 | 11.77 | 10.43 | 1.00 | 2.00 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 469.32 | 11.50 | 11.50 | 5.75 | 5.75 | 11.50 |
○Loop 2083 | exec | ParticleBConds3DSoa.h:280-298,SoaDistanceTableABOMPTarget.h:228-228 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Innermost | 9.3 | 8.52 | 7.55 | 1.00 | 3.00 | 6.67 | 1.00 | 1 | 22.64 | 15.33 | 349.44 | 15.00 | 15.00 | 5.00 | 2.25 | 15.00 |
○Loop 1858 | exec | VectorSoAContainer.h:244-244,VectorSoAContainer.h:263-263,OhmmsVector.h:223-223,SoaDistanceTableAAOMPTarget.h:440-442,TinyVector.h:182-182 | qmcplusplus::SoaDistanceTableAAOMPTarget::update(int) | Single | 8.39 | 7.37 | 6.53 | 1.54 | 1.00 | 8.00 | 3.33 | 1 | 54.55 | 15.91 | 0.00 | 3.33 | 2.17 | 3.33 | 0.42 | 1.00 |
○Loop 859 | 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 | 9.35 | 5.71 | 5.06 | 1.00 | 1.06 | 2.00 | 1.41 | 1 | 100.00 | 50.00 | 469.58 | 6.33 | 6.33 | 6.00 | 3.17 | 4.50 |
○Loop 1352 | 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 | 2.74 | 2.07 | 1.83 | 1.00 | 1.67 | 1.67 | 1.00 | 1 | 94.64 | 47.99 | 1039.99 | 30.00 | 30.00 | 18.00 | 18.00 | 30.00 |
○Loop 377 | exec | BsplineFunctor.h:236-241 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 2.02 | 1.66 | 1.47 | 1.00 | 1.00 | 12.04 | 1.47 | 6561 | 0.00 | 10.85 | 0.28 | 12.50 | 12.50 | 12.50 | 1.04 | 8.50 |
○Loop 2345 | exec | | __intel_avx_rep_memset | Single | 1.51 | 1.22 | 1.08 | 1.00 | 1.00 | 2.00 | 4.00 | 1 | 100.00 | 50.00 | 0.27 | 4.00 | 4.00 | 4.00 | 2.00 | 1.00 |
○Loop 858 | 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 | 3.32 | 1.07 | 0.95 | 3.36 | 1.00 | 6.35 | 15.67 | 9 | 40.21 | 22.87 | 293.55 | 39.17 | 11.67 | 39.17 | 6.17 | 2.50 |
○Loop 848 | exec | VectorSoAContainer.h:231-231,VectorSoAContainer.h:271-271,OhmmsVector.h:223-223,stl_algobase.h:200-200,TinyVector.h:145-145,stl_vector.h:933-933,einspline_spo_ref.hpp:223-227 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Innermost | 1.18 | 0.93 | 0.83 | 2.11 | 1.00 | 12.67 | 5.43 | 1 | 0.00 | 11.93 | 0.00 | 6.33 | 3.00 | 6.33 | 0.50 | 1.17 |
○Loop 317 | exec | BsplineFunctor.h:291-298 | qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.73 | 0.63 | 0.55 | 1.18 | 1.00 | 12.53 | 1.70 | 81 | 0.00 | 9.94 | 0.04 | 7.67 | 6.50 | 7.67 | 0.61 | 4.50 |
○Loop 972 | exec | DiracDeterminantRef.cpp:157-157,OperatorTags.h:63-63,inner_product.hpp:155-155 | miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.8 | 0.61 | 0.54 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 103.70 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 959 | exec | OperatorTags.h:63-63,TinyVector.h:61-61,inner_product.hpp:155-155 | miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.72 | 0.58 | 0.51 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 110.63 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 851 | exec | MultiBsplineRef.hpp:276-286 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Innermost | 0.5 | 0.37 | 0.33 | 1.00 | 1.07 | 2.00 | 1.07 | 1 | 100.00 | 50.00 | 309.60 | 4.83 | 4.83 | 4.50 | 2.42 | 4.50 |
○Loop 350 | exec | TwoBodyJastrowRef.h:324-331 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.45 | 0.36 | 0.32 | 1.00 | 1.31 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 263.64 | 3.50 | 3.50 | 2.67 | 1.75 | 3.50 |
○Loop 863 | exec | inner_product.hpp:82-83 | qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&) | Innermost | 0.48 | 0.35 | 0.31 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 242.32 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 345 | exec | TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.44 | 0.3 | 0.26 | 1.00 | 1.33 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 211.51 | 4.00 | 4.00 | 3.00 | 2.00 | 4.00 |
○Loop 347 | exec | TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.43 | 0.29 | 0.26 | 1.00 | 1.33 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 218.17 | 4.00 | 4.00 | 3.00 | 2.00 | 4.00 |
○Loop 343 | exec | TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.42 | 0.29 | 0.26 | 1.00 | 1.33 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 218.46 | 4.00 | 4.00 | 3.00 | 2.00 | 4.00 |
○Loop 960 | exec | DiracDeterminantRef.cpp:109-109,OperatorTags.h:63-63,inner_product.hpp:155-155 | miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.37 | 0.28 | 0.24 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 226.42 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 974 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.45 | 0.28 | 0.24 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 75.24 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 940 | exec | inner_product.hpp:211-212 | qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&) | Innermost | 0.31 | 0.16 | 0.14 | 2.40 | 1.00 | 8.00 | 4.80 | 1 | 33.33 | 16.67 | 0.00 | 4.80 | 2.00 | 4.80 | 0.60 | 1.00 |
○Loop 338 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.22 | 0.15 | 0.14 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 281.13 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 337 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.2 | 0.15 | 0.13 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 284.43 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 336 | exec | TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.19 | 0.15 | 0.13 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 280.89 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 957 | exec | DiracDeterminantRef.cpp:238-238,OperatorTags.h:63-63,inner_product.hpp:155-155 | miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&) | Innermost | 0.22 | 0.13 | 0.11 | 1.00 | 1.73 | 6.40 | 1.00 | 1 | 33.33 | 16.67 | 98.18 | 16.00 | 16.00 | 9.25 | 2.50 | 16.00 |
○Loop 375 | exec | BsplineFunctor.h:246-260,stl_vector.h:951-951 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.18 | 0.11 | 0.1 | 1.00 | 1.23 | 3.33 | 1.46 | 1 | 55.26 | 30.26 | 559.07 | 23.33 | 23.33 | 19.00 | 7.00 | 16.00 |
○Loop 963 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.19 | 0.1 | 0.09 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 205.49 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 340 | exec | stl_numeric.h:126-127,stl_iterator.h:887-887 | miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.13 | 0.07 | 0.06 | 1.00 | 1.78 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 301.16 | 3.00 | 3.00 | 1.69 | 1.50 | 3.00 |
○Loop 315 | exec | BsplineFunctor.h:303-338,stl_vector.h:951-951 | qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.11 | 0.07 | 0.06 | 1.00 | 1.44 | 2.72 | 1.70 | 1 | 64.34 | 34.30 | 804.70 | 34.00 | 34.00 | 23.58 | 12.50 | 20.00 |
○Loop 81 | exec | OhmmsVector.h:229-229,NonLocalPP.hpp:126-126,NonLocalPP.hpp:129-135,stl_vector.h:806-806,stl_vector.h:933-933,unique_ptr.h:150-150 | qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | InBetween | 0.12 | 0.07 | 0.06 | 2.48 | 1.00 | 12.15 | 3.42 | 3 | 0.00 | 11.70 | 0.82 | 4.56 | 1.83 | 4.56 | 0.38 | 1.33 |
○Loop 292 | exec | BsplineFunctor.h:236-241 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.09 | 0.05 | 0.05 | 1.00 | 1.00 | 12.12 | 1.47 | 6561 | 0.00 | 10.98 | 1.09 | 12.50 | 12.50 | 12.50 | 1.03 | 8.50 |
○Loop 853 | exec | TinyVector.h:61-61,MultiBsplineRef.hpp:227-227,MultiBsplineRef.hpp:234-239,MultiBsplineRef.hpp:242-242,MultiBsplineRef.hpp:253-258 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | InBetween | 0.07 | 0.04 | 0.03 | 2.46 | 1.11 | 5.27 | 5.93 | 14 | 25.81 | 19.15 | 20.46 | 26.67 | 10.83 | 24.00 | 5.06 | 4.50 |
○Loop 358 | exec | TwoBodyJastrowRef.h:393-398 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.06 | 0.03 | 0.03 | 1.00 | 1.00 | 8.00 | 1.56 | 1 | 0.00 | 12.50 | 424.28 | 4.67 | 4.67 | 4.67 | 0.58 | 3.00 |
○Loop 955 | exec | inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&) | Innermost | 0.09 | 0.03 | 0.03 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 139.52 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 849 | exec | VectorSoAContainer.h:265-265,stl_algobase.h:695-696,MultiBsplineEvalHelper.hpp:45-47,TinyVector.h:61-61,MultiBsplineRef.hpp:187-192,MultiBsplineRef.hpp:198-202,MultiBsplineRef.hpp:229-229,MultiBsplineRef.hpp:244-244,MultiBsplineRef.hpp:249-251,MultiBsplineRef.hpp:255-258,MultiBsplineRef.hpp:269-286,stl_vector.h:933-933,stl_vector.h:1056-1056,MultiBsplineData.hpp:68-79,einspline_spo_ref.hpp:206-207 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator > >&, qmcplusplus::Vector >&) | Outermost | 0.06 | 0.02 | 0.02 | 1.89 | 1.82 | 7.94 | 2.22 | 112 | 34.72 | 18.82 | 23.70 | 81.17 | 42.83 | 44.63 | 10.22 | 36.50 |
○Loop 366 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.05 | 0.02 | 0.02 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 214.23 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 252 | exec | OneBodyJastrowRef.h:186-187 | miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.05 | 0.02 | 0.02 | 1.00 | 1.67 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 258.01 | 7.00 | 7.00 | 4.20 | 3.50 | 7.00 |
○Loop 364 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.06 | 0.02 | 0.02 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 213.41 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 362 | exec | TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.05 | 0.02 | 0.02 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 205.21 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 982 | 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 373 | exec | BsplineFunctor.h:236-236,BsplineFunctor.h:240-241,BsplineFunctor.h:246-246,BsplineFunctor.h:249-249,BsplineFunctor.h:256-260,TwoBodyJastrowRef.h:107-107,TwoBodyJastrowRef.h:127-129,TwoBodyJastrowRef.h:132-132,stl_vector.h:951-951,ParticleSet.h:313-313,ParticleSet.h:316-316 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | InBetween | 0.04 | 0.02 | 0.01 | 1.00 | 1.00 | 5.67 | 8.00 | 1000012 | 47.54 | 20.75 | 67.65 | 28.00 | 28.00 | 28.00 | 4.94 | 3.50 |
○Loop 297 | exec | stl_algobase.h:752-754 | qmcplusplus::Vector >::resize(unsigned long, double) | Single | 0.03 | 0.01 | 0.01 | 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 368 | exec | TwoBodyJastrowRef.h:375-376 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.05 | 0.01 | 0.01 | 1.00 | 1.67 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 643.57 | 7.00 | 7.00 | 4.20 | 3.50 | 7.00 |
○Loop 38 | exec | refwrap.h:313-313,miniqmc.cpp:429-458,TinyVector.h:62-62 | main.extracted.110 | Innermost | 0.04 | 0.01 | 0.01 | 5.76 | 1.00 | 11.33 | 10.08 | 2 | 9.90 | 12.29 | 0.10 | 10.08 | 1.75 | 10.08 | 0.89 | 1.00 |
○Loop 360 | exec | TwoBodyJastrowRef.h:388-391 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.04 | 0.01 | 0.01 | 1.00 | 1.20 | 2.00 | 1.33 | 1 | 100.00 | 50.00 | 825.82 | 2.00 | 2.00 | 1.67 | 1.00 | 1.50 |
○Loop 372 | exec | refwrap.h:313-313,shared_ptr_base.h:1308-1308,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OhmmsVector.h:249-249,optional:897-897,optional:1213-1213,TwoBodyJastrowRef.h:107-108,TwoBodyJastrowRef.h:126-127,stl_vector.h:806-806,stl_vector.h:933-933,stl_vector.h:951-951,stl_vector.h:1056-1056,ParticleSet.h:313-313 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Outermost | 0.03 | 0.01 | 0.01 | 2.86 | 1.95 | 15.61 | 5.00 | 1000012 | 17.39 | 13.65 | 12.60 | 10.00 | 3.50 | 5.13 | 0.64 | 2.00 |
○Loop 852 | exec | MultiBsplineRef.hpp:226-226,MultiBsplineRef.hpp:234-236,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 | 5.14 | 1.00 | 8.00 | 9.00 | 14 | 0.00 | 12.39 | 4.85 | 12.00 | 2.33 | 12.00 | 1.50 | 1.33 |
○Loop 249 | 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 | 344.96 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 1213 | exec | ParticleSet.cpp:242-243,stl_vector.h:806-806,unique_ptr.h:150-150 | qmcplusplus::ParticleSet::update(bool) | Single | 0.03 | 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 82 | exec | VectorSoAContainer.h:231-231,OhmmsVector.h:229-229,NonLocalPP.hpp:131-132,OperatorTags.h:43-43,OperatorTags.h:63-63,TinyVector.h:145-145,stl_vector.h:806-806,stl_vector.h:933-933 | 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 | 5.95 | 5.00 | 5.00 | 2.96 | 0.71 | 2.33 |
○Loop 843 | exec | stl_algobase.h:695-696,MultiBsplineEvalHelper.hpp:45-47,MultiBsplineRef.hpp:42-44,MultiBsplineRef.hpp:47-49,MultiBsplineRef.hpp:56-58,MultiBsplineRef.hpp:67-71,stl_vector.h:1056-1056,MultiBsplineData.hpp:54-57,einspline_spo_ref.hpp:175-176 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | Outermost | 0.03 | 0.01 | 0.01 | 1.34 | 2.03 | 8.67 | 1.54 | 10 | 17.50 | 14.64 | 27.20 | 31.50 | 23.50 | 15.50 | 3.63 | 20.50 |
○Loop 247 | 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 | 340.61 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 248 | 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 | 345.66 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 286 | exec | OhmmsVector.h:223-223,OhmmsVector.h:229-229,OhmmsVector.h:249-249,OneBodyJastrowRef.h:134-135,OneBodyJastrowRef.h:141-143,OneBodyJastrowRef.h:146-146,OneBodyJastrowRef.h:151-153,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 | 0.03 | 0.01 | 0.01 | 3.17 | 2.57 | 11.78 | 6.33 | 1000012 | 22.73 | 14.20 | 0.10 | 9.50 | 3.00 | 3.70 | 0.81 | 1.50 |
○Loop 313 | exec | shared_ptr_base.h:1308-1308,OhmmsVector.h:223-223,OneBodyJastrowRef.h:214-219,stl_vector.h:933-933,stl_vector.h:1056-1056,ParticleSet.h:313-316 | 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 | 0.70 | 3.00 | 3.00 | 3.00 | 0.25 | 1.00 |
○Loop 314 | exec | BsplineFunctor.h:303-338 | qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.03 | 0.01 | 0.01 | 1.00 | 2.40 | 6.90 | 1.00 | 1 | 43.30 | 19.46 | 169.16 | 25.00 | 25.00 | 10.42 | 3.63 | 25.00 |
○Loop 280 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.02 | 0.01 | 0.01 | 1.00 | 1.54 | 2.00 | 1.00 | 1 | 100.00 | 50.00 | 71.00 | 4.00 | 4.00 | 2.60 | 2.00 | 4.00 |
○Loop 112 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,stl_vector.h:806-806,stl_vector.h:933-933,WaveFunction.cpp:263-263,WaveFunction.cpp:269-269,WaveFunction.cpp:272-273 | qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Outermost | 0.04 | 0.01 | 0.01 | 1.00 | 1.00 | 13.89 | 2.78 | 8 | 16.67 | 13.54 | 0.10 | 8.33 | 8.33 | 8.33 | 0.60 | 3.00 |
○Loop 106 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,OperatorTags.h:94-94,stl_vector.h:806-806,stl_vector.h:933-933,WaveFunction.cpp:185-188 | qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.02 | 0.01 | 0 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
○Loop 861 | exec | OhmmsVector.h:178-178,OhmmsVector.h:248-249,SPOSet.h:83-86,stl_vector.h:933-933,inner_product.hpp:82-83 | qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&) | Outermost | 0.02 | 0.01 | 0 | NA | NA | NA | NA | NA | NA | NA | 33.30 | NA | NA | NA | NA | NA |
○Loop 370 | exec | stl_numeric.h:126-127,stl_iterator.h:887-887 | miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.03 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 341 | exec | shared_ptr_base.h:1308-1308,OhmmsVector.h:223-223,stl_algobase.h:200-200,TwoBodyJastrowRef.h:269-274,ParticleSet.h:313-316 | 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 80 | exec | VectorSoAContainer.h:231-231,OhmmsVector.h:229-229,NonLocalPP.hpp:122-122,NonLocalPP.hpp:126-126,TinyVector.h:170-170,stl_vector.h:951-951,ParticleSet.h:277-277 | 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 288 | exec | shared_ptr_base.h:1308-1308,OhmmsVector.h:223-223,OneBodyJastrowRef.h:134-134,OneBodyJastrowRef.h:143-146,BsplineFunctor.h:229-229,BsplineFunctor.h:236-236,BsplineFunctor.h:240-241,BsplineFunctor.h:246-246,BsplineFunctor.h:249-249,BsplineFunctor.h:256-260,stl_vector.h:951-951,ParticleSet.h:313-313,ParticleSet.h:316-316 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | InBetween | 0.03 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 278 | exec | OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::ParticleAttrib >&, bool) | Innermost | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 845 | exec | MultiBsplineRef.hpp:64-71 | miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&) | InBetween | 0.03 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 2084 | exec | ParticleBConds3DSoa.h:284-286,ParticleBConds3DSoa.h:294-296,SoaDistanceTableABOMPTarget.h:214-214,SoaDistanceTableABOMPTarget.h:222-222 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Outermost | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 279 | 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 844 | 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 | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 107 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,stl_vector.h:806-806,stl_vector.h:933-933,WaveFunction.cpp:198-201 | qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | Single | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 352 | exec | shared_ptr_base.h:1308-1308,OhmmsVector.h:223-223,stl_algobase.h:200-200,TwoBodyJastrowRef.h:269-274,ParticleSet.h:313-316 | 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 2085 | exec | ParticleBConds3DSoa.h:296-296,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 1220 | exec | ParticleSet.cpp:343-344,stl_vector.h:806-806,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 374 | exec | BsplineFunctor.h:246-260 | miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 242 | 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 1042 | 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 109 | exec | refwrap.h:313-313,NewTimer.h:242-242,NewTimer.h:249-249,stl_vector.h:806-806,stl_vector.h:933-933,WaveFunction.cpp:225-228 | 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 842 | exec | stl_algobase.h:200-200,stl_algobase.h:366-368,stl_vector.h:933-933,stl_vector.h:1056-1056,einspline_spo_ref.hpp:183-187,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 283 | 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 967 | 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 970 | exec | DiracDeterminantRef.cpp:157-157,DiracDeterminantRef.cpp:173-173,DiracDeterminantRef.cpp:178-178,TinyVectorOps.h:129-131,OperatorTags.h:94-94,TinyVector.h:169-169,inner_product.hpp:82-83,inner_product.hpp:155-155 | 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 114 | exec | WaveFunction.cpp:273-274 | qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 289 | exec | BsplineFunctor.h:246-260 | miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | Innermost | 0.01 | 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 | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 2086 | 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 356 | exec | VectorSoAContainer.h:244-244,VectorSoAContainer.h:263-263,VectorSoAContainer.h:273-273,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OhmmsVector.h:249-249,stl_numeric.h:126-127,stl_algobase.h:752-754,stl_iterator.h:784-784,stl_iterator.h:887-887,TwoBodyJastrowRef.h:268-269,TwoBodyJastrowRef.h:364-364,TwoBodyJastrowRef.h:367-367,TwoBodyJastrowRef.h:375-376,TwoBodyJastrowRef.h:381-382,TwoBodyJastrowRef.h:386-393,TwoBodyJastrowRef.h:397-398,TwoBodyJastrowRef.h:420-420,DistanceTable.h:268-268,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 1853 | 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 | 0.01 | 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 | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1553 | exec | stl_tree.h:787-787,stl_tree.h:795-795,stl_tree.h:1210-1210,stl_tree.h:1894-1895,NewTimer.h:119-124 | std::map, double, std::less >, std::allocator const, double> > >::operator[](qmcplusplus::StackKeyParam<2> const&) | Single | 0.05 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 865 | exec | OhmmsVector.h:56-56,OhmmsVector.h:144-144,OhmmsVector.h:210-212,OhmmsVector.h:287-287,SPOSet.h:106-111,OhmmsMatrix.h:217-217,new_allocator.h:125-125 | qmcplusplus::SPOSet::evaluate_notranspose(qmcplusplus::ParticleSet const&, int, int, qmcplusplus::Matrix >&, qmcplusplus::Matrix, std::allocator > >&, qmcplusplus::Matrix >&) | Single | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1351 | 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 | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 47 | exec | random.h:1726-1726,random.h:1730-1730,random.h:1814-1814,random.h:1823-1823,RandomGenerator.h:51-55,random.tcc:406-406,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 947 | exec | OhmmsVector.h:223-223,DelayedUpdate.h:186-187,OhmmsMatrix.h:236-236 | qmcplusplus::DelayedUpdate::updateInvMat(qmcplusplus::Matrix >&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1226 | exec | ParticleSet.cpp:389-390,stl_vector.h:806-806,unique_ptr.h:150-150 | qmcplusplus::ParticleSet::acceptMove(int) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1272 | exec | VirtualParticleSet.cpp:119-120,OhmmsVector.h:178-178,OhmmsVector.h:223-223,OhmmsVector.h:229-229,OperatorTags.h:43-43,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 1554 | exec | stl_tree.h:787-787,stl_tree.h:795-795,stl_tree.h:1210-1210,stl_tree.h:1894-1895,NewTimer.h:119-124 | std::map, long, std::less >, std::allocator const, long> > >::operator[](qmcplusplus::StackKeyParam<2> const&) | Single | 0.02 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 847 | exec | VectorSoAContainer.h:231-231,stl_algobase.h:200-200,stl_vector.h:933-933,einspline_spo_ref.hpp:219-219,einspline_spo_ref.hpp:222-223 | 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 354 | exec | TwoBodyJastrowRef.h:423-427,OperatorTags.h:94-94 | miniqmcreference::TwoBodyJastrowRef >::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 939 | exec | inner_product.hpp:210-212 | qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&) | InBetween | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 966 | 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 285 | 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 270 | exec | OneBodyJastrowRef.h:169-169,OperatorTags.h:94-94 | miniqmcreference::OneBodyJastrowRef >::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 371 | exec | shared_ptr_base.h:1308-1308,OhmmsVector.h:223-223,stl_algobase.h:200-200,TwoBodyJastrowRef.h:269-274,ParticleSet.h:313-316 | 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 111 | exec | OhmmsVector.h:379-379,TinyVector.h:164-164 | qmcplusplus::WaveFunction::evaluateGL(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 64 | exec | stl_algobase.h:740-742 | main.extracted.110 | Innermost | 0.01 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 48 | 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 290 | exec | BsplineFunctor.h:246-260,stl_vector.h:951-951 | 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 1537 | exec | PosTransformer.h:39-46 | qmcplusplus::RealSpacePositions::setAllParticlePos(qmcplusplus::ParticleAttrib, std::allocator > > const&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 934 | 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 1096 | 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 | qmcplusplus::build_els(qmcplusplus::ParticleSet const&, StdRandom >&, bool) | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 57 | 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 52 | 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 938 | 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 1095 | exec | random.h:1823-1823,random.tcc:406-406,random.tcc:3334-3335,random.tcc:3338-3338,StdRandom.h:102-103 | 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 953 | exec | DiracDeterminantRef.cpp:238-238,DiracDeterminantRef.cpp:247-247,DiracDeterminantRef.cpp:252-252,TinyVectorOps.h:129-131,OperatorTags.h:94-94,TinyVector.h:169-169,inner_product.hpp:82-83,inner_product.hpp:155-155 | 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 56 | exec | random.h:1726-1726,random.h:1730-1730,random.h:1814-1814,random.h:1823-1823,random.tcc:406-406,random.tcc:419-419,random.tcc:3334-3335,random.tcc:3338-3338,StdRandom.h:102-103 | main.extracted.110 | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 55 | 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 268 | 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 333 | 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 273 | exec | VectorSoAContainer.h:273-273,OhmmsVector.h:223-223,OhmmsVector.h:249-249,OneBodyJastrowRef.h:109-113,OneBodyJastrowRef.h:166-166,OneBodyJastrowRef.h:186-188,OneBodyJastrowRef.h:192-194,stl_numeric.h:126-127,stl_iterator.h:784-784,stl_iterator.h:887-887,TinyVector.h:169-169,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 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 964 | 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 20 | exec | PrimeNumberSet.h:86-91 | main | 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 105 | exec | OhmmsVector.h:379-379,TinyVector.h:164-164 | qmcplusplus::WaveFunction::evaluateLog(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 2090 | exec | VectorSoAContainer.h:151-153,VectorSoAContainer.h:167-167,VectorSoAContainer.h:174-176,OhmmsVector.h:149-149,OhmmsVector.h:156-158,OhmmsVector.h:212-215,OhmmsVector.h:248-248,SoaDistanceTableABOMPTarget.h:73-76,stl_vector.h:933-933,Mallocator.hpp:78-78 | qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&) | Single | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 1106 | exec | TinyVectorTensorOps.h:150-152,ParticleIOUtility.h:71-90,OhmmsVector.h:223-223,ostream:564-564,InfoStream.h:37-37,OperatorTags.h:43-43,ParticleSet.h:127-127,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 962 | 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 862 | 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 53 | 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 369 | 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 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 367 | 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 365 | 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 363 | 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 361 | 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 339 | exec | stl_numeric.h:127-127,stl_iterator.h:887-887 | 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 359 | exec | TwoBodyJastrowRef.h:388-391 | 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 833 | 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 1104 | exec | ParticleIOUtility.h:69-69,ParticleIOUtility.h:78-78,OperatorTags.h:63-63 | void qmcplusplus::expandSuperCell(qmcplusplus::ParticleSet&, qmcplusplus::Tensor const&) | InBetween | 0 | 0 | 0 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
○Loop 832 | exec | BsplineAllocator.hpp:108-108,random.tcc:406-406,random.tcc:3334-3335,random.tcc:3338-3338,StdRandom.h:102-103 | 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 828 | 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 267 | 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 931 | exec | std_abs.h:71-71,DiracMatrix.h:31-35 | 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 |