Loop id | Source Location | Source Function | Level | Exclusive Coverage icx_4 (%) | Inclusive Coverage icx_4 (%) | Max Exclusive Time Over Threads icx_4 (s) | Max Inclusive Time Over Threads icx_4 (s) | Exclusive Time w.r.t. Wall Time icx_4 (s) | Inclusive Time w.r.t. Wall Time icx_4 (s) | Nb Threads icx_4 | GFLOPS icx_4 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing icx_4 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect |
---|
924 | exec - MultiBsplineRef.hpp:68-70 | miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&) | Innermost | 19.92 | 19.92 | 17.84 | 17.84 | 17.04 | 17.04 | 252 | 0.00 | 100 | 25 | 1 | 1.5 | 4 | 1.06 | 0 | 5 | 0 | 0 | 0 |
1962 | exec - SoaDistanceTableAAOMPTarget.h:440-442 [...] | qmcplusplus::SoaDistanceTableAAOMPTarget<double, 3u, 40>::update(int) | Single | 15.65 | 15.65 | 14.08 | 14.08 | 13.39 | 13.39 | 252 | 0.00 | 54.55 | 15.91 | 1.46 | 1 | 8 | 1.06 | 0 | 4 | 2 | 4 | 0 |
933 | 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 | 10.24 | 10.24 | 9.28 | 9.28 | 8.76 | 8.76 | 252 | 0.00 | 100 | 50 | 1 | 1.76 | 2 | 1.07 | 1 | 9 | 0 | 0 | 0 |
2217 | exec - SoaDistanceTableABOMPTarget.h:228-228 [...] | qmcplusplus::SoaDistanceTableABOMPTarget<double, 3u, 40>::evaluate(qmcplusplus::ParticleSet&) | Innermost | 7.09 | 7.09 | 6.65 | 6.65 | 6.06 | 6.06 | 252 | 0.00 | 12.77 | 14.1 | 1 | 3.33 | 6.67 | 1.11 | 0 | 7 | 0 | 0 | 0 |
410 | exec - BsplineFunctor.h:236-241 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Innermost | 1.95 | 1.95 | 1.91 | 1.91 | 1.67 | 1.67 | 252 | 0.00 | 94.12 | 47.43 | 1.54 | 1 | 3.08 | 1.16 | 1 | 1 | 0 | 0 | 3 |
1419 | 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 | 1.48 | 1.48 | 1.54 | 1.54 | 1.27 | 1.27 | 252 | 0.00 | 91.26 | 46.72 | 1 | 1.67 | 1.67 | 1.24 | 1 | 0 | 0 | 0 | 7 |
2501 | exec - | __intel_avx_rep_memset | Single | 0.80 | 0.80 | 0.88 | 0.88 | 0.68 | 0.68 | 252 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.3 | 0 | 0 | 2 | 0 | 0 |
926 | 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 | 0.63 | 0.63 | 0.73 | 0.73 | 0.54 | 0.54 | 252 | 0.00 | 20 | 13.13 | 2.18 | 1 | 12.26 | 1.37 | 4 | 6 | 0 | 4 | 0 |
1046 | 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 | 0.62 | 0.62 | 0.64 | 0.64 | 0.53 | 0.53 | 252 | 0.00 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.21 | 0 | 2 | 0 | 0 | 0 |
1033 | exec - inner_product.hpp:155-155 [...] | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evalGrad(qmcplusplus::ParticleSet&, int) | Single | 0.60 | 0.60 | 0.69 | 0.69 | 0.52 | 0.52 | 252 | 0.00 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.34 | 0 | 2 | 0 | 0 | 0 |
351 | exec - BsplineFunctor.h:291-297 | qmcplusplus::BsplineFunctor<double>::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.45 | 0.45 | 0.52 | 0.52 | 0.39 | 0.39 | 252 | 0.00 | 90.91 | 46.02 | 1.39 | 1 | 2.92 | 1.36 | 1 | 1 | 0 | 0 | 5 |
936 | 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 | 0.26 | 0.26 | 0.32 | 0.32 | 0.22 | 0.22 | 252 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 1.5 | 0 | 2 | 0 | 0 | 0 |
380 | exec - TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.25 | 0.25 | 0.30 | 0.30 | 0.21 | 0.21 | 252 | 0.00 | 100 | 50 | 1 | 1.38 | 2 | 1.42 | 0 | 5 | 0 | 0 | 0 |
376 | exec - TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.24 | 0.24 | 0.29 | 0.29 | 0.21 | 0.21 | 252 | 0.00 | 100 | 50 | 1 | 1.38 | 2 | 1.42 | 0 | 5 | 0 | 0 | 0 |
378 | exec - TwoBodyJastrowRef.h:342-347 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.24 | 0.24 | 0.32 | 0.32 | 0.20 | 0.20 | 252 | 0.00 | 100 | 50 | 1 | 1.38 | 2 | 1.59 | 0 | 5 | 0 | 0 | 0 |
1048 | 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 | 0.24 | 0.24 | 0.30 | 0.30 | 0.20 | 0.20 | 252 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 1.5 | 0 | 2 | 0 | 0 | 0 |
383 | exec - TwoBodyJastrowRef.h:324-331 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int) | Single | 0.23 | 0.23 | 0.28 | 0.28 | 0.20 | 0.20 | 252 | 0.00 | 100 | 50 | 1 | 1.31 | 2 | 1.46 | 0 | 8 | 0 | 0 | 0 |
929 | 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 | 0.20 | 0.20 | 0.24 | 0.24 | 0.17 | 0.17 | 252 | 0.00 | 100 | 50 | 1 | 1.07 | 2 | 1.43 | 0 | 9 | 0 | 0 | 0 |
1034 | exec - inner_product.hpp:155-155 [...] | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.15 | 0.15 | 0.20 | 0.20 | 0.13 | 0.13 | 252 | 0.00 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.61 | 0 | 2 | 0 | 0 | 0 |
371 | exec - TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.12 | 0.12 | 0.15 | 0.15 | 0.10 | 0.10 | 252 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 1.55 | 0 | 2 | 0 | 0 | 0 |
1012 | 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 | 0.12 | 0.13 | 0.13 | 0.10 | 0.10 | 252 | 0.00 | 85.71 | 41.07 | 1.11 | 1 | 2.4 | 1.26 | 0 | 1 | 0 | 1 | 0 |
369 | exec - TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.11 | 0.11 | 0.17 | 0.17 | 0.09 | 0.09 | 252 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 1.82 | 0 | 2 | 0 | 0 | 0 |
370 | exec - TwoBodyJastrowRef.h:155-156 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.11 | 0.11 | 0.15 | 0.15 | 0.09 | 0.09 | 252 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 1.64 | 0 | 2 | 0 | 0 | 0 |
1031 | 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 | 0.09 | 0.09 | 0.12 | 0.12 | 0.08 | 0.08 | 252 | 0.00 | 33.33 | 16.67 | 1 | 1.73 | 6.4 | 1.56 | 0 | 2 | 0 | 0 | 0 |
1037 | exec - inner_product.hpp:82-83 | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.08 | 0.08 | 0.13 | 0.13 | 0.07 | 0.07 | 252 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 1.88 | 0 | 2 | 0 | 0 | 0 |
408 | exec - BsplineFunctor.h:246-260 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Innermost | 0.08 | 0.08 | 0.14 | 0.14 | 0.07 | 0.07 | 252 | 0.00 | 100 | 46.97 | 1 | 1.68 | 2.29 | 2.1 | 0 | 1 | 0 | 0 | 1 |
88 | exec - NonLocalPP.hpp:126-135 [...] | qmcplusplus::NonLocalPP<double>::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | InBetween | 0.08 | 0.09 | 0.13 | 0.14 | 0.07 | 0.08 | 252 | 0.00 | 0 | 11.7 | 2.48 | 1 | 12.15 | 1.9 | NA | NA | NA | NA | NA |
349 | exec - BsplineFunctor.h:303-338 | qmcplusplus::BsplineFunctor<double>::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | Single | 0.05 | 0.05 | 0.08 | 0.08 | 0.04 | 0.04 | 252 | 0.00 | 100 | 48.33 | 1.12 | 1.63 | 2.13 | 1.99 | 1 | 2 | 0 | 3 | 1 |
373 | exec - stl_numeric.h:140-141 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.04 | 0.04 | 0.06 | 0.06 | 0.03 | 0.03 | 251 | 0.00 | 100 | 50 | 1 | 1.78 | 2 | 2.15 | 0 | 1 | 0 | 0 | 0 |
330 | exec - BsplineFunctor.h:236-241 [...] | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Innermost | 0.03 | 0.03 | 0.05 | 0.05 | 0.03 | 0.03 | 251 | 0.00 | 93.33 | 47.08 | 1.54 | 1 | 3.08 | 2.01 | 1 | 1 | 0 | 0 | 3 |
1056 | exec - stl_algobase.h:911-912 | miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::resize(int, int) | Single | 0.03 | 0.03 | 0.04 | 0.04 | 0.03 | 0.03 | 252 | 0.00 | 100 | 25 | 1 | 1 | 4 | 1.52 | 0 | 1 | 0 | 0 | 0 |
391 | exec - TwoBodyJastrowRef.h:393-398 | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ... | Innermost | 0.03 | 0.03 | 0.05 | 0.05 | 0.02 | 0.02 | 250 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 2.3 | 0 | 7 | 0 | 0 | 0 |
335 | exec - stl_algobase.h:923-924 | qmcplusplus::Vector<double, std::allocator<double> >::resize(unsigned long, double) | Single | 0.03 | 0.03 | 0.04 | 0.04 | 0.02 | 0.02 | 252 | 0.00 | 100 | 50 | 1 | 1 | 2 | 1.58 | 0 | 1 | 0 | 0 | 0 |
1029 | 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 | 0.02 | 0.02 | 0.05 | 0.05 | 0.02 | 0.02 | 250 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 2.51 | 0 | 2 | 0 | 0 | 0 |
397 | 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 | 0.02 | 0.05 | 0.05 | 0.02 | 0.02 | 234 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 2.77 | 0 | 2 | 0 | 0 | 0 |
395 | 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 | 0.02 | 0.06 | 0.06 | 0.01 | 0.01 | 231 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 3.73 | 0 | 2 | 0 | 0 | 0 |
399 | 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 | 0.02 | 0.05 | 0.05 | 0.01 | 0.01 | 233 | 0.00 | 100 | 50 | 1 | 1.54 | 2 | 3.16 | 0 | 2 | 0 | 0 | 0 |
289 | exec - OneBodyJastrowRef.h:186-187 | miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&) | Single | 0.01 | 0.01 | 0.03 | 0.03 | 0.01 | 0.01 | 221 | 0.00 | 100 | 50 | 1 | 1.67 | 2 | 2.86 | 0 | 2 | 0 | 0 | 0 |
401 | 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 | 0.01 | 0.03 | 0.03 | 0.01 | 0.01 | 228 | 0.00 | 100 | 50 | 1 | 1.67 | 2 | 3.12 | 0 | 2 | 0 | 0 | 0 |
405 | exec - TwoBodyJastrowRef.h:107-132 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | Outermost | 0.01 | 2.06 | 0.04 | 1.98 | 0.01 | 1.76 | 218 | 0.00 | 25 | 14.12 | 2.18 | 1.97 | 14.25 | 3.08 | NA | NA | NA | NA | NA |
406 | exec - BsplineFunctor.h:236-260 [...] | miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&) | InBetween | 0.01 | 2.04 | 0.03 | 1.97 | 0.01 | 1.75 | 209 | 0.00 | 47.66 | 22.56 | 1.3 | 1.37 | 5.28 | 2.68 | NA | NA | NA | NA | NA |
927 | 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 | 0.01 | 10.45 | 0.03 | 9.45 | 0.01 | 8.95 | 202 | 0.00 | 23.68 | 16.2 | 1.61 | 2.4 | 8.74 | 2.35 | NA | NA | NA | NA | NA |