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Profiling MPI #4.28 - node gmz10.benchmarkcenter.megware.com - process 392396 - thread 392845

NameModuleCoverage (%)Time (s)
void miniqmcreference::MultiBsplineEvalRef::evaluate_v(qmcplusplus::bspline_traits::SplineType const*, double, double, double, double*, unsigned long)+exec24.8941.22
Loop 852 - MultiBsplineRef.hpp:63-71 - exec+24.8841.19
Loop 851 - MultiBsplineRef.hpp:68-70 - exec6.4210.64
Loop 849 - MultiBsplineRef.hpp:68-70 - exec6.3210.47
Loop 850 - MultiBsplineRef.hpp:68-70 - exec6.1310.15
Loop 848 - MultiBsplineRef.hpp:68-70 - exec6.009.93
mkl_blas_def_dgemm_kernel_zenlibmkl_def.so.218.6930.94
mkl_blas_def_dgemm_pstlibmkl_def.so.217.0228.19
mkl_blas_def_dgemm_copybn_bdzlibmkl_def.so.211.9619.81
void miniqmcreference::MultiBsplineEvalRef::evaluate_vgh(qmcplusplus::bspline_traits::SplineType const*, double, double, double, double*, double*, double*, unsigned long)+exec10.4117.23
Loop 866 - MultiBsplineRef.hpp:226-262 - exec+10.3417.11
Loop 867 - MultiBsplineRef.hpp:227-262 - exec+10.3417.11
Loop 865 - MultiBsplineRef.hpp:242-262 - exec10.3417.11
Loop 863 - MultiBsplineRef.hpp:276-286 - exec0.040.07
qmcplusplus::SoaDistanceTableABOMPTarget::evaluate(qmcplusplus::ParticleSet&)+exec4.497.44
Loop 2034 - SoaDistanceTableABOMPTarget.h:214-228 - exec+4.487.41
Loop 2035 - SoaDistanceTableABOMPTarget.h:215-228 - exec+4.487.41
Loop 2037 - ParticleBConds3DSoa.h:280-298 - exec4.487.41
qmcplusplus::SoaDistanceTableAAOMPTarget::update(int)+exec2.263.74
Loop 1791 - SoaDistanceTableAAOMPTarget.h:440-442 - exec2.263.74
mkl_blas_def_xdgemvlibmkl_def.so.21.232.04
miniqmcreference::TwoBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+exec0.981.63
Loop 324 - TwoBodyJastrowRef.h:107-132 - exec+0.971.61
Loop 325 - BsplineFunctor.h:236-260 - exec+0.971.61
Loop 326 - BsplineFunctor.h:236-241 - exec0.941.55
Loop 327 - BsplineFunctor.h:246-260 - exec0.030.04
Loop 328 - BsplineFunctor.h:246-260 - exec0.010.01
void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+exec0.951.58
Loop 1321 - ParticleBConds3DSoa.h:234-255 - exec0.951.58
mkl_blas_def_dgemm_copyan_bdzlibmkl_def.so.20.901.49
miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+exec0.831.38
Loop 313 - TwoBodyJastrowRef.h:342-347 - exec0.210.36
Loop 311 - TwoBodyJastrowRef.h:342-347 - exec0.210.35
Loop 318 - TwoBodyJastrowRef.h:324-331 - exec0.200.33
Loop 315 - TwoBodyJastrowRef.h:342-347 - exec0.190.31
Loop 321 - TwoBodyJastrowRef.h:269-274 - exec0.000.00
__kmp_hardware_timestamplibomp.so0.711.18
__memcpy_avx512_unaligned_ermslibc.so.60.651.07
miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+exec0.641.06
Loop 1071 - inner_product.hpp:82-155 - exec+0.631.05
Loop 1070 - inner_product.hpp:155-155 - exec0.390.65
Loop 1069 - inner_product.hpp:82-83 - exec0.240.40
__memset_avx512_unaligned_ermslibc.so.60.540.90
miniqmcreference::DiracDeterminantRef >::evalGrad(qmcplusplus::ParticleSet&, int)+exec0.450.75
Loop 1056 - inner_product.hpp:155-155 - exec0.450.75
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+exec0.370.62
Loop 838 - einspline_spo_ref.hpp:219-227 - exec+0.370.61
Loop 839 - einspline_spo_ref.hpp:223-227 - exec0.370.61
qmcplusplus::BsplineFunctor::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+exec0.280.47
Loop 262 - BsplineFunctor.h:291-297 - exec0.240.39
Loop 263 - BsplineFunctor.h:302-336 - exec0.010.02
Loop 264 - BsplineFunctor.h:302-336 - exec0.000.00
mkl_blas_def_dgemm_mscalelibmkl_def.so.20.170.27
unknown_kernel_regionkernel0.140.24
__kmp_hyper_barrier_gather(barrier_type, kmp_info*, int, int, void (*)(void*, void*), void*)libomp.so0.130.21
mkl_blas_def_dtrsm_ilibmkl_def.so.20.120.19
qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+exec0.110.19
Loop 1033 - inner_product.hpp:210-212 - exec+0.110.19
Loop 1032 - inner_product.hpp:211-212 - exec0.110.19
miniqmcreference::TwoBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+exec0.100.16
Loop 297 - TwoBodyJastrowRef.h:155-156 - exec0.040.07
Loop 295 - TwoBodyJastrowRef.h:155-156 - exec0.030.05
Loop 296 - TwoBodyJastrowRef.h:155-156 - exec0.020.02
Loop 305 - stl_numeric.h:141-141 - exec0.000.00
mkl_blas_def_dgemm_copyat_bdzlibmkl_def.so.20.090.14
miniqmcreference::DiracDeterminantRef >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus...+exec0.080.13
Loop 1051 - inner_product.hpp:82-155 - exec+0.080.13
Loop 1049 - inner_product.hpp:155-155 - exec0.060.10
Loop 1050 - inner_product.hpp:82-83 - exec0.020.03
mkl_blas_def_dtrsml2x2_llnlibmkl_def.so.20.080.13
mkl_blas_def_dtrmml2x2_lunlibmkl_def.so.20.080.12
__kmp_hyper_barrier_release(barrier_type, kmp_info*, int, int, int, void*)libomp.so0.070.11
qmcplusplus::NonLocalPP::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&)+exec0.050.07
Loop 53 - NonLocalPP.hpp:122-135 - exec+0.010.01
Loop 54 - NonLocalPP.hpp:126-135 - exec+0.010.01
Loop 55 - NonLocalPP.hpp:131-132 - exec0.010.01
mkl_lapack_xdlaswplibmkl_core.so.20.040.07
mkl_blas_def_xdswaplibmkl_def.so.20.040.06
miniqmcreference::TwoBodyJastrowRef >::recompute(qmcplusplus::ParticleSet&)+exec0.040.06
Loop 331 - TwoBodyJastrowRef.h:268-398 - exec+0.040.06
Loop 332 - TwoBodyJastrowRef.h:268-398 - exec+0.040.06
Loop 347 - TwoBodyJastrowRef.h:381-382 - exec0.020.02
Loop 346 - TwoBodyJastrowRef.h:381-382 - exec0.010.01
Loop 348 - TwoBodyJastrowRef.h:381-382 - exec0.010.01
Loop 343 - TwoBodyJastrowRef.h:388-391 - exec0.000.00
Loop 341 - TwoBodyJastrowRef.h:397-398 - exec0.000.00
Loop 345 - TwoBodyJastrowRef.h:375-376 - exec0.000.00
Loop 339 - TwoBodyJastrowRef.h:397-398 - exec0.000.00
qmcplusplus::Vector, std::allocator > >::resize(unsigned long, qmcplusplus::TinyVector)+exec0.030.05
Loop 240 - stl_algobase.h:911-912 - exec0.030.05
qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector >&, qmcplusplus::Vector > const&, std::vector >&)+exec0.030.05
Loop 840 - inner_product.hpp:82-83 - exec+0.030.04
Loop 841 - inner_product.hpp:82-83 - exec0.030.04
miniqmcreference::OneBodyJastrowRef >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector >&)+exec0.030.05
Loop 225 - OneBodyJastrowRef.h:134-155 - exec+0.020.02
Loop 227 - OneBodyJastrowRef.h:143-146 - exec+0.020.02
Loop 228 - BsplineFunctor.h:236-241 - exec0.020.02
miniqmcreference::DiracDeterminantRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+exec0.030.04
Loop 1060 - inner_product.hpp:155-155 - exec0.020.02
Loop 1059 - inner_product.hpp:82-83 - exec0.010.02
qmcplusplus::Vector >::resize(unsigned long, double)+exec0.020.04
Loop 236 - stl_algobase.h:924-924 - exec0.020.04
qmcplusplus::TimerType::stop()exec0.020.03
mkl_lapack_dgetrilibmkl_core.so.20.020.03
qmcplusplus::TimerType::start()exec0.020.03
__kmp_api_omp_get_levellibomp.so0.010.02
f64xsubf128libm.so.60.010.02
miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)exec0.010.02
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