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Profiling node skylake - process 617176 - thread 617176

NameModuleCoverage (%)Time (s)
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&)+exec30.210.29
Loop 827 - MultiBsplineRef.hpp:43-74 - exec+30.210.29
Loop 829 - MultiBsplineRef.hpp:65-73 - exec+30.210.29
Loop 830 - MultiBsplineRef.hpp:66-73 - exec+30.210.29
Loop 831 - MultiBsplineRef.hpp:70-73 - exec30.210.29
void qmcplusplus::DTD_BConds::computeDistances, qmcplusplus::VectorSoAContainer >, qmcplusplus::VectorSoAContainer+exec23.440.22
Loop 1167 - ParticleBConds.h:185-217 - exec23.440.22
miniqmcreference::einspline_spo_ref::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector >&, qmcplusplus::Vector, std::allocator >...+exec21.870.21
Loop 834 - TinyVectorOps.h:59-59 - exec+20.830.19
Loop 837 - MultiBsplineRef.hpp:233-270 - exec+20.310.19
Loop 838 - MultiBsplineRef.hpp:234-270 - exec+20.310.19
Loop 840 - MultiBsplineRef.hpp:249-270 - exec20.310.19
Loop 836 - MultiBsplineRef.hpp:284-295 - exec0.520
Loop 832 - einspline_spo_ref.hpp:219-227 - exec+0.520
Loop 833 - einspline_spo_ref.hpp:223-227 - exec0.520
mkl_blas_avx512_dgemm_kernel_0libmkl_avx512.so.23.120.03
__intel_avx_rep_memset+exec1.560.01
Loop 1469 - - exec1.560.01
std::map, double, std::less >, std::allocator const, double> > >::operator[](qmcplusplus::StackKeyParam<2> const&)+exec1.560.01
Loop 1246 - stl_tree.h:782-1952 - exec1.560.01
qmcplusplus::BsplineAllocator >::setCoefficientsForOrbitals(int, int, Array&, multi_UBspline_3d_d*) [clone .extracted]+exec1.560.01
Loop 810 - BsplineAllocator.hpp:171-180 - exec+1.560.01
Loop 812 - BsplineAllocator.hpp:179-180 - exec1.560.01
qmcplusplus::BsplineFunctor::evaluateV(int, int, int, double const*, double*) const+exec1.560.01
Loop 302 - BsplineFunctor.h:236-241 - exec1.040.01
unknown_function[vdso]1.560.01
mkl_blas_avx512_dgemm_kernel_nocopy_TN_b1libmkl_avx512.so.21.040.01
mkl_blas_avx512_dgemm_kernel_nocopy_TN_b0libmkl_avx512.so.21.040.01
inflate_fastlibmpi.so.12.0.01.040.01
miniqmcreference::TwoBodyJastrowRef >::acceptMove(qmcplusplus::ParticleSet&, int)+exec1.040.01
Loop 323 - TwoBodyJastrowRef.h:340-345 - exec0.520
Loop 325 - TwoBodyJastrowRef.h:340-345 - exec0.520
_dl_rtld_di_serinfold-linux-x86-64.so.21.040.01
VPMI_KVS_Get_name_length_maxlibmpi.so.12.0.00.520
mkl_blas_avx512_dgemv_t_intrinsicslibmkl_avx512.so.20.520
mkl_blas_avx512_dgemv_n_intrinsicslibmkl_avx512.so.20.520
__kmp_elapsedlibiomp5.so0.520
__kmp_get_global_thread_id_reglibiomp5.so0.520
__intel_avx_rep_memcpy+exec0.520
Loop 1468 - - exec0.520
qmcplusplus::TimerType::stop()+exec0.520
Loop 1244 - NewTimer.cpp:99-100 - exec0.520
void qmcplusplus::expandSuperCell(qmcplusplus::ParticleSet&, qmcplusplus::Tensor const&)+exec0.520
Loop 1183 - ParticleIOUtility.h:65-91 - exec+0.520
Loop 1184 - ParticleIOUtility.h:67-91 - exec+0.520
Loop 1185 - ParticleIOUtility.h:68-91 - exec+0.520
Loop 1186 - ParticleIOUtility.h:69-91 - exec+0.520
Loop 1187 - ParticleIOUtility.h:70-91 - exec0.520
qmcplusplus::DistanceTableBA::evaluate(qmcplusplus::ParticleSet&)+exec0.520
Loop 1171 - DistanceTableBA.h:88-102 - exec+0.520
Loop 1172 - DistanceTableBA.h:89-99 - exec+0.520
Loop 1173 - DistanceTableBA.h:99-99 - exec0.520
miniqmcreference::DiracDeterminantRef >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib, std::allocator > >&, qmcplusplus:...+exec0.520
Loop 956 - DiracDeterminantRef.cpp:157-178 - exec+0.520
Loop 957 - inner_product.hpp:81-82 - exec0.520
miniqmcreference::DiracDeterminantRef >::ratio(qmcplusplus::ParticleSet&, int)+exec0.520
Loop 955 - inner_product.hpp:81-82 - exec0.520
qmcplusplus::DiracMatrix::invert_transpose(qmcplusplus::Matrix > const&, qmcplusplus::Matrix >&, double&, double&)+exec0.520
Loop 929 - inner_product.hpp:209-211 - exec+0.520
Loop 930 - inner_product.hpp:210-211 - exec0.520
miniqmcreference::OneBodyJastrowRef >::ratio(qmcplusplus::ParticleSet&, int)exec0.520
miniqmcreference::OneBodyJastrowRef >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector&)+exec0.520
Loop 240 - OneBodyJastrowRef.h:196-197 - exec0.520
_dl_deallocate_tlsld-linux-x86-64.so.20.520
unknown_kernel_regionkernel0.520
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