Name | Module | Coverage (%) | Time (s) |
►miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)+ | libqmcwfs.so | 21.64 | 24.11 |
►Loop 673 - einspline_spo_ref.hpp:175-176 - libqmcwfs.so+ | | 21.62 | 24.08 |
►Loop 675 - MultiBsplineRef.hpp:63-71 - libqmcwfs.so+ | | 21.62 | 24.08 |
►Loop 674 - MultiBsplineRef.hpp:64-71 - libqmcwfs.so+ | | 21.62 | 24.08 |
○Loop 676 - MultiBsplineRef.hpp:68-71 - libqmcwfs.so | | 21.62 | 24.08 |
►void miniqmcreference::MultiBsplineEvalRef::evaluate_vgh(qmcplusplus::bspline_traits::SplineType const*, double, double, double, double*, double*, double*, unsigned long)+ | libqmcwfs.so | 20.85 | 23.23 |
►Loop 680 - MultiBsplineRef.hpp:226-262 - libqmcwfs.so+ | | 19.72 | 21.97 |
►Loop 679 - MultiBsplineRef.hpp:227-262 - libqmcwfs.so+ | | 19.72 | 21.97 |
○Loop 678 - MultiBsplineRef.hpp:239-262 - libqmcwfs.so | | 19.72 | 21.97 |
○Loop 677 - MultiBsplineRef.hpp:276-286 - libqmcwfs.so | | 1.09 | 1.22 |
○mkl_blas_avx512_dgemm_kernel_nocopy_TN_b1 | libmkl_avx512.so.2 | 13.34 | 14.86 |
○mkl_blas_avx512_dgemm_kernel_0 | libmkl_avx512.so.2 | 13 | 14.48 |
►qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+ | libqmcparticle_omptarget.so | 8.28 | 9.23 |
►Loop 439 - SoaDistanceTableABOMPTarget.h:214-228 - libqmcparticle_omptarget.so+ | | 8.26 | 9.2 |
►Loop 438 - ParticleBConds3DSoa.h:280-298 - libqmcparticle_omptarget.so+ | | 8.26 | 9.2 |
○Loop 440 - ParticleBConds3DSoa.h:280-298 - libqmcparticle_omptarget.so | | 8.26 | 9.2 |
►qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+ | libqmcparticle_omptarget.so | 6.09 | 6.79 |
○Loop 184 - SoaDistanceTableAAOMPTarget.h:440-442 - libqmcparticle_omptarget.so | | 6.09 | 6.78 |
○unknown_function | Unknown module | 2.82 | 3.14 |
►void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+ | libqmcparticle_omptarget.so | 1.81 | 2.02 |
○Loop 479 - ParticleBConds3DSoa.h:237-255 - libqmcparticle_omptarget.so | | 1.8 | 2.01 |
►miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+ | libqmcwfs.so | 1.52 | 1.7 |
►Loop 556 - TwoBodyJastrowRef.h:107-132 - libqmcwfs.so+ | | 1.49 | 1.66 |
►Loop 557 - BsplineFunctor.h:232-260 - libqmcwfs.so+ | | 1.49 | 1.66 |
○Loop 558 - BsplineFunctor.h:236-241 - libqmcwfs.so | | 1.46 | 1.63 |
○Loop 559 - BsplineFunctor.h:249-260 - libqmcwfs.so | | 0.03 | 0.03 |
○mkl_blas_avx512_dgemv_t_intrinsics | libmkl_avx512.so.2 | 1.36 | 1.52 |
►miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+ | libqmcwfs.so | 1.09 | 1.21 |
►Loop 487 - TwoBodyJastrowRef.h:320-355 - libqmcwfs.so+ | | 0.66 | 0.74 |
○Loop 489 - TwoBodyJastrowRef.h:344-347 - libqmcwfs.so | | 0.66 | 0.74 |
○Loop 490 - TwoBodyJastrowRef.h:324-331 - libqmcwfs.so | | 0.39 | 0.44 |
►miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+ | libqmcwfs.so | 1.05 | 1.18 |
►Loop 681 - einspline_spo_ref.hpp:219-227 - libqmcwfs.so+ | | 1.04 | 1.16 |
○Loop 682 - einspline_spo_ref.hpp:223-227 - libqmcwfs.so | | 1.04 | 1.16 |
○Loop 683 - einspline_spo_ref.hpp:206-207 - libqmcwfs.so | | 0.01 | 0.01 |
○mkl_blas_avx512_dgemv_n_intrinsics | libmkl_avx512.so.2 | 0.92 | 1.03 |
►miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+ | libqmcwfs.so | 0.9 | 1 |
►Loop 726 - DiracDeterminantRef.cpp:173-178 - libqmcwfs.so+ | | 0.9 | 1 |
○Loop 727 - OperatorTags.h:63-94 - libqmcwfs.so | | 0.59 | 0.66 |
○Loop 728 - inner_product.hpp:82-83 - libqmcwfs.so | | 0.31 | 0.34 |
►miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | libqmcwfs.so | 0.8 | 0.89 |
►Loop 547 - TwoBodyJastrow.h:150-157 - libqmcwfs.so+ | | 0.39 | 0.44 |
○Loop 548 - TwoBodyJastrow.h:155-156 - libqmcwfs.so | | 0.39 | 0.44 |
►Loop 550 - TwoBodyJastrowRef.h:269-271 - libqmcwfs.so+ | | 0.29 | 0.33 |
○Loop 551 - BsplineFunctor.h:291-298 - libqmcwfs.so | | 0.25 | 0.28 |
○Loop 552 - BsplineFunctor.h:305-336 - libqmcwfs.so | | 0.04 | 0.05 |
○Loop 549 - stl_numeric.h:140-141 - libqmcwfs.so | | 0.08 | 0.08 |
○mkl_blas_avx512_dgemm_kernel_nocopy_TN_b0 | libmkl_avx512.so.2 | 0.8 | 0.89 |
○unknown_kernel_region | kernel | 0.45 | 0.5 |
►miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+ | libqmcwfs.so | 0.39 | 0.44 |
○Loop 731 - OperatorTags.h:63-94 - libqmcwfs.so | | 0.39 | 0.44 |
►qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+ | libqmcwfs.so | 0.32 | 0.35 |
►Loop 40 - SPOSet.h:83-88 - libqmcwfs.so+ | | 0.31 | 0.34 |
○Loop 41 - inner_product.hpp:82-83 - libqmcwfs.so | | 0.31 | 0.34 |
►miniqmcreference::TwoBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet const&, int, double const*, double*, double*, double*, bool)+ | libqmcwfs.so | 0.25 | 0.28 |
►Loop 484 - TwoBodyJastrowRef.h:269-271 - libqmcwfs.so+ | | 0.24 | 0.26 |
○Loop 485 - BsplineFunctor.h:291-298 - libqmcwfs.so | | 0.22 | 0.24 |
○Loop 486 - BsplineFunctor.h:305-336 - libqmcwfs.so | | 0.02 | 0.02 |
○mkl_lapack_xdlaswp | libmkl_core.so.2 | 0.22 | 0.25 |
►qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+ | libqmcwfs.so | 0.22 | 0.24 |
►Loop 696 - inner_product.hpp:210-212 - libqmcwfs.so+ | | 0.22 | 0.24 |
○Loop 695 - inner_product.hpp:211-212 - libqmcwfs.so | | 0.22 | 0.24 |
►qmcplusplus::SoaDistanceTableAAOMPTarget::evaluate(qmcplusplus::ParticleSet&)+ | libqmcparticle_omptarget.so | 0.21 | 0.23 |
►Loop 260 - SoaDistanceTableAAOMPTarget.h:184-187 - libqmcparticle_omptarget.so+ | | 0.21 | 0.23 |
○Loop 261 - ParticleBConds3DSoa.h:237-255 - libqmcparticle_omptarget.so | | 0.21 | 0.23 |
►miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+ | libqmcwfs.so | 0.18 | 0.19 |
►Loop 732 - DiracDeterminantRef.cpp:247-252 - libqmcwfs.so+ | | 0.17 | 0.19 |
○Loop 734 - OperatorTags.h:63-94 - libqmcwfs.so | | 0.15 | 0.17 |
○Loop 733 - inner_product.hpp:82-83 - libqmcwfs.so | | 0.02 | 0.02 |
○mkl_blas_avx512_dgemm_kernel_nocopy_NN_b0 | libmkl_avx512.so.2 | 0.16 | 0.18 |
►miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+ | libqmcwfs.so | 0.13 | 0.15 |
○Loop 440 - TwoBodyJastrowRef.h:423-431 - libqmcwfs.so | | 8.26 | 9.2 |
►Loop 450 - TwoBodyJastrowRef.h:254-398 - libqmcwfs.so+ | | 0.12 | 0.12 |
►Loop 456 - TwoBodyJastrowRef.h:268-398 - libqmcwfs.so+ | | 0.12 | 0.12 |
►Loop 455 - TwoBodyJastrowRef.h:377-383 - libqmcwfs.so+ | | 0.05 | 0.05 |
○Loop 462 - TwoBodyJastrowRef.h:381-382 - libqmcwfs.so | | 0.05 | 0.05 |
►Loop 459 - TwoBodyJastrowRef.h:361-398 - libqmcwfs.so+ | | 0.04 | 0.04 |
○Loop 460 - TwoBodyJastrowRef.h:397-398 - libqmcwfs.so | | 0.04 | 0.04 |
►Loop 454 - TwoBodyJastrowRef.h:269-271 - libqmcwfs.so+ | | 0.02 | 0.02 |
○Loop 465 - BsplineFunctor.h:291-298 - libqmcwfs.so | | 0.02 | 0.02 |
○Loop 463 - TwoBodyJastrowRef.h:375-376 - libqmcwfs.so | | 0.01 | 0.01 |
►qmcplusplus::TinyVector qmcplusplus::simd::dot(double const*, qmcplusplus::TinyVector const*, int)+ | libqmcwfs.so | 0.13 | 0.14 |
○Loop 658 - inner_product.hpp:155-155 - libqmcwfs.so | | 0.13 | 0.14 |
○mkl_blas_avx512_dgemm_dcopy_right8_ea | libmkl_avx512.so.2 | 0.11 | 0.12 |
►miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | libqmcwfs.so | 0.11 | 0.12 |
○Loop 730 - inner_product.hpp:82-83 - libqmcwfs.so | | 0.09 | 0.1 |
►main._omp_fn.1+ | exec | 0.09 | 0.1 |
►Loop 38 - - exec+ | | 0.32 | 0.35 |
○Loop 41 - - exec | | 0.31 | 0.34 |
►Loop 40 - - exec+ | | 0.01 | 0.01 |
►Loop 70 - - exec+ | | 0.01 | 0.01 |
○Loop 75 - - exec | | 0.01 | 0.01 |
○mkl_blas_avx512_dtrsm_kernel_ll_0 | libmkl_avx512.so.2 | 0.07 | 0.08 |
►miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+ | libqmcwfs.so | 0.06 | 0.07 |
►Loop 639 - OneBodyJastrowRef.h:134-155 - libqmcwfs.so+ | | 0.05 | 0.05 |
►Loop 641 - OneBodyJastrowRef.h:143-146 - libqmcwfs.so+ | | 0.05 | 0.05 |
○Loop 642 - BsplineFunctor.h:236-241 - libqmcwfs.so | | 0.05 | 0.05 |
○gomp_team_barrier_wait_end | libgomp.so.1.0.0 | 0.06 | 0.06 |
○mkl_blas_avx512_dgemm_dcopy_down24_ea | libmkl_avx512.so.2 | 0.04 | 0.05 |
►miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | libqmcwfs.so | 0.04 | 0.05 |
►Loop 597 - OneBodyJastrow.h:188-194 - libqmcwfs.so+ | | 0.03 | 0.03 |
○Loop 599 - OneBodyJastrow.h:192-193 - libqmcwfs.so | | 0.03 | 0.03 |
○Loop 600 - OneBodyJastrow.h:186-187 - libqmcwfs.so | | 0.01 | 0.01 |
○mkl_blas_avx512_dgemm_kernel_nocopy_NN_b1 | libmkl_avx512.so.2 | 0.03 | 0.03 |
○__dynamic_cast | libstdc++.so.6.0.31 | 0.03 | 0.03 |
○qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | libqmcwfs.so | 0.03 | 0.03 |
○f64xsubf128 | libm-2.28.so | 0.03 | 0.03 |
►qmcplusplus::TimerType::stop()+ | libqmcutil.so | 0.03 | 0.03 |
○Loop 40 - NewTimer.cpp:99-101 - libqmcutil.so | | 0.01 | 0.01 |
○__cxxabiv1::__vmi_class_type_info::__do_dyncast(long, __cxxabiv1::__class_type_info::__sub_kind, __cxxabiv1::__class_type_info const*, void const*, __cxxabiv1::__class_type_info const*, void const*, __cxxabiv1::__class_type_info::__dyncast_result&) const | libstdc++.so.6.0.31 | 0.02 | 0.02 |
►miniqmcreference::OneBodyJastrowRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particl...+ | libqmcwfs.so | 0.02 | 0.02 |
►Loop 611 - OneBodyJastrowRef.h:109-237 - libqmcwfs.so+ | | 0.02 | 0.02 |
►Loop 610 - OneBodyJastrow.h:188-194 - libqmcwfs.so+ | | 0.02 | 0.02 |
○Loop 612 - OneBodyJastrow.h:193-193 - libqmcwfs.so | | 0.02 | 0.02 |
►qmcplusplus::Vector, std::allocator > >::resize(unsigned long, qmcplusplus::TinyVector)+ | libqmcwfs.so | 0.02 | 0.02 |
○Loop 244 - stl_algobase.h:918-919 - libqmcwfs.so | | 0.02 | 0.02 |
○qmcplusplus::TimerType::start() | libqmcutil.so | 0.02 | 0.02 |
○mkl_blas_avx512_xdgemv | libmkl_avx512.so.2 | 0.02 | 0.02 |
►qmcplusplus::SoaDistanceTableABOMPTarget::update(int)+ | libqmcparticle_omptarget.so | 0.02 | 0.02 |
○Loop 290 - stl_algo.h:731-757 - libqmcparticle_omptarget.so | | 0.02 | 0.02 |
○qmcplusplus::ParticleSet::makeMove(int, qmcplusplus::TinyVector const&, bool) | libqmcparticle.so | 0.02 | 0.02 |
►miniqmcreference::OneBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet&, int, double const*)+ | libqmcwfs.so | 0.01 | 0.01 |
○Loop 596 - OneBodyJastrowRef.h:214-218 - libqmcwfs.so | | 0.01 | 0.01 |
○qmcplusplus::OneBodyJastrow >::evalGrad(qmcplusplus::ParticleSet&, int) | libqmcwfs.so | 0.01 | 0.01 |
○DGEMV | libmkl_intel_lp64.so.2 | 0.01 | 0.01 |
○mkl_blas_avx512_d_generic_fullacopybcopy | libmkl_avx512.so.2 | 0.01 | 0.01 |
○mkl_blas_avx512_xdgemm_nocopy_driver | libmkl_avx512.so.2 | 0.01 | 0.01 |
○__cxxabiv1::__si_class_type_info::__do_dyncast(long, __cxxabiv1::__class_type_info::__sub_kind, __cxxabiv1::__class_type_info const*, void const*, __cxxabiv1::__class_type_info const*, void const*, __cxxabiv1::__class_type_info::__dyncast_result&) const | libstdc++.so.6.0.31 | 0.01 | 0.01 |
○gomp_barrier_wait_end | libgomp.so.1.0.0 | 0.01 | 0.01 |
○qmcplusplus::SoaDistanceTableABOMPTarget::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector const&, int, bool) | libqmcparticle_omptarget.so | 0.01 | 0.01 |
○qmcplusplus::ParticleSet::update(bool) | libqmcparticle.so | 0 | 0 |
○qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const | libqmcwfs.so | 0 | 0 |
○qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | libqmcwfs.so | 0 | 0 |
○qmcplusplus::TinyVector qmcplusplus::CrystalLattice::toUnit_floor(qmcplusplus::TinyVector const&) const | libqmcwfs.so | 0 | 0 |
○mkl_blas_avx512_xdger | libmkl_avx512.so.2 | 0 | 0 |