Loop id | Source Location | Source Function | Level | Coverage run_0 (%) | Max Time Over Threads run_0 (s) | Time w.r.t. Wall Time run_0 (s) | Nb Threads run_0 | GFLOPS run_0 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing run_0 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect |
---|
873 | exec - MultiBsplineRef.hpp:68-70 | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&) | Innermost | 24.67 | 29.62 | 27.69 | 112 | 219.96 | 100 | 25 | 1 | 1.5 | 4 | 1.08 | 0 | 5 | 0 | 0 | 0 |
880 | exec - MultiBsplineRef.hpp:242-262 [...] | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<... | Innermost | 12.46 | 14.66 | 13.98 | 112 | 606.68 | 100 | 50 | 1 | 1.76 | 2 | 1.06 | 1 | 9 | 1 | 0 | 0 |
2090 | exec - SoaDistanceTableABOMPTarget.h:228-228 [...] | qmcplusplus::SoaDistanceTableABOMPTarget<double, 3u, 40>::evaluate(qmcplusplus::ParticleSet&) | Innermost | 7.2 | 8.79 | 8.08 | 112 | 363.89 | 12.77 | 14.1 | 1 | 3.33 | 6.67 | 1.1 | 0 | 7 | 0 | 0 | 0 |
1864 | exec - SoaDistanceTableAAOMPTarget.h:440-442 [...] | qmcplusplus::SoaDistanceTableAAOMPTarget<double, 3u, 40>::update(int) | Single | 6.92 | 8.42 | 7.77 | 112 | 0.00 | 54.55 | 15.91 | 1.46 | 1 | 8 | 1.1 | 0 | 4 | 2 | 4 | 1 |
1370 | exec - ParticleBConds3DSoa.h:235-256 | void qmcplusplus::DTD_BConds<double, 3u, 40>::computeDistances<qmcplusplus::TinyVector<double, 3u>, qmcplusplus::VectorSoAContainer<double, 3u, qmcplusplus::Mallocator<double, 64ul> >, qmcplusplus::VectorSoAContainer<double, 3... | Single | 2 | 2.6 | 2.25 | 112 | 957.39 | 97 | 48.88 | 1 | 1.67 | 1.67 | 1.17 | 2 | 7 | 0 | 0 | 0 |
393 | exec - BsplineFunctor.h:236-241 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Innermost | 1.32 | 2 | 1.48 | 112 | 0.46 | 89.47 | 44.08 | 1.5 | 1 | 3.2 | 1.37 | 1 | 1 | 0 | 3 | 0 |
2345 | exec - | __intel_avx_rep_memset | Single | 1.11 | 1.49 | 1.25 | 112 | 0.24 | 100 | 50 | 1 | 1 | 2 | 1.21 | 0 | 1 | 0 | 0 | 0 |
875 | exec - einspline_spo_ref.hpp:223-227 [...] | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<... | Innermost | 0.9 | 1.21 | 1.01 | 112 | 0.00 | 30 | 15.31 | 1.88 | 1 | 10.22 | 1.22 | 3 | 0 | 1 | 8 | 0 |
994 | exec - inner_product.hpp:155-155 [...] | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<... | Innermost | 0.58 | 0.84 | 0.65 | 112 | 97.72 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.31 | 0 | 1 | 1 | 0 | 0 |
981 | exec - inner_product.hpp:155-155 [...] | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.56 | 0.79 | 0.63 | 112 | 101.28 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.27 | 0 | 1 | 1 | 0 | 0 |
332 | exec - BsplineFunctor.h:291-297 | qmcplusplus::BsplineFunctor<double>::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.52 | 0.76 | 0.58 | 112 | 0.46 | 86.96 | 44.57 | 1.39 | 1 | 2.92 | 1.33 | 1 | 1 | 0 | 6 | 0 |
877 | exec - MultiBsplineRef.hpp:276-286 | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<... | Innermost | 0.38 | 0.58 | 0.43 | 112 | 266.46 | 100 | 50 | 1 | 1.07 | 2 | 1.38 | 0 | 9 | 0 | 0 | 0 |
363 | exec - TwoBodyJastrowRef.h:324-331 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.32 | 0.44 | 0.36 | 112 | 264.79 | 100 | 50 | 1 | 1.31 | 2 | 1.22 | 0 | 8 | 0 | 0 | 0 |
883 | exec - inner_product.hpp:82-83 | qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<double, std::allocator<double> > const&, std::vector<double, st... | Innermost | 0.3 | 0.46 | 0.34 | 112 | 249.37 | 100 | 50 | 1 | 1.54 | 2 | 1.39 | 0 | 2 | 0 | 0 | 0 |
982 | exec - inner_product.hpp:155-155 [...] | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.29 | 0.44 | 0.32 | 112 | 197.17 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.38 | 0 | 1 | 1 | 0 | 0 |
361 | exec - TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.28 | 0.43 | 0.31 | 112 | 204.36 | 100 | 50 | 1 | 1.33 | 2 | 1.39 | 0 | 5 | 0 | 0 | 0 |
357 | exec - TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.27 | 0.41 | 0.3 | 112 | 211.17 | 100 | 50 | 1 | 1.33 | 2 | 1.37 | 0 | 5 | 0 | 0 | 0 |
359 | exec - TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.27 | 0.41 | 0.31 | 112 | 202.88 | 100 | 50 | 1 | 1.33 | 2 | 1.37 | 0 | 5 | 0 | 0 | 0 |
996 | exec - inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<... | Innermost | 0.26 | 0.41 | 0.29 | 112 | 72.48 | 100 | 50 | 1 | 1.54 | 2 | 1.46 | 0 | 2 | 0 | 0 | 0 |
350 | exec - TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.16 | 0.25 | 0.17 | 112 | 243.02 | 100 | 50 | 1 | 1.54 | 2 | 1.47 | 0 | 2 | 0 | 0 | 0 |
351 | exec - TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.16 | 0.26 | 0.17 | 112 | 248.66 | 100 | 50 | 1 | 1.54 | 2 | 1.53 | 0 | 2 | 0 | 0 | 0 |
352 | exec - TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.15 | 0.24 | 0.17 | 112 | 246.89 | 100 | 50 | 1 | 1.54 | 2 | 1.41 | 0 | 2 | 0 | 0 | 0 |
962 | exec - inner_product.hpp:211-212 | qmcplusplus::DiracMatrix<double, double>::invert_transpose(qmcplusplus::Matrix<double, std::allocator<double> > const&, qmcplusplus::Matrix<double, std::allocator<double> >&, double&, double&) | Innermost | 0.14 | 0.31 | 0.15 | 112 | 0.00 | 85.71 | 41.07 | 1.11 | 1 | 2.4 | 2.07 | 0 | 1 | 0 | 0 | 1 |
979 | exec - inner_product.hpp:155-155 [...] | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector&l... | Innermost | 0.13 | 0.31 | 0.14 | 112 | 90.55 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 2.21 | 0 | 1 | 1 | 0 | 0 |
961 | exec - inner_product.hpp:211-212 | qmcplusplus::DiracMatrix<double, double>::invert_transpose(qmcplusplus::Matrix<double, std::allocator<double> > const&, qmcplusplus::Matrix<double, std::allocator<double> >&, double&, double&) | Innermost | 0.12 | 0.28 | 0.14 | 112 | 0.00 | 85.71 | 41.07 | 1.11 | 1 | 2.4 | 2 | 0 | 1 | 0 | 0 | 1 |
985 | exec - inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.1 | 0.17 | 0.11 | 112 | 193.44 | 100 | 50 | 1 | 1.54 | 2 | 1.55 | 0 | 2 | 0 | 0 | 0 |
391 | exec - BsplineFunctor.h:246-260 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Innermost | 0.08 | 0.16 | 0.09 | 112 | 657.15 | 100 | 46.88 | 1 | 1.52 | 2.13 | 1.78 | 0 | 1 | 0 | 0 | 1 |
354 | exec - stl_numeric.h:126-127 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.08 | 0.13 | 0.09 | 112 | 235.12 | 100 | 50 | 1 | 1.78 | 2 | 1.63 | 0 | 1 | 0 | 0 | 0 |
76 | exec - NonLocalPP.hpp:126-135 [...] | qmcplusplus::NonLocalPP<double>::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | InBetween | 0.06 | 0.11 | 0.06 | 112 | 0.43 | 0 | 11.74 | 2.52 | 1 | 12.22 | 1.83 | 2.33 | 1.67 | 3 | 0.67 | 1 |
330 | exec - BsplineFunctor.h:303-338 | qmcplusplus::BsplineFunctor<double>::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.06 | 0.13 | 0.07 | 112 | 822.62 | 100 | 48.58 | 1.13 | 1.57 | 2.1 | 1.86 | 1 | 2 | 0 | 0 | 4 |
308 | exec - BsplineFunctor.h:236-241 [...] | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Innermost | 0.04 | 0.09 | 0.04 | 112 | 1.65 | 88.24 | 43.38 | 1.5 | 1 | 3.2 | 2.25 | 1 | 1 | 0 | 4 | 0 |
977 | exec - inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector&l... | Innermost | 0.03 | 0.07 | 0.03 | 112 | 142.25 | 100 | 50 | 1 | 1.54 | 2 | 2.33 | 0 | 2 | 0 | 0 | 0 |
876 | exec - MultiBsplineRef.hpp:187-286 [...] | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<... | Outermost | 0.02 | 0.05 | 0.02 | 112 | 30.00 | 38.15 | 23 | 1.5 | 1.9 | 6.41 | 2.5 | NA | NA | NA | NA | NA |
381 | exec - TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.02 | 0.05 | 0.02 | 112 | 213.98 | 100 | 50 | 1 | 1.54 | 2 | 2.5 | 0 | 2 | 0 | 0 | 0 |
390 | exec - BsplineFunctor.h:229-260 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | InBetween | 0.02 | 0.06 | 0.02 | 112 | 346.64 | 39.69 | 24.38 | 1 | 1.04 | 5 | 3 | NA | NA | NA | NA | NA |
379 | exec - TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.02 | 0.05 | 0.02 | 112 | 210.26 | 100 | 50 | 1 | 1.54 | 2 | 2.5 | 0 | 2 | 0 | 0 | 0 |
383 | exec - TwoBodyJastrowRef.h:381-382 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.02 | 0.05 | 0.02 | 112 | 214.61 | 100 | 50 | 1 | 1.54 | 2 | 2.5 | 0 | 2 | 0 | 0 | 0 |
268 | exec - OneBodyJastrowRef.h:186-187 | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.02 | 0.06 | 0.02 | 112 | 253.01 | 100 | 50 | 1 | 1.67 | 2 | 3 | 0 | 2 | 0 | 0 | 0 |
389 | exec - TwoBodyJastrowRef.h:107-132 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Outermost | 0.01 | 0.03 | 0.01 | 103 | 35.30 | 52.5 | 28.63 | 1.78 | 1.72 | 5.48 | 3 | NA | NA | NA | NA | NA |
375 | exec - TwoBodyJastrowRef.h:397-398 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.01 | 0.02 | 0.01 | 112 | 407.61 | 100 | 50 | 1 | 1.17 | 2 | 2 | 0 | 3 | 0 | 0 | 0 |
263 | exec - OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.01 | 0.03 | 0.01 | 112 | 356.51 | 100 | 50 | 1 | 1.54 | 2 | 3 | 0 | 2 | 0 | 0 | 0 |
36 | exec - miniqmc.cpp:429-458 [...] | main.extracted.110 | Innermost | 0.01 | 0.03 | 0.01 | 101 | 0.00 | 9.46 | 12.3 | 5.9 | 1 | 11.43 | 3 | 2 | 0 | 1 | 0 | 0 |
305 | exec - BsplineFunctor.h:229-260 [...] | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | InBetween | 0.01 | 0.03 | 0.01 | 108 | 44.20 | 39.06 | 23.97 | 1 | 1.04 | 5.14 | 3 | NA | NA | NA | NA | NA |
313 | exec - stl_algobase.h:752-754 | qmcplusplus::Vector<double, std::allocator<double> >::resize(unsigned long, double) | Single | 0.01 | 0.03 | 0.02 | 112 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.5 | 0 | 1 | 0 | 0 | 0 |
2089 | exec - SoaDistanceTableABOMPTarget.h:215-228 [...] | qmcplusplus::SoaDistanceTableABOMPTarget<double, 3u, 40>::evaluate(qmcplusplus::ParticleSet&) | InBetween | 0.01 | 0.03 | 0.01 | 112 | 82.60 | 0 | 7.98 | 2.41 | 1 | 14.75 | 3 | 1 | 0 | 0 | 4 | 0 |
879 | exec - MultiBsplineRef.hpp:227-262 [...] | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<... | InBetween | 0.01 | 0.03 | 0.01 | 112 | 726.12 | 49.25 | 30.91 | 1.22 | 1.81 | 4.16 | 3 | 1.5 | 0 | 0 | 9 | 0 |
374 | exec - TwoBodyJastrowRef.h:397-398 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.01 | 0.02 | 0.01 | 112 | 416.01 | 100 | 50 | 1 | 1.17 | 2 | 2 | 0 | 3 | 0 | 0 | 0 |
77 | exec - NonLocalPP.hpp:131-132 [...] | qmcplusplus::NonLocalPP<double>::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | Innermost | 0.01 | 0.04 | 0.01 | 99 | 3.75 | 38.89 | 17.36 | 1.09 | 1.92 | 6.6 | 4 | 5 | 0 | 2 | 1 | 3 |
264 | exec - OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.01 | 0.03 | 0.01 | 112 | 351.46 | 100 | 50 | 1 | 1.54 | 2 | 3 | 0 | 2 | 0 | 0 | 0 |
1225 | exec - ParticleSet.cpp:242-243 [...] | qmcplusplus::ParticleSet::update(bool) | Single | 0.01 | 0.04 | 0.01 | 95 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 4 | 1 | 1 | 0 | 0 | 2 |
1004 | exec - stl_algobase.h:740-742 | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::resize(int, int) | Single | 0.01 | 0.04 | 0.02 | 111 | 0.00 | 100 | 50 | 1 | 1 | 2 | 2 | 0 | 1 | 0 | 0 | 0 |
377 | exec - TwoBodyJastrowRef.h:388-391 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.01 | 0.04 | 0.01 | 112 | 819.62 | 100 | 50 | 1 | 1.2 | 2 | 4 | 0 | 5 | 0 | 0 | 0 |
870 | exec - MultiBsplineRef.hpp:42-71 [...] | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&) | Outermost | 0.01 | 0.03 | 0.01 | 112 | 24.80 | 18.33 | 14.79 | 1.39 | 2.06 | 7.15 | 3 | NA | NA | NA | NA | NA |
385 | exec - TwoBodyJastrowRef.h:375-376 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.01 | 0.04 | 0.01 | 112 | 637.32 | 100 | 50 | 1 | 1.67 | 2 | 4 | 0 | 2 | 0 | 0 | 0 |
297 | exec - OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.01 | 0.02 | 0.01 | 110 | 70.65 | 100 | 50 | 1 | 1.54 | 2 | 2 | 0 | 2 | 0 | 0 | 0 |
329 | exec - OneBodyJastrowRef.h:214-219 [...] | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::computeU3(qmcplusplus::ParticleSet&, int, double const*) | Single | 0.01 | 0.03 | 0.01 | 97 | 3.00 | 0 | 11.11 | 1 | 1 | 12.04 | 3 | 1 | 1 | 0.5 | 0 | 0.5 |
265 | exec - OneBodyJastrowRef.h:192-193 | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.01 | 0.03 | 0.01 | 112 | 338.31 | 100 | 50 | 1 | 1.54 | 2 | 3 | 0 | 2 | 0 | 0 | 0 |
303 | exec - OneBodyJastrowRef.h:134-155 [...] | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Outermost | 0.01 | 0.03 | 0.01 | 88 | 6.55 | 53.85 | 29.01 | 2.15 | 1.77 | 5.03 | 3 | NA | NA | NA | NA | NA |
373 | exec - TwoBodyJastrowRef.h:397-398 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.01 | 0.03 | 0.01 | 112 | 429.26 | 100 | 50 | 1 | 1.17 | 2 | 3 | 0 | 3 | 0 | 0 | 0 |
101 | exec - WaveFunction.cpp:185-188 [...] | qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.01 | 0.03 | 0.01 | 75 | 0.00 | 27.27 | 15.34 | 1.56 | 2.04 | 9.74 | 3 | 3 | 0 | 1 | 0 | 2 |