options

Profiling node ip-172-31-68-94 - process 509596 - thread 509596

NameModuleCoverage (%)Time (s)
mkl_blas_def_dgemm_kernel_zenlibmkl_def.so.228.9812.04
mkl_blas_def_dgemm_pstlibmkl_def.so.217.47.23
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)+libqmcwfs.so14.856.17
Loop 821 - MultiBsplineRef.hpp:42-71 - libqmcwfs.so+14.846.16
Loop 822 - MultiBsplineRef.hpp:63-71 - libqmcwfs.so+14.846.16
Loop 823 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so3.881.61
Loop 826 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so3.81.58
Loop 824 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so3.651.51
Loop 825 - MultiBsplineRef.hpp:68-70 - libqmcwfs.so3.511.46
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+libqmcwfs.so13.965.8
Loop 837 - MultiBsplineRef.hpp:187-286 - libqmcwfs.so+12.985.39
Loop 841 - MultiBsplineRef.hpp:226-262 - libqmcwfs.so+12.495.19
Loop 842 - MultiBsplineRef.hpp:227-262 - libqmcwfs.so+12.495.19
Loop 844 - MultiBsplineRef.hpp:242-262 - libqmcwfs.so12.495.19
Loop 839 - MultiBsplineRef.hpp:276-286 - libqmcwfs.so0.490.2
Loop 835 - einspline_spo_ref.hpp:219-227 - libqmcwfs.so+0.950.39
Loop 836 - einspline_spo_ref.hpp:223-227 - libqmcwfs.so0.950.39
mkl_blas_def_dgemm_copybn_bdzlibmkl_def.so.27.493.11
qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+libqmcparticle_omptarget.so2.240.93
Loop 453 - SoaDistanceTableABOMPTarget.h:214-228 - libqmcparticle_omptarget.so+2.290.94
Loop 454 - SoaDistanceTableABOMPTarget.h:215-228 - libqmcparticle_omptarget.so+2.290.94
Loop 456 - ParticleBConds3DSoa.h:280-298 - libqmcparticle_omptarget.so2.230.92
Loop 455 - SoaDistanceTableABOMPTarget.h:228-228 - libqmcparticle_omptarget.so0.060.02
mkl_blas_def_dgemm_copyan_bdzlibmkl_def.so.22.120.88
qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+libqmcparticle_omptarget.so2.030.84
Loop 204 - SoaDistanceTableAAOMPTarget.h:440-442 - libqmcparticle_omptarget.so2.020.84
__nss_database_lookuplibc.so.61.30.54
qmcplusplus::BsplineFunctor::evaluateV(int, int, int, double const*, double*) const+libqmcwfs.so1.30.54
Loop 449 - BsplineFunctor.h:236-241 - libqmcwfs.so1.240.51
Loop 447 - BsplineFunctor.h:246-260 - libqmcwfs.so0.050.02
void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+libqmcparticle_omptarget.so1.240.51
Loop 219 - ParticleBConds3DSoa.h:234-255 - libqmcparticle_omptarget.so1.240.51
mkl_blas_def_xdgemvlibmkl_def.so.21.160.48
qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+libqmcwfs.so0.770.32
Loop 453 - BsplineFunctor.h:291-298 - libqmcwfs.so0.660.27
Loop 450 - BsplineFunctor.h:302-336 - libqmcwfs.so0.070.03
Loop 452 - BsplineFunctor.h:302-336 - libqmcwfs.so0.010
miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+libqmcwfs.so0.730.3
Loop 631 - TwoBodyJastrowRef.h:342-347 - libqmcwfs.so0.190.08
Loop 635 - TwoBodyJastrowRef.h:342-347 - libqmcwfs.so0.190.08
Loop 638 - TwoBodyJastrowRef.h:324-331 - libqmcwfs.so0.190.08
Loop 633 - TwoBodyJastrowRef.h:342-347 - libqmcwfs.so0.140.06
miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+libqmcwfs.so0.510.21
Loop 901 - inner_product.hpp:155-155 - libqmcwfs.so0.510.21
miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+libqmcwfs.so0.490.2
Loop 913 - OhmmsVector.h:223-223 - libqmcwfs.so+0.50.2
Loop 915 - inner_product.hpp:155-155 - libqmcwfs.so0.280.11
Loop 914 - inner_product.hpp:82-83 - libqmcwfs.so0.220.09
mkl_blas_def_dtrsm_ilibmkl_def.so.20.30.12
qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+libqmcwfs.so0.290.12
Loop 891 - inner_product.hpp:210-212 - libqmcwfs.so+0.290.12
Loop 892 - inner_product.hpp:211-212 - libqmcwfs.so0.290.12
mkl_lapack_xdlaswplibmkl_core.so.20.20.08
mkl_blas_def_dtrsml2x2_llnlibmkl_def.so.20.20.08
miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.20.08
Loop 617 - TwoBodyJastrowRef.h:155-156 - libqmcwfs.so0.080.03
Loop 616 - TwoBodyJastrowRef.h:155-156 - libqmcwfs.so0.060.02
Loop 625 - stl_numeric.h:141-141 - libqmcwfs.so0.040.01
Loop 615 - TwoBodyJastrowRef.h:155-156 - libqmcwfs.so0.020.01
mkl_blas_def_dtrmml2x2_lunlibmkl_def.so.20.190.08
qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+libqmcwfs.so0.190.08
Loop 7 - inner_product.hpp:82-83 - libqmcwfs.so+0.180.07
Loop 8 - inner_product.hpp:82-83 - libqmcwfs.so0.180.07
miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+libqmcwfs.so0.180.07
Loop 894 - OhmmsMatrix.h:217-217 - libqmcwfs.so+0.180.07
Loop 895 - inner_product.hpp:155-155 - libqmcwfs.so0.170.07
Loop 896 - inner_product.hpp:82-83 - libqmcwfs.so0.010
miniqmcreference::TwoBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+libqmcwfs.so0.180.07
Loop 644 - TwoBodyJastrowRef.h:268-398 - libqmcwfs.so+0.180.06
Loop 645 - TwoBodyJastrowRef.h:268-398 - libqmcwfs.so+0.180.06
Loop 659 - TwoBodyJastrowRef.h:381-382 - libqmcwfs.so0.070.03
Loop 660 - TwoBodyJastrowRef.h:381-382 - libqmcwfs.so0.050.02
Loop 662 - TwoBodyJastrowRef.h:381-382 - libqmcwfs.so0.040.01
Loop 656 - TwoBodyJastrowRef.h:388-391 - libqmcwfs.so0.010
Loop 654 - TwoBodyJastrowRef.h:397-398 - libqmcwfs.so0.010
.omp_outlined..11+libqmcwfs.so0.130.05
Loop 97 - BsplineAllocator.hpp:172-180 - libqmcwfs.so+0.130.05
Loop 99 - BsplineAllocator.hpp:179-180 - libqmcwfs.so0.130.05
miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.120.05
Loop 905 - inner_product.hpp:155-155 - libqmcwfs.so0.110.04
Loop 904 - inner_product.hpp:82-83 - libqmcwfs.so0.010
mkl_blas_def_dgemm_copyat_bdzlibmkl_def.so.20.080.03
.omp_outlined..64exec0.080.03
unknown_function[vdso]0.080.03
qmcplusplus::Vector >::resize(unsigned long, double)+libqmcwfs.so0.070.03
Loop 209 - stl_algobase.h:923-924 - libqmcwfs.so0.070.03
mkl_blas_def_dgemm_mscalelibmkl_def.so.20.060.02
f64xsubf128libm.so.60.060.02
miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.060.02
Loop 683 - OneBodyJastrowRef.h:192-193 - libqmcwfs.so0.020.01
Loop 681 - OneBodyJastrowRef.h:192-193 - libqmcwfs.so0.010
Loop 678 - stl_numeric.h:141-141 - libqmcwfs.so0.010
qmcplusplus::Vector, std::allocator > >::resize(unsigned long, qmcplusplus::TinyVector)+libqmcwfs.so0.060.02
Loop 455 - stl_algobase.h:911-912 - libqmcwfs.so0.060.02
Loop 454 - stl_algobase.h:911-912 - libqmcwfs.so0.010
miniqmcreference::OneBodyJastrowRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus::Particle...+libqmcwfs.so0.050.02
Loop 715 - OneBodyJastrowRef.h:109-194 - libqmcwfs.so+0.040.02
Loop 718 - OneBodyJastrowRef.h:192-193 - libqmcwfs.so0.020.01
Loop 717 - OneBodyJastrowRef.h:192-193 - libqmcwfs.so0.020.01
mkl_lapack_dgetrilibmkl_core.so.20.040.01
__kmp_api_omp_get_levellibomp.so0.040.01
qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int)libqmcwfs.so0.040.01
qmcplusplus::TimerType::stop()+libqmcutil.so0.040.01
Loop 1 - NewTimer.h:119-121 - libqmcutil.so0.010
Loop 2 - NewTimer.h:119-121 - libqmcutil.so0.010
_dl_deallocate_tlsld-linux-x86-64.so.20.040.01
mkl_blas_def_xdswaplibmkl_def.so.20.020.01
__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.6.0.300.020.01
miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)libqmcwfs.so0.020.01
qmcplusplus::TimerType::start()libqmcutil.so0.020.01
mkl_blas_xdgerlibmkl_core.so.20.010
mm_account_ptr_by_tidlibmkl_core.so.20.010
mkl_serv_cbwr_getlibmkl_core.so.20.010
DGEMVlibmkl_intel_lp64.so.20.010
mkl_set_xerbla_interfacelibmkl_intel_lp64.so.20.010
mkl_blas_def_dgemm_blk_info_bdzlibmkl_def.so.20.010
mkl_blas_def_xidamax_nonanlibmkl_def.so.20.010
mkl_blas_def_xdtrsmlibmkl_def.so.20.010
__clock_gettimelibc.so.60.010
__kmp_get_global_thread_id_reglibomp.so0.010
__libc_malloclibc.so.60.010
pthread_selflibc.so.60.010
__pthread_mutex_locklibc.so.60.010
qmcplusplus::ParticleSet::acceptMove(int)libqmcparticle.so0.010
qmcplusplus::ParticleSet::makeMove(int, qmcplusplus::TinyVector const&, bool)libqmcparticle.so0.010
qmcplusplus::ParticleSet::update(bool)libqmcparticle.so0.010
qmcplusplus::ParticleSet::getDistTableAA(int) constlibqmcparticle.so0.010
miniqmcreference::DiracDeterminantRef >::acceptMove(qmcplusplus::ParticleSet&, int)libqmcwfs.so0.010
void qmcplusplus::DelayedUpdate::getInvRow > >(qmcplusplus::Matrix > const&, int, qmcplusplus::Vector >&)libqmcwfs.so0.010
qmcplusplus::build_SPOSet(bool, int, int, int, int, int, qmcplusplus::Tensor const&, bool)libqmcwfs.so0.010
qmcplusplus::WaveFunction::evaluateGL(qmcplusplus::ParticleSet&)libqmcwfs.so0.010
qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+libqmcwfs.so0.010
Loop 739 - WaveFunction.cpp:198-201 - libqmcwfs.so0.010
miniqmcreference::OneBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet&, int, double const*)libqmcwfs.so0.010
PMIx_Get_nblibpmix.so.2.9.30.010
qmcplusplus::Vector > >::resize(unsigned long, double)+libqmcparticle_omptarget.so0.010
Loop 79 - stl_algobase.h:923-924 - libqmcparticle_omptarget.so0.010
__tls_get_addrld-linux-x86-64.so.20.010
_dl_mcountld-linux-x86-64.so.20.010
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