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Functions and Loops

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Coverage run_0 (%) Max Time Over Threads run_0 (s) Time w.r.t. Wall Time run_0 (s) Nb Threads run_0 Deviation (coverage) run_0 Deviation (walltime) run_0 Categories run_0 Compilation Options
NameModuleCoverage run_0 (%)Max Time Over Threads run_0 (s)Time w.r.t. Wall Time run_0 (s)Nb Threads run_0Deviation (coverage) run_0Deviation (walltime) run_0Categories run_0Compilation Options
miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&)+exec24.9116.6616.6710.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 827 - MultiBsplineRef.hpp:43-74 - exec [...]+0.020.010.0110.000.00
Loop 829 - MultiBsplineRef.hpp:65-73 - exec [...]+0.010010.000.00
Loop 830 - MultiBsplineRef.hpp:66-73 - exec [...]+0.010010.000.00
Loop 831 - MultiBsplineRef.hpp:70-73 - exec24.8416.6216.6210.000.00
Loop 828 - MultiBsplineRef.hpp:70-73 - exec00000.000.00
Loop 826 - stl_algobase.h:238-437 - exec [...]00000.000.00
void qmcplusplus::DTD_BConds<double, 3u, 39>::computeDistances<qmcplusplus::TinyVector<double, 3u>, qmcplusplus::VectorSoAContainer<double, 3u, 64ul, qmcplusplus::Mallocator<double, 64ul> >, qmcplusplus::VectorSoAContainer<dou...+exec18.0412.0712.0710.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1167 - ParticleBConds.h:185-217 - exec18.0212.0612.0610.000.00
miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<...+exec15.8110.5810.5810.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 834 - TinyVectorOps.h:59-59 - exec [...]+0.020.010.0110.000.00
Loop 836 - MultiBsplineRef.hpp:284-295 - exec0.520.350.3510.000.00
Loop 835 - MultiBsplineRef.hpp:284-295 - exec00000.000.00
Loop 837 - MultiBsplineRef.hpp:233-270 - exec [...]+00000.000.00
Loop 838 - MultiBsplineRef.hpp:234-270 - exec [...]+0.020.010.0110.000.00
Loop 840 - MultiBsplineRef.hpp:249-270 - exec [...]14.279.549.5510.000.00
Loop 839 - MultiBsplineRef.hpp:249-270 - exec [...]00000.000.00
Loop 832 - einspline_spo_ref.hpp:219-227 - exec [...]+00000.000.00
Loop 833 - einspline_spo_ref.hpp:223-227 - exec [...]0.960.640.6410.000.00
mkl_blas_avx512_dgemm_kernel_nocopy_TN_b1libmkl_avx512.so.214.159.479.4710.000.00Math (%): 100.00
mkl_blas_avx512_dgemm_kernel_0libmkl_avx512.so.213.38.98.910.000.00Math (%): 100.00
__intel_avx_rep_memset+exec1.621.081.0910.000.00Memory (%): 100.00
Loop 1469 - - exec1.050.70.710.000.00
mkl_blas_avx512_dgemv_t_intrinsicslibmkl_avx512.so.21.150.770.7710.000.00Math (%): 100.00
mkl_blas_avx512_dgemm_kernel_nocopy_TN_b0libmkl_avx512.so.21.090.730.7310.000.00Math (%): 100.00
qmcplusplus::BsplineFunctor<double>::evaluateV(int, int, int, double const*, double*) const+exec1.010.670.6710.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 302 - BsplineFunctor.h:236-241 - exec0.90.60.610.000.00
Loop 300 - BsplineFunctor.h:246-260 - exec0.10.070.0710.000.00
Loop 301 - BsplineFunctor.h:236-241 - exec00000.000.00
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int)+exec10.670.6710.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 327 - TwoBodyJastrowRef.h:322-329 - exec0.320.220.2210.000.00
Loop 323 - TwoBodyJastrowRef.h:340-345 - exec0.240.160.1610.000.00
Loop 325 - TwoBodyJastrowRef.h:340-345 - exec0.220.140.1410.000.00
Loop 324 - TwoBodyJastrowRef.h:340-345 - exec0.210.140.1410.000.00
Loop 329 - TwoBodyJastrowRef.h:266-271 - exec [...]00000.000.00
Loop 326 - TwoBodyJastrowRef.h:322-329 - exec00000.000.00
Loop 328 - TwoBodyJastrowRef.h:266-271 - exec [...]00000.000.00
mkl_blas_avx512_dgemv_n_intrinsicslibmkl_avx512.so.20.930.620.6210.000.00Math (%): 100.00
qmcplusplus::BsplineFunctor<double>::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+exec0.750.510.5110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 299 - BsplineFunctor.h:291-297 - exec0.620.420.4210.000.00
Loop 297 - BsplineFunctor.h:302-335 - exec0.070.050.0510.000.00
Loop 298 - BsplineFunctor.h:291-298 - exec00000.000.00
__nss_database_lookuplibc.so.60.70.470.4710.000.00Others (%): 100.00
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.610.410.4110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 318 - TwoBodyJastrowRef.h:153-154 - exec0.160.110.1110.000.00
Loop 319 - TwoBodyJastrowRef.h:153-154 - exec0.150.10.110.000.00
Loop 317 - TwoBodyJastrowRef.h:153-154 - exec0.140.090.0910.000.00
Loop 321 - stl_numeric.h:140-141 - exec [...]0.130.090.0910.000.00
Loop 322 - TwoBodyJastrowRef.h:266-271 - exec [...]0.010010.000.00
Loop 315 - TwoBodyJastrowRef.h:153-154 - exec00000.000.00
Loop 320 - TwoBodyJastrowRef.h:0-0 - exec [...]00000.000.00
Loop 314 - TwoBodyJastrowRef.h:153-154 - exec00000.000.00
Loop 316 - TwoBodyJastrowRef.h:153-154 - exec00000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<...+exec0.550.360.3610.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 956 - DiracDeterminantRef.cpp:157-178 - exec [...]+00000.000.00
Loop 957 - inner_product.hpp:81-82 - exec [...]0.550.360.3610.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratio(qmcplusplus::ParticleSet&, int)+exec0.490.320.3210.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 955 - inner_product.hpp:81-82 - exec0.470.310.3110.000.00
Loop 954 - DiracDeterminantRef.cpp:0-0 - exec00000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evalGrad(qmcplusplus::ParticleSet&, int)+exec0.460.30.310.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 945 - inner_product.hpp:154-154 - exec [...]0.460.30.310.000.00
Loop 944 - inner_product.hpp:154-154 - exec [...]00000.000.00
__intel_avx_rep_memcpy+exec0.410.270.2810.000.00Memory (%): 100.00
Loop 1467 - - exec00000.000.00
Loop 1468 - - exec00000.000.00
qmcplusplus::DiracMatrix<double, double>::invert_transpose(qmcplusplus::Matrix<double, std::allocator<double> > const&, qmcplusplus::Matrix<double, std::allocator<double> >&, double&, double&)+exec0.330.220.2210.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 929 - inner_product.hpp:209-211 - exec+00000.000.00
Loop 930 - inner_product.hpp:210-211 - exec0.330.220.2210.000.00
Loop 928 - inner_product.hpp:210-211 - exec00000.000.00
Loop 924 - DiracMatrix.h:30-34 - exec [...]00000.000.00
Loop 927 - DiracMatrix.h:111-112 - exec00000.000.00
Loop 925 - DiracMatrix.h:30-34 - exec [...]00000.000.00
Loop 926 - DiracMatrix.h:111-112 - exec00000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.320.210.2110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 946 - inner_product.hpp:154-154 - exec [...]0.280.190.1810.000.00
Loop 949 - inner_product.hpp:81-82 - exec0.040.020.0210.000.00
Loop 947 - inner_product.hpp:154-154 - exec [...]00000.000.00
Loop 948 - inner_product.hpp:81-82 - exec [...]00000.000.00
mkl_blas_avx512_dgemm_kernel_nocopy_NN_b0libmkl_avx512.so.20.230.160.1610.000.00Math (%): 100.00
qmcplusplus::BsplineAllocator<double, 64ul, qmcplusplus::Mallocator<double, 64ul> >::setCoefficientsForOrbitals(int, int, Array<double, 3u>&, multi_UBspline_3d_d*) [clone .extracted]+exec0.220.140.1410.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 810 - BsplineAllocator.hpp:171-180 - exec [...]+00000.000.00
Loop 812 - BsplineAllocator.hpp:179-180 - exec0.220.140.1410.000.00
Loop 811 - BsplineAllocator.hpp:179-180 - exec00000.000.00
Loop 809 - BsplineAllocator.hpp:179-180 - exec00000.000.00
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ...+exec0.160.110.1110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 331 - TwoBodyJastrowRef.h:420-425 - exec [...]00000.000.00
Loop 332 - TwoBodyJastrowRef.h:265-418 - exec [...]+00000.000.00
Loop 333 - TwoBodyJastrowRef.h:265-418 - exec [...]+00000.000.00
Loop 346 - TwoBodyJastrowRef.h:373-374 - exec0.030.020.0210.000.00
Loop 348 - stl_numeric.h:140-141 - exec [...]0.030.020.0210.000.00
Loop 342 - TwoBodyJastrowRef.h:379-380 - exec0.020.010.0110.000.00
Loop 340 - TwoBodyJastrowRef.h:379-380 - exec0.020.010.0110.000.00
Loop 338 - TwoBodyJastrowRef.h:386-389 - exec0.010.010.0110.000.00
Loop 335 - TwoBodyJastrowRef.h:395-396 - exec0.010.010.0110.000.00
Loop 337 - TwoBodyJastrowRef.h:395-396 - exec0.010.010.0110.000.00
Loop 336 - TwoBodyJastrowRef.h:395-396 - exec0.010010.000.00
Loop 341 - TwoBodyJastrowRef.h:379-380 - exec00000.000.00
Loop 347 - TwoBodyJastrowRef.h:0-0 - exec [...]00000.000.00
Loop 334 - TwoBodyJastrowRef.h:386-389 - exec00000.000.00
Loop 349 - TwoBodyJastrowRef.h:266-271 - exec [...]00000.000.00
Loop 344 - TwoBodyJastrowRef.h:379-380 - exec00000.000.00
Loop 343 - TwoBodyJastrowRef.h:379-380 - exec00000.000.00
Loop 339 - TwoBodyJastrowRef.h:379-380 - exec00000.000.00
Loop 345 - TwoBodyJastrowRef.h:373-374 - exec00000.000.00
qmcplusplus::DistanceTableBA<double, 3u, 39>::evaluate(qmcplusplus::ParticleSet&)+exec0.150.10.110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1171 - DistanceTableBA.h:88-102 - exec [...]+00000.000.00
Loop 1172 - DistanceTableBA.h:89-99 - exec [...]+00000.000.00
Loop 1173 - DistanceTableBA.h:99-99 - exec [...]0.150.10.110.000.00
main.extracted.104+exec0.120.080.0810.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 36 - new_allocator.h:130-168 - exec [...]+00000.000.00
Loop 39 - miniqmc.cpp:472-488 - exec [...]+00000.000.00
Loop 40 - miniqmc.cpp:476-488 - exec [...]+0.090.060.0610.000.00
Loop 41 - miniqmc.cpp:478-488 - exec [...]0.020.010.0110.000.00
Loop 43 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 44 - random.tcc:404-409 - exec00000.000.00
Loop 45 - random.tcc:412-417 - exec00000.000.00
Loop 38 - stl_algobase.h:918-918 - exec [...]00000.000.00
Loop 49 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 50 - random.tcc:404-409 - exec00000.000.00
Loop 51 - random.tcc:412-417 - exec00000.000.00
Loop 37 - stl_algobase.h:918-918 - exec [...]00000.000.00
Loop 46 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 48 - random.tcc:412-417 - exec00000.000.00
Loop 47 - random.tcc:404-409 - exec00000.000.00
Loop 42 - NonLocalPP.hpp:111-111 - exec [...]00000.000.00
Loop 52 - random.tcc:404-3371 - exec [...]+00000.000.00
Loop 60 - RandomGenerator.h:51-55 - exec [...]+0.010010.000.00
Loop 61 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 63 - random.tcc:412-417 - exec00000.000.00
Loop 62 - random.tcc:404-409 - exec00000.000.00
Loop 64 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 65 - random.tcc:404-409 - exec00000.000.00
Loop 66 - random.tcc:412-417 - exec00000.000.00
Loop 57 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 58 - random.tcc:404-409 - exec00000.000.00
Loop 59 - random.tcc:412-417 - exec00000.000.00
Loop 54 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 56 - random.tcc:412-417 - exec00000.000.00
Loop 55 - random.tcc:404-409 - exec00000.000.00
Loop 53 - miniqmc.cpp:422-453 - exec [...]00000.000.00
Loop 67 - StdRandom.h:101-102 - exec [...]+00000.000.00
Loop 68 - random.tcc:404-3365 - exec [...]+00000.000.00
Loop 69 - random.tcc:404-409 - exec00000.000.00
Loop 70 - random.tcc:412-417 - exec00000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector&l...+exec0.10.070.0710.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 942 - inner_product.hpp:82-154 - exec [...]+0.010010.000.00
Loop 943 - inner_product.hpp:82-154 - exec [...]0.10.060.0610.000.00
std::map<qmcplusplus::StackKeyParam<2>, double, std::less<qmcplusplus::StackKeyParam<2> >, std::allocator<std::pair<qmcplusplus::StackKeyParam<2> const, double> > >::operator[](qmcplusplus::StackKeyParam<2> c...+exec0.10.070.0710.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1246 - stl_tree.h:782-1952 - exec [...]0.080.050.0510.000.00
unknown_function[vdso]0.090.060.0610.000.00OMP (%): 100.00
mkl_lapack_xdlaswplibmkl_core.so.20.080.050.0510.000.00Math (%): 100.00
mkl_blas_avx512_dtrsm_kernel_ll_0libmkl_avx512.so.20.070.040.0410.000.00Math (%): 100.00
qmcplusplus::TimerType<qmcplusplus::CPUClock>::start()+exec0.070.040.0410.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1243 - NewTimer.cpp:39-54 - exec [...]00000.000.00
Loop 1242 - NewTimer.cpp:53-54 - exec00000.000.00
mkl_blas_avx512_dgemm_dcopy_down24_ealibmkl_avx512.so.20.070.050.0510.000.00Math (%): 100.00
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.070.050.0510.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 243 - OneBodyJastrowRef.h:190-191 - exec0.040.020.0210.000.00
Loop 235 - stl_numeric.h:140-141 - exec [...]0.010.010.0110.000.00
Loop 240 - OneBodyJastrowRef.h:196-197 - exec0.010010.000.00
Loop 241 - OneBodyJastrowRef.h:196-197 - exec0.010.010.0110.000.00
Loop 239 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 234 - OneBodyJastrowRef.h:0-0 - exec [...]00000.000.00
Loop 236 - OneBodyJastrowRef.h:190-191 - exec00000.000.00
Loop 237 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 238 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 242 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
__kmp_api_omp_get_levellibiomp5.so0.060.040.0410.000.00OMP (%): 100.00
mkl_blas_avx512_dgemm_dcopy_right8_ealibmkl_avx512.so.20.050.040.0310.000.00Math (%): 100.00
qmcplusplus::TimerType<qmcplusplus::CPUClock>::stop()+exec0.040.030.0310.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1244 - NewTimer.cpp:99-100 - exec0.010010.000.00
Loop 1245 - NewTimer.cpp:86-100 - exec [...]00000.000.00
__kmp_elapsedlibiomp5.so0.040.020.0210.000.00OMP (%): 100.00
qmcplusplus::Vector<double, std::allocator<double> >::resize(unsigned long, double)+exec0.040.030.0210.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 283 - stl_algobase.h:930-931 - exec0.040.030.0210.000.00
Loop 280 - stl_algobase.h:930-931 - exec00000.000.00
Loop 281 - stl_algobase.h:930-931 - exec00000.000.00
Loop 282 - stl_algobase.h:930-931 - exec [...]00000.000.00
unknown_kernel_regionkernel0.040.020.0210.000.00System (%): 100.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::resize(int, int)+exec0.040.030.0310.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 961 - stl_algobase.h:918-918 - exec [...]0.040.030.0310.000.00
Loop 960 - stl_algobase.h:918-918 - exec [...]00000.000.00
Loop 959 - stl_algobase.h:918-918 - exec [...]00000.000.00
Loop 958 - stl_algobase.h:918-918 - exec [...]00000.000.00
__kmp_get_ancestor_thread_numlibiomp5.so0.030.020.0210.000.00OMP (%): 100.00
__kmp_get_global_thread_id_reglibiomp5.so0.030.020.0210.000.00OMP (%): 100.00
qmcplusplus::ParticleSet::makeMove(int, qmcplusplus::TinyVector<double, 3u> const&)+exec0.030.020.0210.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1099 - ParticleSet.cpp:290-291 - exec [...]0.010.010.0110.000.00
_dl_deallocate_tlsld-linux-x86-64.so.20.030.020.0210.000.00OMP (%): 100.00
mkl_blas_avx512_dgemm_kernel_nocopy_NN_b1libmkl_avx512.so.20.020.010.0110.000.00Math (%): 100.00
__tls_get_addrld-linux-x86-64.so.20.020.010.0110.000.00System (%): 66.67
OMP (%): 33.33
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratio(qmcplusplus::ParticleSet&, int)+exec0.020.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 253 - OneBodyJastrowRef.h:147-150 - exec [...]0.010010.000.00
Loop 252 - OneBodyJastrowRef.h:155-159 - exec [...]00000.000.00
std::map<qmcplusplus::StackKeyParam<2>, long, std::less<qmcplusplus::StackKeyParam<2> >, std::allocator<std::pair<qmcplusplus::StackKeyParam<2> const, long> > >::operator[](qmcplusplus::StackKeyParam<2> const...+exec0.020.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1247 - stl_tree.h:782-1952 - exec [...]0.020.010.0110.000.00
void qmcplusplus::expandSuperCell<qmcplusplus::ParticleSet>(qmcplusplus::ParticleSet&, qmcplusplus::Tensor<int, 3u> const&)+exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1188 - stl_algobase.h:386-386 - exec [...]00000.000.00
Loop 1182 - OhmmsVector.h:61-210 - exec [...]00000.000.00
Loop 1192 - ParticleIOUtility.h:37-40 - exec [...]00000.000.00
Loop 1191 - stl_algobase.h:386-386 - exec [...]+00000.000.00
Loop 1190 - TinyVectorOps.h:49-49 - exec [...]00000.000.00
Loop 1189 - stl_algobase.h:386-386 - exec [...]00000.000.00
Loop 1183 - ParticleIOUtility.h:65-91 - exec [...]+00000.000.00
Loop 1184 - ParticleIOUtility.h:67-91 - exec [...]+00000.000.00
Loop 1185 - ParticleIOUtility.h:68-91 - exec [...]+00000.000.00
Loop 1186 - ParticleIOUtility.h:69-91 - exec [...]+00000.000.00
Loop 1187 - ParticleIOUtility.h:70-91 - exec [...]0.010010.000.00
mkl_serv_cbwr_getlibmkl_core.so.20.010010.000.00Math (%): 100.00
qmcplusplus::DistanceTableBA<double, 3u, 39>::update(int)exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
mkl_serv_cpu_detectlibmkl_core.so.20.010010.000.00Math (%): 100.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::acceptMove(qmcplusplus::ParticleSet&, int)+exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 952 - DelayedUpdate.h:137-138 - exec00000.000.00
Loop 953 - DelayedUpdate.h:137-138 - exec00000.000.00
Loop 951 - DelayedUpdate.h:147-148 - exec00000.000.00
Loop 950 - DelayedUpdate.h:147-148 - exec00000.000.00
inflate_fastlibmpi.so.12.0.00.010010.000.00MPI (%): 100.00
qmcplusplus::WaveFunction::ratio(qmcplusplus::ParticleSet&, int)+exec0.010.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 107 - WaveFunction.cpp:216-219 - exec [...]0.010.010.0110.000.00
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ...+exec0.010.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 261 - OneBodyJastrowRef.h:173-173 - exec [...]+00000.000.00
Loop 260 - TinyVectorOps.h:49-49 - exec [...]00000.000.00
Loop 255 - OneBodyJastrowRef.h:0-0 - exec00000.000.00
Loop 258 - OneBodyJastrowRef.h:175-176 - exec00000.000.00
Loop 257 - OneBodyJastrowRef.h:175-176 - exec00000.000.00
Loop 256 - stl_numeric.h:140-141 - exec00000.000.00
Loop 262 - OneBodyJastrowRef.h:113-198 - exec [...]+00000.000.00
Loop 269 - OneBodyJastrowRef.h:196-197 - exec0.010.010.0110.000.00
Loop 270 - OneBodyJastrowRef.h:190-191 - exec00000.000.00
Loop 264 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 268 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 271 - stl_numeric.h:140-141 - exec [...]00000.000.00
Loop 272 - stl_numeric.h:140-141 - exec [...]00000.000.00
Loop 265 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 263 - OneBodyJastrowRef.h:190-191 - exec00000.000.00
Loop 267 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 266 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 259 - OneBodyJastrowRef.h:173-173 - exec [...]00000.000.00
Loop 254 - OneBodyJastrowRef.h:175-176 - exec00000.000.00
adler32libmpi.so.12.0.00.010010.000.00MPI (%): 100.00
qmcplusplus::ParticleSet::acceptMove(int)+exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1107 - ParticleSet.cpp:337-338 - exec [...]00000.000.00
mkl_blas_avx512_xdgemvlibmkl_avx512.so.20.010010.000.00Math (%): 100.00
void qmcplusplus::DelayedUpdate<double, double>::getInvRow<qmcplusplus::Vector<double, std::allocator<double> > >(qmcplusplus::Matrix<double, std::allocator<double> > const&, int, qmcplusplus::Vector<double, std::...exec0.010.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
mkl_blas_avx512_d_generic_fullacopybcopylibmkl_avx512.so.20.010010.000.00Math (%): 100.00
qmcplusplus::DistanceTableAA<double, 3u, 39>::evaluate(qmcplusplus::ParticleSet&, int)exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
_dl_rtld_di_serinfold-linux-x86-64.so.20.010.010.0110.000.00System (%): 100.00
_intel_fast_memsetexec0.010.010.0110.000.00Memory (%): 100.00
qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 106 - WaveFunction.cpp:204-207 - exec [...]0.010010.000.00
qmcplusplus::TimerManager<qmcplusplus::TimerType<qmcplusplus::CPUClock> >::pop_timer(qmcplusplus::TimerType<qmcplusplus::CPUClock>*)+exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 1299 - TimerManager.cpp:97-104 - exec [...]00000.000.00
Loop 1298 - basic_string.h:236-277 - exec [...]00000.000.00
mkl_blas_avx512_xdgerlibmkl_avx512.so.20.010.010.0110.000.00Math (%): 100.00
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evalGrad(qmcplusplus::ParticleSet&, int)exec0.010.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
qmcplusplus::TimerManager<qmcplusplus::TimerType<qmcplusplus::CPUClock> >::push_timer(qmcplusplus::TimerType<qmcplusplus::CPUClock>*)exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
__libm_exp_l9exec0.010.010.0110.000.00Math (%): 100.00
qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int)+exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 105 - WaveFunction.cpp:191-194 - exec [...]0.010010.000.00
qmcplusplus::DistanceTableBA<double, 3u, 39>::evaluate(qmcplusplus::ParticleSet&, int)exec0.010010.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
__kmp_api_omp_in_parallellibiomp5.so0.010010.000.00OMP (%): 100.00
mkl_blas_errchk_dgerlibmkl_intel_lp64.so.20.010010.000.00Math (%): 100.00
mkl_serv_get_dynamic@pltlibmkl_intel_thread.so.20.010010.000.00Math (%): 100.00
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratio(qmcplusplus::ParticleSet&, int)+exec0.010.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 330 - TwoBodyJastrowRef.h:125-130 - exec [...]00000.000.00
mkl_blas_avx512_xdswaplibmkl_avx512.so.20.010010.000.00Math (%): 100.00
mkl_lapack_dlaswplibmkl_intel_thread.so.20.010010.000.00Math (%): 100.00
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int)+exec0.010.010.0110.000.00Exe (%): 100.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2023.0.0 (2023.0.0.20221201) --driver-mode=g++ --intel -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/miniqmc/src -I /home/kcamus/qaas_runs/169-451-1869/intel/miniqmc/build/build/src -I /home/kcam...
Loop 249 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 248 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 246 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 244 - OneBodyJastrowRef.h:190-191 - exec00000.000.00
Loop 251 - OneBodyJastrowRef.h:190-191 - exec00000.000.00
Loop 247 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 245 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
Loop 250 - OneBodyJastrowRef.h:196-197 - exec00000.000.00
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