Name | Module | Coverage (%) | Time (s) |
►miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)+ | exec | 27.12 | 21.59 |
►Loop 765 - MultiBsplineRef.hpp:42-71 - exec+ | | 27.03 | 21.52 |
►Loop 766 - MultiBsplineRef.hpp:63-71 - exec+ | | 27.03 | 21.52 |
►Loop 767 - MultiBsplineRef.hpp:64-71 - exec+ | | 27.03 | 21.52 |
○Loop 768 - MultiBsplineRef.hpp:68-70 - exec | | 27.03 | 21.52 |
○Loop 764 - einspline_spo_ref.hpp:183-187 - exec | | 0.01 | 0.01 |
►miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+ | exec | 17.97 | 14.31 |
►Loop 771 - MultiBsplineRef.hpp:187-286 - exec+ | | 15.66 | 12.46 |
►Loop 773 - MultiBsplineRef.hpp:226-262 - exec+ | | 15.28 | 12.16 |
►Loop 774 - MultiBsplineRef.hpp:227-262 - exec+ | | 15.28 | 12.16 |
►Loop 778 - MultiBsplineRef.hpp:242-262 - exec+ | | 15.28 | 12.16 |
○Loop 780 - MultiBsplineRef.hpp:242-262 - exec | | 7.74 | 6.16 |
○Loop 779 - MultiBsplineRef.hpp:242-261 - exec | | 7.54 | 6 |
○Loop 772 - MultiBsplineRef.hpp:276-286 - exec | | 0.38 | 0.3 |
►Loop 769 - einspline_spo_ref.hpp:219-227 - exec+ | | 0.82 | 0.65 |
○Loop 770 - einspline_spo_ref.hpp:223-227 - exec | | 0.82 | 0.65 |
○mkl_blas_avx512_dgemm_kernel_0 | libmkl_avx512.so.2 | 11.83 | 9.41 |
○mkl_blas_avx512_dgemm_kernel_nocopy_TN_b1 | libmkl_avx512.so.2 | 11.17 | 8.89 |
►qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+ | exec | 9.92 | 7.89 |
►Loop 1986 - SoaDistanceTableABOMPTarget.h:214-228 - exec+ | | 9.88 | 7.86 |
►Loop 1988 - SoaDistanceTableABOMPTarget.h:215-228 - exec+ | | 9.88 | 7.86 |
○Loop 1987 - SoaDistanceTableABOMPTarget.h:228-228 - exec | | 9.88 | 7.86 |
○Loop 1989 - SoaDistanceTableABOMPTarget.h:194-196 - exec | | 0.01 | 0 |
►qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+ | exec | 5.17 | 4.12 |
○Loop 1742 - SoaDistanceTableAAOMPTarget.h:440-442 - exec | | 5.17 | 4.12 |
○kmp_flag_64::wait(kmp_info*, int, void*) | libiomp5.so | 2.15 | 1.71 |
►void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+ | exec | 1.76 | 1.4 |
○Loop 1244 - ParticleBConds3DSoa.h:235-256 - exec | | 1.75 | 1.39 |
►__intel_avx_rep_memset+ | exec | 1.55 | 1.23 |
○Loop 2280 - - exec | | 0.91 | 0.72 |
►qmcplusplus::BsplineFunctor::evaluateV(int, int, int, double const*, double*) const+ | exec | 1.38 | 1.09 |
○Loop 274 - BsplineFunctor.h:236-241 - exec | | 1.29 | 1.02 |
○Loop 272 - BsplineFunctor.h:246-260 - exec | | 0.06 | 0.05 |
○mkl_blas_avx512_dgemv_t_intrinsics | libmkl_avx512.so.2 | 1.22 | 0.97 |
►miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+ | exec | 0.93 | 0.74 |
►Loop 295 - TwoBodyJastrowRef.h:324-349 - exec+ | | 0.67 | 0.53 |
○Loop 297 - TwoBodyJastrowRef.h:342-347 - exec | | 0.67 | 0.53 |
○Loop 299 - TwoBodyJastrowRef.h:324-331 - exec | | 0.23 | 0.18 |
○mkl_blas_avx512_dgemv_n_intrinsics | libmkl_avx512.so.2 | 0.91 | 0.72 |
○mkl_blas_avx512_dgemm_kernel_nocopy_TN_b0 | libmkl_avx512.so.2 | 0.87 | 0.69 |
►miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+ | exec | 0.66 | 0.52 |
►Loop 883 - inner_product.hpp:82-155 - exec+ | | 0.66 | 0.52 |
○Loop 885 - inner_product.hpp:155-155 - exec | | 0.43 | 0.34 |
○Loop 887 - inner_product.hpp:82-83 - exec | | 0.23 | 0.18 |
○unknown_function | Unknown module | 0.64 | 0.51 |
○unknown_kernel_region | kernel | 0.61 | 0.48 |
►miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | exec | 0.53 | 0.42 |
○Loop 287 - TwoBodyJastrowRef.h:155-156 - exec | | 0.14 | 0.11 |
○Loop 289 - TwoBodyJastrowRef.h:155-156 - exec | | 0.14 | 0.11 |
○Loop 291 - TwoBodyJastrowRef.h:155-156 - exec | | 0.13 | 0.1 |
○Loop 293 - stl_numeric.h:126-127 - exec | | 0.08 | 0.06 |
►qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+ | exec | 0.5 | 0.4 |
○Loop 271 - BsplineFunctor.h:291-297 - exec | | 0.37 | 0.29 |
○Loop 269 - BsplineFunctor.h:303-338 - exec | | 0.1 | 0.08 |
►miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | exec | 0.45 | 0.35 |
○Loop 873 - inner_product.hpp:155-155 - exec | | 0.32 | 0.25 |
○Loop 876 - inner_product.hpp:82-83 - exec | | 0.09 | 0.07 |
►miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+ | exec | 0.44 | 0.35 |
○Loop 872 - inner_product.hpp:155-155 - exec | | 0.44 | 0.35 |
►qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+ | exec | 0.32 | 0.25 |
►Loop 781 - inner_product.hpp:82-83 - exec+ | | 0.31 | 0.24 |
○Loop 783 - inner_product.hpp:82-83 - exec | | 0.31 | 0.24 |
○__intel_avx_rep_memcpy | exec | 0.23 | 0.18 |
►miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+ | exec | 0.16 | 0.13 |
►Loop 304 - TwoBodyJastrowRef.h:268-420 - exec+ | | 0.16 | 0.09 |
►Loop 305 - stl_algobase.h:200-754 - exec+ | | 0.16 | 0.09 |
○Loop 306 - TwoBodyJastrowRef.h:393-398 - exec | | 0.04 | 0.03 |
○Loop 314 - TwoBodyJastrowRef.h:381-382 - exec | | 0.03 | 0.02 |
○Loop 316 - TwoBodyJastrowRef.h:375-376 - exec | | 0.03 | 0.02 |
○Loop 310 - TwoBodyJastrowRef.h:381-382 - exec | | 0.02 | 0.01 |
○Loop 319 - TwoBodyJastrowRef.h:269-274 - exec | | 0.01 | 0 |
○Loop 312 - TwoBodyJastrowRef.h:381-382 - exec | | 0.01 | 0 |
○Loop 318 - stl_numeric.h:126-127 - exec | | 0.01 | 0 |
○Loop 308 - TwoBodyJastrowRef.h:388-391 - exec | | 0.01 | 0.01 |
○mkl_lapack_xdlaswp | libmkl_core.so.2 | 0.11 | 0.09 |
►miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+ | exec | 0.11 | 0.08 |
►Loop 866 - inner_product.hpp:82-155 - exec+ | | 0.11 | 0.08 |
○Loop 870 - inner_product.hpp:155-155 - exec | | 0.08 | 0.06 |
○Loop 868 - inner_product.hpp:82-83 - exec | | 0.03 | 0.02 |
►miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | exec | 0.1 | 0.08 |
○Loop 212 - OneBodyJastrowRef.h:186-187 - exec | | 0.03 | 0.02 |
○Loop 202 - stl_numeric.h:126-127 - exec | | 0.02 | 0.01 |
○Loop 207 - OneBodyJastrowRef.h:192-193 - exec | | 0.01 | 0.01 |
○Loop 208 - OneBodyJastrowRef.h:192-193 - exec | | 0.01 | 0.01 |
○mkl_blas_avx512_dgemm_kernel_nocopy_NN_b0 | libmkl_avx512.so.2 | 0.08 | 0.06 |
►qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+ | exec | 0.08 | 0.06 |
►Loop 851 - inner_product.hpp:210-212 - exec+ | | 0.08 | 0.06 |
►Loop 852 - inner_product.hpp:210-212 - exec+ | | 0.08 | 0.06 |
►Loop 853 - inner_product.hpp:210-212 - exec+ | | 0.08 | 0.06 |
○Loop 854 - inner_product.hpp:211-212 - exec | | 0.08 | 0.06 |
○mkl_blas_avx512_dtrsm_kernel_ll_0 | libmkl_avx512.so.2 | 0.08 | 0.06 |
○qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | exec | 0.08 | 0.06 |
○__kmp_get_global_thread_id_reg | libiomp5.so | 0.07 | 0.05 |
○mkl_blas_avx512_dgemm_dcopy_right8_ea | libmkl_avx512.so.2 | 0.06 | 0.04 |
○mkl_blas_avx512_dgemm_kernel_nocopy_NN_b1 | libmkl_avx512.so.2 | 0.03 | 0.02 |
○mkl_blas_avx512_dgemm_dcopy_down24_ea | libmkl_avx512.so.2 | 0.03 | 0.02 |
○__libm_exp_z0 | exec | 0.03 | 0.02 |
○__kmp_api_omp_get_level | libiomp5.so | 0.03 | 0.02 |
○kmp_flag_native::notdone_check() | libiomp5.so | 0.03 | 0.02 |
○_dl_update_slotinfo | ld-2.28.so | 0.03 | 0.02 |
○__dynamic_cast | libstdc++.so.6.0.25 | 0.03 | 0.02 |
►main.extracted.110+ | exec | 0.03 | 0.02 |
►Loop 24 - new_allocator.h:101-125 - exec+ | | 0.03 | 0.02 |
►Loop 27 - miniqmc.cpp:425-461 - exec+ | | 0.03 | 0.02 |
○Loop 28 - miniqmc.cpp:429-458 - exec | | 0.03 | 0.02 |
►qmcplusplus::TimerType::stop()+ | exec | 0.03 | 0.02 |
○Loop 1455 - NewTimer.cpp:99-100 - exec | | 0.01 | 0 |
○qmcplusplus::RealSpacePositionsOMPTarget::getAllParticlePos() const | exec | 0.03 | 0.02 |
○__tls_get_addr | ld-2.28.so | 0.03 | 0.02 |
○__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.6.0.25 | 0.02 | 0.01 |
○miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | exec | 0.02 | 0.01 |
►qmcplusplus::Vector >::resize(unsigned long, double)+ | exec | 0.02 | 0.01 |
○Loop 254 - stl_algobase.h:752-754 - exec | | 0.02 | 0.01 |
○miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | exec | 0.02 | 0.01 |
○qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | exec | 0.02 | 0.01 |
○qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | exec | 0.02 | 0.01 |
○mkl_blas_avx512_xdger | libmkl_avx512.so.2 | 0.01 | 0.01 |
○__libm_logl_ex | exec | 0.01 | 0.01 |
○qmcplusplus::SoaDistanceTableABOMPTarget::update(int) | exec | 0.01 | 0.01 |
○qmcplusplus::SoaDistanceTableABOMPTarget::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector const&, int, bool) | exec | 0.01 | 0.01 |
○qmcplusplus::SoaDistanceTableAAOMPTarget::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector const&, int, bool) | exec | 0.01 | 0.01 |
○qmcplusplus::TimerType::start() | exec | 0.01 | 0.01 |
○qmcplusplus::VirtualParticleSet::makeMoves(qmcplusplus::ParticleSet const&, int, std::vector, std::allocator > > const&, bool, int) | exec | 0.01 | 0.01 |
►miniqmcreference::DiracDeterminantRef >::resize(int, int)+ | exec | 0.01 | 0.01 |
○Loop 895 - stl_algobase.h:740-742 - exec | | 0.01 | 0.01 |
○miniqmcreference::DiracDeterminantRef >::acceptMove(qmcplusplus::ParticleSet&, int) | exec | 0.01 | 0.01 |
►miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+ | exec | 0.01 | 0.01 |
►Loop 234 - OneBodyJastrowRef.h:109-194 - exec+ | | 0.02 | 0 |
○Loop 240 - OneBodyJastrowRef.h:192-193 - exec | | 0.01 | 0 |
○Loop 239 - OneBodyJastrowRef.h:192-193 - exec | | 0.01 | 0 |
○mkl_lapack_dtrtri | libmkl_intel_thread.so.2 | 0.01 | 0 |
○DGEMV | libmkl_intel_lp64.so.2 | 0.01 | 0 |
○DGER | libmkl_intel_lp64.so.2 | 0.01 | 0 |
○mkl_blas_dger | libmkl_intel_thread.so.2 | 0.01 | 0 |
○mkl_blas_dgemv | libmkl_intel_thread.so.2 | 0.01 | 0 |
○mkl_blas_xdger | libmkl_core.so.2 | 0.01 | 0 |
○mkl_serv_cpu_detect | libmkl_core.so.2 | 0.01 | 0 |
○mkl_blas_avx512_damax | libmkl_avx512.so.2 | 0.01 | 0 |
○mkl_blas_avx512_d_generic_fullacopybcopy | libmkl_avx512.so.2 | 0.01 | 0 |
○mkl_blas_avx512_xdgemv | libmkl_avx512.so.2 | 0.01 | 0 |
○mkl_blas_avx512_dgemv_n_intrinsics@plt | libmkl_avx512.so.2 | 0.01 | 0 |
○__kmp_get_ancestor_thread_num | libiomp5.so | 0.01 | 0 |
○__kmp_api_omp_in_parallel | libiomp5.so | 0.01 | 0 |
○__libm_log_l9 | exec | 0.01 | 0 |
○qmcplusplus::RealSpacePositionsOMPTarget::setOneParticlePos(qmcplusplus::TinyVector const&, unsigned long) | exec | 0.01 | 0 |
○__errno_location | libpthread-2.28.so | 0.01 | 0 |
○qmcplusplus::ParticleSet::acceptMove(int) | exec | 0.01 | 0 |
○qmcplusplus::ParticleSet::computeNewPosDistTables(int, qmcplusplus::TinyVector const&, bool) | exec | 0.01 | 0 |
○qmcplusplus::ParticleSet::makeMove(int, qmcplusplus::TinyVector const&, bool) | exec | 0.01 | 0 |
►qmcplusplus::ParticleSet::update(bool)+ | exec | 0.01 | 0 |
○Loop 1090 - ParticleSet.cpp:242-243 - exec | | 0.01 | 0 |
○qmcplusplus::Vector > >::resize(unsigned long, double) | exec | 0.01 | 0 |
○__GI___sched_yield | libc-2.28.so | 0.01 | 0 |
○qmcplusplus::BsplineAllocator >::setCoefficientsForOrbitals(int, int, Array&, multi_UBspline_3d_d*) [clone .extracted] | exec | 0.01 | 0 |
○__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.6.0.25 | 0.01 | 0 |
►miniqmcreference::OneBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet&, int, double const*)+ | exec | 0.01 | 0 |
○Loop 268 - OneBodyJastrowRef.h:214-219 - exec | | 0.01 | 0 |
○update_get_addr | ld-2.28.so | 0.01 | 0 |
○miniqmcreference::OneBodyJastrowRef >::evalGrad(qmcplusplus::ParticleSet&, int) | exec | 0.01 | 0 |
○qmcplusplus::WaveFunction::acceptMove(qmcplusplus::ParticleSet&, int) | exec | 0.01 | 0 |
►qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int)+ | exec | 0.01 | 0 |
○Loop 76 - WaveFunction.cpp:185-188 - exec | | 0.01 | 0 |
○.plt.sec@start | libiomp5.so | 0.01 | 0 |
○unknown_function | exec | 0.01 | 0 |