Name | Module | Coverage (%) | Time (s) |
►miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)+ | exec | 22.43 | 24.64 |
►Loop 870 - MultiBsplineRef.hpp:42-71 - exec+ | | 22.37 | 24.56 |
►Loop 871 - MultiBsplineRef.hpp:63-71 - exec+ | | 22.37 | 24.56 |
►Loop 872 - MultiBsplineRef.hpp:64-71 - exec+ | | 22.37 | 24.56 |
○Loop 873 - MultiBsplineRef.hpp:68-70 - exec | | 22.37 | 24.56 |
○mkl_blas_avx512_dgemm_kernel_nocopy_TN_b1 | libmkl_avx512.so.2 | 15.61 | 17.14 |
○mkl_blas_avx512_dgemm_kernel_0 | libmkl_avx512.so.2 | 14.53 | 15.96 |
►miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+ | exec | 14.32 | 15.73 |
►Loop 876 - MultiBsplineRef.hpp:187-286 - exec+ | | 13.22 | 14.52 |
►Loop 878 - MultiBsplineRef.hpp:226-262 - exec+ | | 12.84 | 14.11 |
►Loop 879 - MultiBsplineRef.hpp:227-262 - exec+ | | 12.84 | 14.11 |
○Loop 880 - MultiBsplineRef.hpp:242-262 - exec | | 12.84 | 14.11 |
○Loop 877 - MultiBsplineRef.hpp:276-286 - exec | | 0.38 | 0.41 |
►Loop 874 - einspline_spo_ref.hpp:219-227 - exec+ | | 1.03 | 1.13 |
○Loop 875 - einspline_spo_ref.hpp:223-227 - exec | | 1.03 | 1.13 |
►qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+ | exec | 7.21 | 7.91 |
►Loop 2088 - SoaDistanceTableABOMPTarget.h:214-228 - exec+ | | 7.2 | 7.9 |
►Loop 2089 - SoaDistanceTableABOMPTarget.h:215-228 - exec+ | | 7.2 | 7.9 |
○Loop 2090 - SoaDistanceTableABOMPTarget.h:228-228 - exec | | 7.2 | 7.9 |
►qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+ | exec | 6.99 | 7.68 |
○Loop 1864 - SoaDistanceTableAAOMPTarget.h:440-442 - exec | | 6.97 | 7.66 |
►void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+ | exec | 2.2 | 2.42 |
○Loop 1370 - ParticleBConds3DSoa.h:235-256 - exec | | 2.19 | 2.4 |
►__intel_avx_rep_memset+ | exec | 1.98 | 2.17 |
○Loop 2345 - - exec | | 1.14 | 1.25 |
○kmp_flag_64::wait(kmp_info*, int, void*) | libiomp5.so | 1.73 | 1.89 |
○mkl_blas_avx512_dgemv_t_intrinsics | libmkl_avx512.so.2 | 1.55 | 1.7 |
►miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+ | exec | 1.28 | 1.41 |
►Loop 389 - TwoBodyJastrowRef.h:107-132 - exec+ | | 1.22 | 1.34 |
►Loop 390 - BsplineFunctor.h:229-260 - exec+ | | 1.22 | 1.34 |
○Loop 393 - BsplineFunctor.h:236-241 - exec | | 1.16 | 1.27 |
○Loop 391 - BsplineFunctor.h:246-260 - exec | | 0.06 | 0.07 |
►miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+ | exec | 1.13 | 1.24 |
○Loop 363 - TwoBodyJastrowRef.h:324-331 - exec | | 0.34 | 0.37 |
○Loop 357 - TwoBodyJastrowRef.h:342-347 - exec | | 0.26 | 0.29 |
○Loop 361 - TwoBodyJastrowRef.h:342-347 - exec | | 0.25 | 0.27 |
○Loop 359 - TwoBodyJastrowRef.h:342-347 - exec | | 0.25 | 0.28 |
►miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+ | exec | 1.08 | 1.18 |
►Loop 992 - inner_product.hpp:82-155 - exec+ | | 1.07 | 1.18 |
○Loop 994 - inner_product.hpp:155-155 - exec | | 0.71 | 0.78 |
○Loop 996 - inner_product.hpp:82-83 - exec | | 0.36 | 0.4 |
○mkl_blas_avx512_dgemv_n_intrinsics | libmkl_avx512.so.2 | 1.06 | 1.16 |
○mkl_blas_avx512_dgemm_kernel_nocopy_TN_b0 | libmkl_avx512.so.2 | 0.97 | 1.07 |
○unknown_function | Unknown module | 0.72 | 0.79 |
►miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | exec | 0.61 | 0.67 |
○Loop 351 - TwoBodyJastrowRef.h:155-156 - exec | | 0.2 | 0.22 |
○Loop 350 - TwoBodyJastrowRef.h:155-156 - exec | | 0.17 | 0.18 |
○Loop 352 - TwoBodyJastrowRef.h:155-156 - exec | | 0.13 | 0.14 |
○Loop 354 - stl_numeric.h:126-127 - exec | | 0.1 | 0.1 |
►miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+ | exec | 0.57 | 0.62 |
○Loop 981 - inner_product.hpp:155-155 - exec | | 0.56 | 0.62 |
►qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+ | exec | 0.54 | 0.59 |
○Loop 332 - BsplineFunctor.h:291-297 - exec | | 0.47 | 0.52 |
○Loop 330 - BsplineFunctor.h:303-338 - exec | | 0.06 | 0.06 |
○unknown_kernel_region | kernel | 0.53 | 0.58 |
►qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+ | exec | 0.36 | 0.39 |
►Loop 881 - inner_product.hpp:82-83 - exec+ | | 0.36 | 0.39 |
○Loop 883 - inner_product.hpp:82-83 - exec | | 0.36 | 0.39 |
►miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | exec | 0.32 | 0.35 |
○Loop 982 - inner_product.hpp:155-155 - exec | | 0.25 | 0.28 |
○Loop 985 - inner_product.hpp:82-83 - exec | | 0.06 | 0.07 |
○__intel_avx_rep_memcpy | exec | 0.31 | 0.33 |
►qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+ | exec | 0.27 | 0.3 |
►Loop 960 - inner_product.hpp:210-212 - exec+ | | 0.27 | 0.3 |
○Loop 962 - inner_product.hpp:211-212 - exec | | 0.17 | 0.19 |
○Loop 961 - inner_product.hpp:211-212 - exec | | 0.1 | 0.11 |
○pthread_spin_lock | libpthread-2.28.so | 0.21 | 0.23 |
○mkl_lapack_xdlaswp | libmkl_core.so.2 | 0.18 | 0.19 |
○mkl_blas_avx512_dgemm_kernel_nocopy_NN_b0 | libmkl_avx512.so.2 | 0.15 | 0.17 |
○mkl_blas_avx512_dgemm_dcopy_right8_ea | libmkl_avx512.so.2 | 0.13 | 0.14 |
○qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&) | exec | 0.1 | 0.11 |
►miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+ | exec | 0.09 | 0.1 |
►Loop 368 - TwoBodyJastrowRef.h:268-420 - exec+ | | 0.07 | 0.07 |
►Loop 370 - stl_algobase.h:752-754 - exec+ | | 0.07 | 0.07 |
○Loop 385 - TwoBodyJastrowRef.h:375-376 - exec | | 0.03 | 0.03 |
○Loop 374 - TwoBodyJastrowRef.h:397-398 - exec | | 0.02 | 0.02 |
○Loop 379 - TwoBodyJastrowRef.h:381-382 - exec | | 0.01 | 0.01 |
○Loop 383 - TwoBodyJastrowRef.h:381-382 - exec | | 0.01 | 0.01 |
►miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+ | exec | 0.08 | 0.09 |
○Loop 268 - OneBodyJastrowRef.h:186-187 - exec | | 0.03 | 0.03 |
○Loop 264 - OneBodyJastrowRef.h:192-193 - exec | | 0.02 | 0.02 |
○Loop 263 - OneBodyJastrowRef.h:192-193 - exec | | 0.01 | 0.01 |
○Loop 265 - OneBodyJastrowRef.h:192-193 - exec | | 0.01 | 0.01 |
►miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+ | exec | 0.08 | 0.08 |
►Loop 975 - inner_product.hpp:82-155 - exec+ | | 0.08 | 0.08 |
○Loop 979 - inner_product.hpp:155-155 - exec | | 0.05 | 0.05 |
○Loop 977 - inner_product.hpp:82-83 - exec | | 0.03 | 0.03 |
○mkl_blas_avx512_dtrsm_kernel_ll_0 | libmkl_avx512.so.2 | 0.07 | 0.07 |
○mkl_blas_avx512_dgemm_dcopy_down24_ea | libmkl_avx512.so.2 | 0.05 | 0.05 |
○mkl_blas_avx512_dgemm_kernel_nocopy_NN_b1 | libmkl_avx512.so.2 | 0.04 | 0.04 |
○__kmp_api_omp_get_level | libiomp5.so | 0.04 | 0.04 |
○kmp_flag_native::notdone_check() | libiomp5.so | 0.03 | 0.03 |
►miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+ | exec | 0.03 | 0.03 |
►Loop 303 - OneBodyJastrowRef.h:134-155 - exec+ | | 0.01 | 0.01 |
►Loop 305 - BsplineFunctor.h:229-260 - exec+ | | 0.01 | 0.01 |
○Loop 308 - BsplineFunctor.h:236-241 - exec | | 0.01 | 0.01 |
►miniqmcreference::DiracDeterminantRef >::resize(int, int)+ | exec | 0.02 | 0.02 |
○Loop 1004 - stl_algobase.h:740-742 - exec | | 0.02 | 0.02 |
○qmcplusplus::SoaDistanceTableABOMPTarget::update(int) | exec | 0.02 | 0.02 |
►qmcplusplus::ParticleSet::acceptMove(int)+ | exec | 0.02 | 0.02 |
○Loop 1238 - ParticleSet.cpp:389-390 - exec | | 0.01 | 0.01 |
○qmcplusplus::ParticleSet::makeMove(int, qmcplusplus::TinyVector const&, bool) | exec | 0.02 | 0.02 |
○miniqmcreference::OneBodyJastrowRef >::evalGrad(qmcplusplus::ParticleSet&, int) | exec | 0.02 | 0.02 |
○qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&) | exec | 0.02 | 0.02 |
►main.extracted.110+ | exec | 0.02 | 0.02 |
►Loop 24 - new_allocator.h:101-125 - exec+ | | 0.02 | 0.02 |
►Loop 35 - StdRandom.h:102-103 - exec+ | | 0.02 | 0.02 |
○Loop 36 - miniqmc.cpp:429-458 - exec | | 0.02 | 0.02 |
○__libm_exp_z0 | exec | 0.01 | 0.01 |
○qmcplusplus::TimerType::stop() | exec | 0.01 | 0.01 |
►qmcplusplus::ParticleSet::update(bool)+ | exec | 0.01 | 0.01 |
○Loop 1225 - ParticleSet.cpp:242-243 - exec | | 0.01 | 0.01 |
○__GI___pthread_getspecific | libpthread-2.28.so | 0.01 | 0.01 |
►qmcplusplus::Vector >::resize(unsigned long, double)+ | exec | 0.01 | 0.01 |
○Loop 313 - stl_algobase.h:752-754 - exec | | 0.01 | 0.01 |
○_dl_update_slotinfo | ld-2.28.so | 0.01 | 0.01 |
○miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle... | exec | 0.01 | 0.01 |
○mkl_blas_dgemv | libmkl_intel_thread.so.2 | 0.01 | 0.01 |
○mkl_blas_avx512_xdgemm_nocopy_driver | libmkl_avx512.so.2 | 0.01 | 0.01 |
○mkl_blas_avx512_xdgemv | libmkl_avx512.so.2 | 0.01 | 0.01 |
○__kmp_get_global_thread_id_reg | libiomp5.so | 0.01 | 0.01 |
○_intel_fast_memset | exec | 0.01 | 0.01 |
►miniqmcreference::OneBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet&, int, double const*)+ | exec | 0.01 | 0.01 |
○Loop 329 - OneBodyJastrowRef.h:214-219 - exec | | 0.01 | 0.01 |
○update_get_addr | ld-2.28.so | 0.01 | 0.01 |
○miniqmcreference::OneBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int) | exec | 0.01 | 0.01 |
○__dynamic_cast | libstdc++.so.6.0.25 | 0.01 | 0.01 |
○qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int) | exec | 0.01 | 0.01 |
○__tls_get_addr | ld-2.28.so | 0.01 | 0.01 |
○__kmp_api_omp_in_parallel | libiomp5.so | 0 | 0 |
○qmcplusplus::SoaDistanceTableABOMPTarget::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector const&, int, bool) | exec | 0 | 0 |
○qmcplusplus::TimerType::start() | exec | 0 | 0 |
○miniqmcreference::TwoBodyJastrowRef >::evalGrad(qmcplusplus::ParticleSet&, int) | exec | 0 | 0 |
○qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&) | exec | 0 | 0 |
○mkl_blas_avx512_xdger | libmkl_avx512.so.2 | 0 | 0 |
○__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 | 0 |