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Profiling node ip-172-31-68-94 - process 426073 - thread 426538

NameModuleCoverage (%)Time (s)
mkl_blas_def_dgemm_pstlibmkl_def.so.226.346.86
void miniqmcreference::MultiBsplineEvalRef::evaluate_v(qmcplusplus::bspline_traits::SplineType const*, double, double, double, double*, unsigned long)+exec26.1246.52
Loop 844 - MultiBsplineRef.hpp:63-71 - exec+26.0946.45
Loop 841 - MultiBsplineRef.hpp:68-70 - exec6.5911.73
Loop 843 - MultiBsplineRef.hpp:68-70 - exec6.5511.66
Loop 840 - MultiBsplineRef.hpp:68-70 - exec6.5311.63
Loop 842 - MultiBsplineRef.hpp:68-70 - exec6.4211.43
mkl_blas_def_dgemm_kernel_zenlibmkl_def.so.215.7828.1
mkl_blas_def_dgemm_copybn_bdzlibmkl_def.so.28.0414.33
void miniqmcreference::MultiBsplineEvalRef::evaluate_vgh(qmcplusplus::bspline_traits::SplineType const*, double, double, double, double*, double*, double*, unsigned long)+exec7.5913.52
Loop 857 - MultiBsplineRef.hpp:226-262 - exec+7.3213.04
Loop 858 - MultiBsplineRef.hpp:226-262 - exec+7.3213.04
Loop 860 - MultiBsplineRef.hpp:242-262 - exec7.3213.04
Loop 855 - MultiBsplineRef.hpp:276-286 - exec0.260.47
qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+exec4.337.71
Loop 2033 - SoaDistanceTableABOMPTarget.h:214-228 - exec+4.317.67
Loop 2034 - SoaDistanceTableABOMPTarget.h:215-228 - exec+4.317.67
Loop 2036 - ParticleBConds3DSoa.h:280-298 - exec4.317.67
qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+exec1.953.47
Loop 1791 - SoaDistanceTableAAOMPTarget.h:440-442 - exec1.943.46
miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+exec1.562.79
Loop 322 - TwoBodyJastrowRef.h:107-132 - exec+1.482.65
Loop 323 - BsplineFunctor.h:236-260 - exec+1.482.65
Loop 326 - BsplineFunctor.h:236-241 - exec1.442.57
Loop 324 - BsplineFunctor.h:246-260 - exec0.040.08
__nss_database_lookuplibc.so.61.11.96
mkl_blas_def_dgemm_copyan_bdzlibmkl_def.so.20.931.65
__kmp_hardware_timestamplibomp.so0.71.24
mkl_blas_def_xdgemvlibmkl_def.so.20.591.05
void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+exec0.490.88
Loop 1310 - ParticleBConds3DSoa.h:234-255 - exec0.490.87
miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+exec0.450.8
Loop 309 - TwoBodyJastrowRef.h:342-347 - exec0.130.23
Loop 313 - TwoBodyJastrowRef.h:342-347 - exec0.130.23
Loop 311 - TwoBodyJastrowRef.h:342-347 - exec0.090.16
Loop 316 - TwoBodyJastrowRef.h:324-331 - exec0.090.16
miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+exec0.430.77
Loop 1060 - inner_product.hpp:82-155 - exec+0.430.76
Loop 1059 - inner_product.hpp:155-155 - exec0.290.52
Loop 1058 - inner_product.hpp:82-83 - exec0.140.24
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+exec0.410.73
Loop 830 - einspline_spo_ref.hpp:219-227 - exec+0.410.73
Loop 831 - einspline_spo_ref.hpp:223-227 - exec0.410.73
__kmp_hyper_barrier_release(barrier_type, kmp_info*, int, int, int, void*)libomp.so0.350.63
qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+exec0.350.61
Loop 832 - inner_product.hpp:82-83 - exec+0.310.55
Loop 833 - inner_product.hpp:82-83 - exec0.310.55
__kmp_hyper_barrier_gather(barrier_type, kmp_info*, int, int, void (*)(void*, void*), void*)libomp.so0.310.54
qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+exec0.290.52
Loop 265 - BsplineFunctor.h:291-298 - exec0.250.44
Loop 262 - BsplineFunctor.h:302-336 - exec0.020.03
miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+exec0.250.44
Loop 1045 - inner_product.hpp:155-155 - exec0.250.44
qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+exec0.170.29
Loop 1022 - inner_product.hpp:210-212 - exec+0.170.29
Loop 1023 - inner_product.hpp:211-212 - exec0.170.29
mkl_blas_def_dtrsm_ilibmkl_def.so.20.160.28
qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&)+exec0.130.22
Loop 62 - NonLocalPP.hpp:122-135 - exec+0.010.01
Loop 63 - NonLocalPP.hpp:126-135 - exec+0.010.01
Loop 64 - NonLocalPP.hpp:131-132 - exec0.010.01
miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+exec0.120.2
Loop 293 - TwoBodyJastrowRef.h:155-156 - exec0.040.06
Loop 294 - TwoBodyJastrowRef.h:155-156 - exec0.040.07
Loop 295 - TwoBodyJastrowRef.h:155-156 - exec0.030.05
mkl_blas_def_dtrsml2x2_llnlibmkl_def.so.20.090.16
mkl_blas_def_dtrmml2x2_lunlibmkl_def.so.20.090.16
mkl_blas_def_dgemm_mscalelibmkl_def.so.20.080.15
miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+exec0.080.15
Loop 227 - OneBodyJastrowRef.h:134-155 - exec+0.060.11
Loop 229 - BsplineFunctor.h:233-260 - exec+0.060.11
Loop 232 - BsplineFunctor.h:236-241 - exec0.060.11
mkl_lapack_xdlaswplibmkl_core.so.20.060.11
mkl_blas_def_dgemm_copyat_bdzlibmkl_def.so.20.060.11
miniqmcreference::TwoBodyJastrowRef >::recompute(qmcplusplus::ParticleSet&)+exec0.060.1
Loop 328 - TwoBodyJastrowRef.h:268-398 - exec+0.070.08
Loop 329 - TwoBodyJastrowRef.h:268-398 - exec+0.070.08
Loop 343 - TwoBodyJastrowRef.h:381-382 - exec0.020.03
Loop 344 - TwoBodyJastrowRef.h:381-382 - exec0.010.01
Loop 338 - TwoBodyJastrowRef.h:397-398 - exec0.010.01
Loop 340 - TwoBodyJastrowRef.h:388-391 - exec0.010.01
Loop 345 - TwoBodyJastrowRef.h:381-382 - exec0.010.01
Loop 342 - TwoBodyJastrowRef.h:375-376 - exec0.010.01
miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+exec0.050.09
Loop 1048 - inner_product.hpp:82-83 - exec0.030.04
Loop 1049 - inner_product.hpp:155-155 - exec0.020.03
miniqmcreference::einspline_spo_ref::evaluate_v(qmcplusplus::ParticleSet const&, int)+exec0.050.09
Loop 839 - einspline_spo_ref.hpp:175-176 - exec0.020.04
miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+exec0.050.08
Loop 1040 - inner_product.hpp:82-155 - exec+0.050.08
Loop 1038 - inner_product.hpp:155-155 - exec0.040.07
Loop 1039 - inner_product.hpp:82-83 - exec0.010.01
__kmp_api_omp_get_levellibomp.so0.040.06
_dl_deallocate_tlsld-linux-x86-64.so.20.030.06
qmcplusplus::ParticleSet::update(bool)+exec0.030.05
Loop 1143 - ParticleSet.cpp:242-243 - exec0.020.03
mkl_blas_def_xdswaplibmkl_def.so.20.030.04
__libc_malloclibc.so.60.030.04
f64xsubf128libm.so.60.030.04
miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+exec0.020.04
Loop 194 - OneBodyJastrowRef.h:192-193 - exec0.010.01
Loop 195 - OneBodyJastrowRef.h:192-193 - exec0.010.01
Loop 193 - OneBodyJastrowRef.h:192-193 - exec0.010.01
qmcplusplus::TimerType::start()exec0.020.03
mkl_blas_def_xdgemm_bdzlibmkl_def.so.20.010.02
qmcplusplus::TimerType::stop()exec0.010.02
qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)exec0.010.02
__dynamic_castlibstdc++.so.6.0.300.010.02
__tls_get_addrld-linux-x86-64.so.20.010.02
qmcplusplus::SoaDistanceTableABOMPTarget::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector const&, int, bool)exec0.010.01
__kmp_get_global_thread_id_reglibomp.so0.010.01
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)exec0.010.01
miniqmcreference::OneBodyJastrowRef >::computeU3(qmcplusplus::ParticleSet&, int, double const*)exec0.010.01
qmcplusplus::Vector, std::allocator > >::resize(unsigned long, qmcplusplus::TinyVector)+exec0.010.01
Loop 241 - stl_algobase.h:911-912 - exec0.010.01
mkl_lapack_dgetrilibmkl_core.so.20.010.01
mkl_serv_deallocatelibmkl_core.so.20.010.01
DGEMVlibmkl_intel_lp64.so.20.010.01
mkl_blas_def_xidamax_nonanlibmkl_def.so.20.010.01
qmcplusplus::SoaDistanceTableABOMPTarget::update(int)exec0.010.01
qmcplusplus::ParticleSet::getDistTableAB(int) constexec0.010.01
qmcplusplus::Vector > >::resize(unsigned long, double)exec0.010.01
miniqmcreference::OneBodyJastrowRef >::recompute(qmcplusplus::ParticleSet&)exec0.010.01
qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int)exec0.010.01
__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.6.0.3000
__sched_yieldlibc.so.600
miniqmcreference::einspline_spo_ref::evaluate_vgh(qmcplusplus::ParticleSet const&, int)exec00
qmcplusplus::Vector >::resize(unsigned long, double)exec00
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