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Profiling node ip-172-31-68-94 - process 499488 - thread 500024

NameModuleCoverage (%)Time (s)
mkl_blas_def_dgemm_pstlibmkl_def.so.226.2548.35
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)+libqmcwfs.so25.647.15
Loop 821 - MultiBsplineRef.hpp:42-71 - libqmcwfs.so+25.5146.98
Loop 822 - MultiBsplineRef.hpp:63-71 - libqmcwfs.so+25.5146.98
Loop 823 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so6.4911.94
Loop 826 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so6.4711.92
Loop 825 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so6.2911.59
Loop 824 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so6.2611.53
Loop 820 - einspline_spo_ref.hpp:183-187 - libqmcwfs.so0.010.01
mkl_blas_def_dgemm_kernel_zenlibmkl_def.so.216.330.01
mkl_blas_def_dgemm_copybn_bdzlibmkl_def.so.28.3115.3
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+libqmcwfs.so8.1214.96
Loop 837 - MultiBsplineRef.hpp:187-286 - libqmcwfs.so+7.5913.97
Loop 841 - MultiBsplineRef.hpp:226-262 - libqmcwfs.so+7.4213.66
Loop 842 - MultiBsplineRef.hpp:227-262 - libqmcwfs.so+7.4213.66
Loop 844 - MultiBsplineRef.hpp:242-262 - libqmcwfs.so7.4213.66
Loop 839 - MultiBsplineRef.hpp:276-286 - libqmcwfs.so0.170.31
Loop 835 - einspline_spo_ref.hpp:219-227 - libqmcwfs.so+0.510.94
Loop 836 - einspline_spo_ref.hpp:223-227 - libqmcwfs.so0.510.94
qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+libqmcparticle_omptarget.so4.237.8
Loop 453 - SoaDistanceTableABOMPTarget.h:214-228 - libqmcparticle_omptarget.so+4.167.65
Loop 454 - SoaDistanceTableABOMPTarget.h:215-228 - libqmcparticle_omptarget.so+4.167.65
Loop 456 - ParticleBConds3DSoa.h:280-298 - libqmcparticle_omptarget.so4.167.65
qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+libqmcparticle_omptarget.so23.68
Loop 204 - SoaDistanceTableAAOMPTarget.h:440-442 - libqmcparticle_omptarget.so23.68
qmcplusplus::BsplineFunctor::evaluateV(int, int, int, double const*, double*) const+libqmcwfs.so1.633
Loop 449 - BsplineFunctor.h:236-241 - libqmcwfs.so1.582.91
Loop 448 - BsplineFunctor.h:246-260 - libqmcwfs.so0.010.02
Loop 447 - BsplineFunctor.h:246-260 - libqmcwfs.so0.010.02
__nss_database_lookuplibc.so.61.222.24
mkl_blas_def_dgemm_copyan_bdzlibmkl_def.so.20.941.73
mkl_blas_def_xdgemvlibmkl_def.so.20.681.25
miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+libqmcwfs.so0.61.11
Loop 913 - OhmmsVector.h:223-223 - libqmcwfs.so+0.61.1
Loop 915 - inner_product.hpp:155-155 - libqmcwfs.so0.380.69
Loop 914 - inner_product.hpp:82-83 - libqmcwfs.so0.220.41
void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+libqmcparticle_omptarget.so0.561.02
Loop 219 - ParticleBConds3DSoa.h:234-255 - libqmcparticle_omptarget.so0.561.02
miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+libqmcwfs.so0.470.86
Loop 631 - TwoBodyJastrowRef.h:342-347 - libqmcwfs.so0.120.22
Loop 633 - TwoBodyJastrowRef.h:342-347 - libqmcwfs.so0.120.22
Loop 638 - TwoBodyJastrowRef.h:324-331 - libqmcwfs.so0.120.22
Loop 635 - TwoBodyJastrowRef.h:342-347 - libqmcwfs.so0.10.19
__kmp_hardware_timestamplibomp.so0.360.66
__kmp_hyper_barrier_release(barrier_type, kmp_info*, int, int, int, void*)libomp.so0.360.65
qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+libqmcwfs.so0.320.59
Loop 7 - inner_product.hpp:82-83 - libqmcwfs.so+0.30.55
Loop 8 - inner_product.hpp:82-83 - libqmcwfs.so0.30.55
qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+libqmcwfs.so0.280.51
Loop 450 - BsplineFunctor.h:302-336 - libqmcwfs.so0.030.05
Loop 453 - BsplineFunctor.h:291-298 - libqmcwfs.so0.010.01
miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+libqmcwfs.so0.250.46
Loop 901 - inner_product.hpp:155-155 - libqmcwfs.so0.250.46
mkl_blas_def_dtrsm_ilibmkl_def.so.20.150.27
miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.140.25
Loop 616 - TwoBodyJastrowRef.h:155-156 - libqmcwfs.so0.040.07
Loop 617 - TwoBodyJastrowRef.h:155-156 - libqmcwfs.so0.040.08
Loop 615 - TwoBodyJastrowRef.h:155-156 - libqmcwfs.so0.030.06
Loop 625 - stl_numeric.h:141-141 - libqmcwfs.so0.010.02
.omp_outlined..64+exec0.130.23
Loop 37 - new_allocator.h:111-145 - exec+0.010.02
Loop 38 - NonLocalPP.hpp:122-135 - exec+0.010.02
Loop 39 - NonLocalPP.hpp:126-135 - exec+0.010.02
Loop 40 - NonLocalPP.hpp:131-132 - exec0.010.02
qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+libqmcwfs.so0.120.23
Loop 891 - inner_product.hpp:210-212 - libqmcwfs.so+0.120.23
Loop 892 - inner_product.hpp:211-212 - libqmcwfs.so0.120.23
mkl_blas_def_dtrmml2x2_lunlibmkl_def.so.20.10.17
mkl_blas_def_dtrsml2x2_llnlibmkl_def.so.20.080.14
miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+libqmcwfs.so0.070.13
Loop 894 - OhmmsMatrix.h:217-217 - libqmcwfs.so+0.070.13
Loop 895 - inner_product.hpp:155-155 - libqmcwfs.so0.060.11
Loop 896 - inner_product.hpp:82-83 - libqmcwfs.so0.010.02
miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.060.11
Loop 905 - inner_product.hpp:155-155 - libqmcwfs.so0.040.06
Loop 904 - inner_product.hpp:82-83 - libqmcwfs.so0.030.05
mkl_lapack_xdlaswplibmkl_core.so.20.060.11
mkl_blas_def_dgemm_mscalelibmkl_def.so.20.060.1
mkl_blas_def_dgemm_copyat_bdzlibmkl_def.so.20.050.09
mkl_blas_def_xdswaplibmkl_def.so.20.050.08
miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+libqmcwfs.so0.040.07
Loop 644 - TwoBodyJastrowRef.h:268-398 - libqmcwfs.so+0.040.05
Loop 645 - TwoBodyJastrowRef.h:268-398 - libqmcwfs.so+0.040.05
Loop 654 - TwoBodyJastrowRef.h:397-398 - libqmcwfs.so0.010.01
Loop 652 - TwoBodyJastrowRef.h:397-398 - libqmcwfs.so0.010.01
Loop 660 - TwoBodyJastrowRef.h:381-382 - libqmcwfs.so0.010.02
Loop 662 - TwoBodyJastrowRef.h:381-382 - libqmcwfs.so0.010.01
miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+libqmcwfs.so0.040.06
Loop 674 - TwoBodyJastrowRef.h:107-132 - libqmcwfs.so+0.010.02
Loop 675 - TwoBodyJastrowRef.h:127-132 - libqmcwfs.so0.010.02
_dl_deallocate_tlsld-linux-x86-64.so.20.030.05
__kmp_api_omp_get_levellibomp.so0.030.05
qmcplusplus::TimerType::stop()libqmcutil.so0.030.05
f64xsubf128libm.so.60.020.04
qmcplusplus::ParticleSet::update(bool)+libqmcparticle.so0.020.03
Loop 398 - ParticleSet.cpp:242-243 - libqmcparticle.so0.010.01
qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+libqmcwfs.so0.020.03
Loop 743 - WaveFunction.cpp:269-274 - libqmcwfs.so+0.010.01
Loop 744 - WaveFunction.cpp:273-274 - libqmcwfs.so0.010.01
miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)libqmcwfs.so0.020.03
qmcplusplus::TimerType::start()libqmcutil.so0.020.03
__dynamic_castlibstdc++.so.6.0.300.020.03
miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.020.03
Loop 683 - OneBodyJastrowRef.h:192-193 - libqmcwfs.so0.010.01
miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+libqmcwfs.so0.010.02
Loop 715 - OneBodyJastrowRef.h:109-194 - libqmcwfs.so+0.010.01
Loop 717 - OneBodyJastrowRef.h:192-193 - libqmcwfs.so0.010.01
__tls_get_addrld-linux-x86-64.so.20.010.02
__kmp_get_global_thread_id_reglibomp.so0.010.02
__libc_freelibc.so.60.010.02
mkl_lapack_dgetrilibmkl_core.so.20.010.01
mkl_serv_deallocatelibmkl_core.so.20.010.01
__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&) constlibstdc++.so.6.0.300.010.01
qmcplusplus::RealSpacePositionsOMPTarget::getAllParticlePos() constlibqmcparticle.so0.010.01
__sched_yieldlibc.so.60.010.01
__libc_malloclibc.so.60.010.01
qmcplusplus::SoaDistanceTableABOMPTarget::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector const&, int, bool)libqmcparticle_omptarget.so0.010.01
miniqmcreference::DiracDeterminantRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)libqmcwfs.so0.010.01
qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int)libqmcwfs.so0.010.01
mkl_blas_def_xdgemm_bdzlibmkl_def.so.200
qmcplusplus::Vector, std::allocator > >::resize(unsigned long, qmcplusplus::TinyVector)+libqmcwfs.so00
Loop 454 - stl_algobase.h:911-912 - libqmcwfs.so0.070.12
qmcplusplus::Vector >::resize(unsigned long, double)libqmcwfs.so00
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