options

Functions and Loops

79 loops and 198 functions have been discarded from the report because their coverage is lower than the threshold set by object_coverage_threshold (0.01%). It represents about 0% of the application. To include them, change the value of object_coverage_threshold in the experiment directory configuration file, then rerun the command with the additionnal parameter --force-static-analysis

Colums Filter

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 GFLOPS 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_0GFLOPS run_0Compilation Options
miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&)+exec27.2622.822.241120.680.63Exe (%): 100.00260.14clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 870 - MultiBsplineRef.hpp:42-71 - exec [...]+0.020.040.011120.010.0138.65
Loop 871 - MultiBsplineRef.hpp:63-71 - exec+0.010.030.011120.010.01401.91
Loop 872 - MultiBsplineRef.hpp:64-71 - exec+0.010.030.011120.010.01810.42
Loop 873 - MultiBsplineRef.hpp:68-70 - exec27.1922.7422.191120.680.63260.15
Loop 869 - einspline_spo_ref.hpp:183-187 - exec [...]00.030440.010.010.00
mkl_blas_avx512_dgemm_kernel_0libmkl_avx512.so.213.7511.1811.221120.200.21Math (%): 100.001342.28
miniqmcreference::einspline_spo_ref<double>::evaluate(qmcplusplus::ParticleSet const&, int, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<qmcplusplus::TinyVector<double, 3u>, std::allocator<...+exec12.8913.410.521120.550.51Exe (%): 100.00765.90clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 876 - MultiBsplineRef.hpp:187-286 - exec [...]+0.020.060.021120.020.0135.48
Loop 877 - MultiBsplineRef.hpp:276-286 - exec0.460.460.371120.050.04190.73
Loop 878 - MultiBsplineRef.hpp:226-262 - exec [...]+00.0101070.000.000.00
Loop 879 - MultiBsplineRef.hpp:227-262 - exec [...]+0.020.040.011120.010.011388.24
Loop 880 - MultiBsplineRef.hpp:242-262 - exec [...]11.3812.149.281120.530.48858.96
Loop 874 - einspline_spo_ref.hpp:219-227 - exec [...]+000100.000.000.00
Loop 875 - einspline_spo_ref.hpp:223-227 - exec [...]0.991.040.811120.100.080.00
mkl_blas_avx512_dgemm_kernel_nocopy_TN_b1libmkl_avx512.so.212.8110.4510.451120.190.14Math (%): 100.001336.62
qmcplusplus::SoaDistanceTableABOMPTarget<double, 3u, 40>::evaluate(qmcplusplus::ParticleSet&)+exec9.938.248.11120.210.19Exe (%): 100.00291.51clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 2096 - stl_construct.h:98-107 - exec [...]00000.000.000.00
Loop 2094 - SoaDistanceTableABOMPTarget.h:194-196 - exec+00000.000.000.00
Loop 2093 - SoaDistanceTableABOMPTarget.h:195-196 - exec00000.000.000.00
Loop 2092 - SoaDistanceTableABOMPTarget.h:194-196 - exec00000.000.000.00
Loop 2088 - SoaDistanceTableABOMPTarget.h:214-228 - exec [...]+00.0201030.000.000.00
Loop 2089 - SoaDistanceTableABOMPTarget.h:215-228 - exec [...]+0.010.030.011120.010.0170.35
Loop 2090 - SoaDistanceTableABOMPTarget.h:228-228 - exec [...]9.918.218.081120.210.19292.13
Loop 2091 - SoaDistanceTableABOMPTarget.h:194-196 - exec00.010290.000.000.00
Loop 2095 - VectorSoAContainer.h:151-176 - exec [...]00010.000.000.00
qmcplusplus::SoaDistanceTableAAOMPTarget<double, 3u, 40>::update(int)+exec5.324.594.341120.200.16Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1864 - SoaDistanceTableAAOMPTarget.h:440-442 - exec [...]5.324.584.341120.200.160.00
void qmcplusplus::DTD_BConds<double, 3u, 40>::computeDistances<qmcplusplus::TinyVector<double, 3u>, qmcplusplus::VectorSoAContainer<double, 3u, qmcplusplus::Mallocator<double, 64ul> >, qmcplusplus::VectorSoAContainer<double, 3...+exec2.031.91.661120.140.12Exe (%): 100.001223.97clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1370 - ParticleBConds3DSoa.h:235-256 - exec2.021.891.641120.140.121238.77
Loop 1369 - ParticleBConds3DSoa.h:235-256 - exec000440.000.000.00
Loop 1368 - ParticleBConds3DSoa.h:235-255 - exec00.010140.000.000.00
kmp_flag_64<false, true>::wait(kmp_info*, int, void*)libiomp5.so1.983.681.611120.610.49OMP (%): 100.000.00
__intel_avx_rep_memset+exec1.691.541.381120.100.08Memory (%): 100.000.23
Loop 2345 - - exec0.970.940.791120.080.060.34
mkl_blas_avx512_dgemv_t_intrinsicslibmkl_avx512.so.21.631.461.331120.100.08Math (%): 100.00347.59
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&)+exec1.361.361.111120.110.09Exe (%): 100.0060.88clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 389 - TwoBodyJastrowRef.h:107-132 - exec [...]+0.010.030.011100.010.0145.45
Loop 390 - BsplineFunctor.h:229-260 - exec [...]+0.030.040.021120.010.01387.69
Loop 393 - BsplineFunctor.h:236-241 - exec [...]1.221.270.991120.110.090.74
Loop 391 - BsplineFunctor.h:246-260 - exec0.10.160.081120.030.02732.92
Loop 392 - BsplineFunctor.h:236-241 - exec00000.000.000.00
mkl_blas_avx512_dgemv_n_intrinsicslibmkl_avx512.so.21.11.020.91120.090.07Math (%): 100.00355.85
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::acceptMove(qmcplusplus::ParticleSet&, int)+exec0.930.860.761120.070.06Exe (%): 100.00320.04clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 363 - TwoBodyJastrowRef.h:324-331 - exec0.260.280.211120.040.03322.05
Loop 357 - TwoBodyJastrowRef.h:342-347 - exec0.220.240.181120.040.03276.97
Loop 359 - TwoBodyJastrowRef.h:342-347 - exec0.210.230.171120.030.03402.33
Loop 361 - TwoBodyJastrowRef.h:342-347 - exec0.210.240.171120.040.03329.45
Loop 360 - TwoBodyJastrowRef.h:342-347 - exec00000.000.000.00
Loop 365 - TwoBodyJastrowRef.h:269-274 - exec [...]00.010700.000.000.00
Loop 362 - TwoBodyJastrowRef.h:324-331 - exec00000.000.000.00
Loop 364 - TwoBodyJastrowRef.h:269-274 - exec [...]00000.000.000.00
Loop 356 - TwoBodyJastrowRef.h:342-347 - exec00000.000.000.00
Loop 358 - TwoBodyJastrowRef.h:342-347 - exec00000.000.000.00
mkl_blas_avx512_dgemm_kernel_nocopy_TN_b0libmkl_avx512.so.20.840.820.681120.070.06Math (%): 100.001772.28
unknown_functionUnknown module0.70.670.571120.070.06Others (%): 100.000.04
qmcplusplus::BsplineFunctor<double>::evaluateVGL(int, int, int, double const*, double*, double*, double*, double*, int*) const+exec0.660.660.541120.070.06Exe (%): 100.0080.23clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 332 - BsplineFunctor.h:291-297 - exec0.540.560.441120.060.050.35
Loop 330 - BsplineFunctor.h:303-338 - exec0.080.10.071120.020.02584.44
Loop 331 - BsplineFunctor.h:291-298 - exec00010.000.000.00
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.650.620.531120.070.05Exe (%): 100.00225.47clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 352 - TwoBodyJastrowRef.h:155-156 - exec0.180.20.151120.030.03199.62
Loop 350 - TwoBodyJastrowRef.h:155-156 - exec0.180.20.141120.030.02289.37
Loop 351 - TwoBodyJastrowRef.h:155-156 - exec0.170.230.141120.030.03242.62
Loop 354 - stl_numeric.h:126-127 - exec [...]0.090.120.071120.020.02204.95
Loop 355 - TwoBodyJastrowRef.h:269-274 - exec [...]00.020750.010.000.00
Loop 347 - TwoBodyJastrowRef.h:155-156 - exec00000.000.000.00
Loop 348 - TwoBodyJastrowRef.h:155-156 - exec00000.000.000.00
Loop 353 - TwoBodyJastrowRef.h:0-0 - exec [...]000190.000.000.00
Loop 349 - TwoBodyJastrowRef.h:155-156 - exec00000.000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<...+exec0.640.550.531120.020.02Exe (%): 100.00159.53clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 992 - inner_product.hpp:82-155 - exec [...]+00.0201040.000.000.00
Loop 994 - inner_product.hpp:155-155 - exec [...]0.440.430.361120.030.03176.37
Loop 996 - inner_product.hpp:82-83 - exec0.20.230.171120.030.02123.02
Loop 993 - inner_product.hpp:155-155 - exec [...]00000.000.000.00
Loop 995 - inner_product.hpp:82-83 - exec00000.000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evalGrad(qmcplusplus::ParticleSet&, int)+exec0.470.490.381120.050.04Exe (%): 100.00168.15clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 981 - inner_product.hpp:155-155 - exec [...]0.460.480.381120.060.04167.82
Loop 980 - inner_product.hpp:155-155 - exec [...]00000.000.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.460.470.371120.060.04Exe (%): 100.00212.82clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 982 - inner_product.hpp:155-155 - exec [...]0.350.380.281120.050.04225.34
Loop 985 - inner_product.hpp:82-83 - exec0.10.130.081120.030.02193.41
Loop 983 - inner_product.hpp:155-155 - exec [...]00000.000.000.00
Loop 984 - DiracDeterminantRef.cpp:0-0 - exec00010.000.000.00
unknown_kernel_regionkernel0.410.490.341120.120.09System (%): 85.92
Math (%): 13.88
OMP (%): 0.19
1.01
qmcplusplus::SPOSet::evaluateDetRatios(qmcplusplus::VirtualParticleSet const&, qmcplusplus::Vector<double, std::allocator<double> >&, qmcplusplus::Vector<double, std::allocator<double> > const&, std::vector<double, st...+exec0.360.380.31120.050.04Exe (%): 100.00282.26clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 881 - inner_product.hpp:82-83 - exec [...]+00.0201010.010.000.00
Loop 883 - inner_product.hpp:82-83 - exec0.360.370.291120.050.04290.63
Loop 882 - inner_product.hpp:82-83 - exec00080.000.000.00
qmcplusplus::DiracMatrix<double, double>::invert_transpose(qmcplusplus::Matrix<double, std::allocator<double> > const&, qmcplusplus::Matrix<double, std::allocator<double> >&, double&, double&)+exec0.280.250.231120.020.01Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 954 - DiracMatrix.h:112-113 - exec00050.000.000.00
Loop 953 - DiracMatrix.h:112-113 - exec00000.000.000.00
Loop 951 - DiracMatrix.h:31-35 - exec [...]00000.000.000.00
Loop 957 - inner_product.hpp:211-212 - exec00000.000.000.00
Loop 952 - DiracMatrix.h:31-35 - exec [...]00000.000.000.00
Loop 956 - inner_product.hpp:211-212 - exec00000.000.000.00
Loop 960 - inner_product.hpp:210-212 - exec+00000.000.000.00
Loop 962 - inner_product.hpp:211-212 - exec0.140.160.121120.020.020.00
Loop 961 - inner_product.hpp:211-212 - exec0.140.160.111120.020.020.00
Loop 959 - inner_product.hpp:211-212 - exec00000.000.000.00
Loop 958 - inner_product.hpp:211-212 - exec00000.000.000.00
Loop 955 - Mallocator.hpp:69-69 - exec [...]00000.000.000.00
__intel_avx_rep_memcpy+exec0.210.250.171120.030.03Memory (%): 100.000.04
Loop 2343 - - exec00000.000.000.00
Loop 2344 - - exec00000.000.000.00
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ...+exec0.160.160.131120.020.02Exe (%): 100.00325.41clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 367 - TwoBodyJastrowRef.h:423-427 - exec [...]000180.000.000.00
Loop 368 - TwoBodyJastrowRef.h:268-420 - exec [...]+00000.000.000.00
Loop 370 - stl_algobase.h:752-754 - exec [...]+00.010900.000.000.00
Loop 383 - TwoBodyJastrowRef.h:381-382 - exec0.030.050.021120.010.01206.76
Loop 379 - TwoBodyJastrowRef.h:381-382 - exec0.030.050.021120.010.01209.43
Loop 381 - TwoBodyJastrowRef.h:381-382 - exec0.030.050.021120.010.01204.06
Loop 377 - TwoBodyJastrowRef.h:388-391 - exec0.020.040.021120.010.01430.14
Loop 385 - TwoBodyJastrowRef.h:375-376 - exec0.020.040.021120.010.01308.86
Loop 375 - TwoBodyJastrowRef.h:397-398 - exec0.010.030.011120.010.01424.61
Loop 374 - TwoBodyJastrowRef.h:397-398 - exec0.010.030.011120.010.01420.91
Loop 387 - stl_numeric.h:126-127 - exec [...]0.010.0201120.010.000.00
Loop 373 - TwoBodyJastrowRef.h:397-398 - exec0.010.020.011120.010.01423.56
Loop 378 - TwoBodyJastrowRef.h:381-382 - exec00040.000.000.00
Loop 380 - TwoBodyJastrowRef.h:381-382 - exec00000.000.000.00
Loop 369 - TwoBodyJastrowRef.h:397-398 - exec00040.000.000.00
Loop 386 - stl_numeric.h:126-127 - exec [...]00000.000.000.00
Loop 376 - TwoBodyJastrowRef.h:388-391 - exec00000.000.000.00
Loop 382 - TwoBodyJastrowRef.h:381-382 - exec00060.000.000.00
Loop 371 - TwoBodyJastrowRef.h:397-398 - exec00070.000.000.00
Loop 384 - TwoBodyJastrowRef.h:375-376 - exec00020.000.000.00
Loop 372 - TwoBodyJastrowRef.h:397-398 - exec00040.000.000.00
Loop 388 - TwoBodyJastrowRef.h:269-274 - exec [...]000140.000.000.00
mkl_lapack_xdlaswplibmkl_core.so.20.130.140.11120.020.02Math (%): 100.000.00
mkl_blas_avx512_dgemm_kernel_nocopy_NN_b0libmkl_avx512.so.20.130.170.111120.030.02Math (%): 100.001406.15
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::evaluateLog(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector&l...+exec0.110.110.091120.010.01Exe (%): 100.00187.92clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 975 - inner_product.hpp:82-155 - exec [...]+00060.000.000.00
Loop 979 - inner_product.hpp:155-155 - exec [...]0.090.10.071120.020.01181.25
Loop 977 - inner_product.hpp:82-83 - exec0.020.040.021120.010.01210.76
Loop 976 - inner_product.hpp:82-83 - exec00000.000.000.00
Loop 978 - inner_product.hpp:155-155 - exec [...]00000.000.000.00
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.080.110.061120.020.02Exe (%): 100.00215.27clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 268 - OneBodyJastrowRef.h:186-187 - exec0.030.040.021120.010.01187.01
Loop 265 - OneBodyJastrowRef.h:192-193 - exec0.010.030.011120.010.01260.86
Loop 263 - OneBodyJastrowRef.h:192-193 - exec0.010.020.011120.010.01243.41
Loop 264 - OneBodyJastrowRef.h:192-193 - exec0.010.040.011120.010.01243.86
Loop 259 - OneBodyJastrowRef.h:186-187 - exec00000.000.000.00
Loop 258 - stl_numeric.h:126-127 - exec [...]00.0101120.000.000.00
Loop 260 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 261 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 262 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 257 - OneBodyJastrowRef.h:0-0 - exec [...]00000.000.000.00
Loop 267 - OneBodyJastrowRef.h:188-194 - exec+00000.000.000.00
Loop 266 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
qmcplusplus::NonLocalPP<double>::evaluate(qmcplusplus::ParticleSet const&, qmcplusplus::WaveFunction&)+exec0.070.090.061120.020.02Exe (%): 100.001.05clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 74 - OhmmsVector.h:48-210 - exec [...]00000.000.000.00
Loop 80 - stl_uninitialized.h:526-526 - exec [...]00000.000.000.00
Loop 81 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 79 - stl_uninitialized.h:526-526 - exec [...]00000.000.000.00
Loop 78 - NonLocalPP.hpp:110-111 - exec [...]00000.000.000.00
Loop 75 - NonLocalPP.hpp:122-135 - exec [...]+00.010530.000.000.00
Loop 76 - NonLocalPP.hpp:126-135 - exec [...]+0.060.090.051120.020.020.58
Loop 77 - NonLocalPP.hpp:131-132 - exec [...]0.010.020.01950.010.013.40
Loop 82 - stl_algobase.h:740-742 - exec00000.000.000.00
mkl_blas_avx512_dgemm_dcopy_right8_ealibmkl_avx512.so.20.070.10.061120.020.02Math (%): 100.000.00
mkl_blas_avx512_dtrsm_kernel_ll_0libmkl_avx512.so.20.060.080.051120.020.01Math (%): 100.001608.05
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&)+exec0.050.070.041120.020.01Exe (%): 100.0013.29clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 303 - OneBodyJastrowRef.h:134-155 - exec [...]+0.010.020760.010.000.00
Loop 305 - BsplineFunctor.h:229-260 - exec [...]+0.010.010.011050.010.0040.90
Loop 308 - BsplineFunctor.h:236-241 - exec [...]0.030.060.031120.010.011.78
Loop 307 - BsplineFunctor.h:236-241 - exec00000.000.000.00
Loop 306 - BsplineFunctor.h:246-260 - exec00050.000.000.00
Loop 304 - BsplineFunctor.h:166-181 - exec [...]00000.000.000.00
mkl_blas_avx512_dgemm_dcopy_down24_ealibmkl_avx512.so.20.040.060.031120.020.01Math (%): 100.006.40
__kmp_api_omp_get_levellibiomp5.so0.040.070.031120.020.01OMP (%): 100.007.53
mkl_blas_avx512_dgemm_kernel_nocopy_NN_b1libmkl_avx512.so.20.030.050.021120.010.01Math (%): 100.002348.87
qmcplusplus::TimerType<std::chrono::_V2::system_clock>::start()+exec0.030.060.031120.020.01Exe (%): 100.000.70clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1555 - NewTimer.cpp:53-54 - exec00.010130.000.000.00
Loop 1556 - NewTimer.cpp:39-54 - exec [...]00000.000.000.00
__kmp_get_global_thread_id_reglibiomp5.so0.030.070.031120.020.01OMP (%): 100.009.92
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::resize(int, int)+exec0.030.040.021110.010.01Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1004 - stl_algobase.h:740-742 - exec0.030.040.021110.010.010.00
Loop 999 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 1002 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 998 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 1001 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 1000 - stl_algobase.h:740-742 - exec00010.000.000.00
Loop 997 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 1003 - stl_algobase.h:741-742 - exec00000.000.000.00
kmp_flag_native<unsigned long long, (flag_type)1, true>::notdone_check()libiomp5.so0.030.060.021090.020.01OMP (%): 100.000.00
qmcplusplus::TimerType<std::chrono::_V2::system_clock>::stop()+exec0.030.060.021110.020.01Exe (%): 100.0015.15clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1558 - NewTimer.cpp:86-100 - exec [...]00000.000.000.00
Loop 1557 - NewTimer.cpp:99-100 - exec00.010130.000.000.00
__libm_exp_z0exec0.030.070.021120.020.02Math (%): 100.0053.75
__dynamic_castlibstdc++.so.6.0.250.030.070.031110.020.01Others (%): 100.001.18
main.extracted.110+exec0.020.040.011120.010.01Exe (%): 100.0047.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 23 - basic_string.h:180-224 - exec [...]00000.000.000.00
Loop 24 - new_allocator.h:101-125 - exec [...]+00000.000.000.00
Loop 26 - random.tcc:401-3332 - exec [...]+00000.000.000.00
Loop 28 - random.tcc:409-414 - exec00000.000.000.00
Loop 27 - random.tcc:401-406 - exec00000.000.000.00
Loop 54 - stl_algobase.h:741-742 - exec00000.000.000.00
Loop 55 - stl_algobase.h:740-742 - exec00000.000.000.00
Loop 57 - stl_algobase.h:740-742 - exec00050.000.000.00
Loop 29 - random.tcc:401-3332 - exec [...]+00000.000.000.00
Loop 30 - random.tcc:401-406 - exec00000.000.000.00
Loop 31 - random.tcc:409-414 - exec00000.000.000.00
Loop 56 - stl_algobase.h:741-742 - exec00000.000.000.00
Loop 32 - random.tcc:401-3332 - exec [...]+00000.000.000.00
Loop 34 - random.tcc:409-414 - exec00000.000.000.00
Loop 33 - random.tcc:401-406 - exec00000.000.000.00
Loop 35 - StdRandom.h:102-103 - exec [...]+00000.000.000.00
Loop 36 - miniqmc.cpp:429-458 - exec [...]0.010.030.011000.010.010.00
Loop 40 - random.tcc:401-3332 - exec [...]+00000.000.000.00
Loop 42 - random.tcc:409-414 - exec00000.000.000.00
Loop 41 - random.tcc:401-406 - exec00000.000.000.00
Loop 50 - StdRandom.h:102-103 - exec [...]+00080.000.000.00
Loop 51 - random.tcc:401-3332 - exec [...]+00.010180.000.000.00
Loop 53 - random.tcc:409-414 - exec00000.000.000.00
Loop 52 - random.tcc:401-406 - exec00010.000.000.00
Loop 43 - RandomGenerator.h:51-55 - exec [...]+00.010980.000.000.00
Loop 44 - random.tcc:401-3332 - exec [...]+0001100.000.000.00
Loop 45 - random.tcc:401-406 - exec00000.000.000.00
Loop 46 - random.tcc:409-414 - exec00000.000.000.00
Loop 47 - random.tcc:401-3332 - exec [...]+000460.000.000.00
Loop 48 - random.tcc:401-406 - exec00080.000.000.00
Loop 49 - random.tcc:409-414 - exec00000.000.000.00
Loop 37 - random.tcc:401-3332 - exec [...]+00000.000.000.00
Loop 38 - random.tcc:401-406 - exec00000.000.000.00
Loop 39 - random.tcc:409-414 - exec00000.000.000.00
Loop 25 - NonLocalPP.hpp:110-111 - exec [...]00000.000.000.00
qmcplusplus::Vector<double, std::allocator<double> >::resize(unsigned long, double)+exec0.020.040.021120.010.01Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 313 - stl_algobase.h:752-754 - exec0.020.040.021120.010.010.00
Loop 311 - stl_algobase.h:752-754 - exec00000.000.000.00
Loop 310 - stl_algobase.h:752-754 - exec00000.000.000.00
Loop 312 - stl_algobase.h:752-754 - exec00000.000.000.00
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evaluateGL(qmcplusplus::ParticleSet&, qmcplusplus::ParticleAttrib<qmcplusplus::TinyVector<double, 3u>, std::allocator<qmcplusplus::TinyVector<double, ...+exec0.020.020.011120.000.00Exe (%): 100.00355.01clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 287 - OneBodyJastrowRef.h:169-169 - exec [...]00000.000.000.00
Loop 281 - OneBodyJastrowRef.h:169-169 - exec [...]000160.000.000.00
Loop 284 - stl_numeric.h:126-127 - exec00070.000.000.00
Loop 289 - OneBodyJastrowRef.h:169-169 - exec [...]+00000.000.000.00
Loop 288 - TinyVectorOps.h:49-49 - exec [...]00000.000.000.00
Loop 285 - OneBodyJastrowRef.h:171-172 - exec00030.000.000.00
Loop 286 - OneBodyJastrowRef.h:171-172 - exec00000.000.000.00
Loop 282 - OneBodyJastrowRef.h:171-172 - exec00000.000.000.00
Loop 283 - OneBodyJastrowRef.h:0-0 - exec00000.000.000.00
Loop 290 - OneBodyJastrowRef.h:109-194 - exec [...]+000390.000.000.00
Loop 300 - OneBodyJastrowRef.h:186-187 - exec00.0101120.000.000.00
Loop 302 - stl_numeric.h:126-127 - exec [...]00.010920.000.000.00
Loop 301 - OneBodyJastrowRef.h:0-0 - exec [...]00000.000.000.00
Loop 296 - OneBodyJastrowRef.h:192-193 - exec00.0101080.000.000.00
Loop 295 - OneBodyJastrowRef.h:192-193 - exec00.0101100.000.000.00
Loop 293 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 297 - OneBodyJastrowRef.h:192-193 - exec00.0101070.000.000.00
Loop 292 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 299 - OneBodyJastrowRef.h:188-194 - exec+00000.000.000.00
Loop 298 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 294 - OneBodyJastrowRef.h:192-193 - exec00000.000.000.00
Loop 291 - OneBodyJastrowRef.h:186-187 - exec00000.000.000.00
__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&) co...libstdc++.so.6.0.250.020.040.021080.010.01Others (%): 100.003.40
__tls_get_addrld-2.28.so0.020.050.021100.010.01System (%): 88.44
OMP (%): 11.56
12.28
_dl_update_slotinfold-2.28.so0.020.050.021120.010.01System (%): 58.47
OMP (%): 41.53
12.58
qmcplusplus::SoaDistanceTableABOMPTarget<double, 3u, 40>::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector<double, 3u> const&, int, bool)exec0.020.040.011060.010.01Exe (%): 100.006.20clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
mkl_blas_avx512_xdgemvlibmkl_avx512.so.20.010.040.011040.010.01Math (%): 100.0011.40
_intel_fast_memsetexec0.010.020.011000.010.00Memory (%): 100.006.65
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::computeU3(qmcplusplus::ParticleSet&, int, double const*)+exec0.010.040.01900.010.01Exe (%): 100.004.20clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 329 - OneBodyJastrowRef.h:214-219 - exec [...]0.010.040.01880.010.012.20
Loop 328 - OneBodyJastrowRef.h:231-237 - exec [...]00000.000.000.00
qmcplusplus::ParticleSet::makeMove(int, qmcplusplus::TinyVector<double, 3u> const&, bool)exec0.010.040.01960.010.01Exe (%): 100.000.20clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
qmcplusplus::WaveFunction::evalGrad(qmcplusplus::ParticleSet&, int)+exec0.010.030.01840.010.01Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 101 - WaveFunction.cpp:185-188 - exec [...]0.010.010640.000.000.00
update_get_addrld-2.28.so0.010.020.011050.010.01OMP (%): 100.009.15
miniqmcreference::OneBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evalGrad(qmcplusplus::ParticleSet&, int)exec0.010.030.01860.010.00Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
__kmp_api_omp_in_parallellibiomp5.so0.010.030.01710.010.00OMP (%): 100.000.00
qmcplusplus::WaveFunction::evaluateRatios(qmcplusplus::VirtualParticleSet&, std::vector<double, std::allocator<double> >&)+exec0.010.030.01900.010.01Exe (%): 100.000.80clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 108 - WaveFunction.cpp:263-274 - exec [...]+00.020380.010.000.00
Loop 109 - WaveFunction.cpp:273-274 - exec00030.000.000.00
Loop 111 - WaveFunction.cpp:273-274 - exec00000.000.000.00
Loop 110 - WaveFunction.cpp:273-274 - exec000240.000.000.00
qmcplusplus::SoaDistanceTableAAOMPTarget<double, 3u, 40>::move(qmcplusplus::ParticleSet const&, qmcplusplus::TinyVector<double, 3u> const&, int, bool)exec0.010.020.01760.010.00Exe (%): 100.000.20clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
miniqmcreference::TwoBodyJastrowRef<qmcplusplus::BsplineFunctor<double> >::evalGrad(qmcplusplus::ParticleSet&, int)exec0.010.020.01670.010.00Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
qmcplusplus::SoaDistanceTableABOMPTarget<double, 3u, 40>::update(int)exec0.010.030.01860.010.01Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
mkl_blas_avx512_xdgerlibmkl_avx512.so.20.010.030.011110.010.01Math (%): 100.00169.96
__kmp_get_ancestor_thread_numlibiomp5.so0.010.020.01770.010.00OMP (%): 100.000.00
miniqmcreference::DiracDeterminantRef<qmcplusplus::DelayedUpdate<double, double> >::acceptMove(qmcplusplus::ParticleSet&, int)+exec0.010.030.01960.010.01Exe (%): 100.0029.05clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 986 - DelayedUpdate.h:147-148 - exec00040.000.000.00
Loop 989 - DelayedUpdate.h:137-138 - exec00.010190.000.000.00
Loop 987 - DelayedUpdate.h:147-148 - exec000160.000.000.00
Loop 988 - DelayedUpdate.h:137-138 - exec00060.000.000.00
qmcplusplus::RealSpacePositionsOMPTarget::getAllParticlePos() constexec0.010.030.01800.010.01Exe (%): 100.000.60clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
qmcplusplus::WaveFunction::ratioGrad(qmcplusplus::ParticleSet&, int, qmcplusplus::TinyVector<double, 3u>&)+exec0.010.030.01900.010.01Exe (%): 100.000.25clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 102 - WaveFunction.cpp:198-201 - exec [...]0.010.020670.010.000.00
qmcplusplus::ParticleSet::computeNewPosDistTables(int, qmcplusplus::TinyVector<double, 3u> const&, bool)+exec0.010.020570.010.00Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1232 - ParticleSet.cpp:343-344 - exec [...]00.020490.000.000.00
qmcplusplus::ParticleSet::update(bool)+exec0.010.040.011000.010.01Exe (%): 100.001.20clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1225 - ParticleSet.cpp:242-243 - exec [...]0.010.030.01790.010.000.00
mkl_blas_avx512_xdgemm_nocopy_driverlibmkl_avx512.so.20.010.020670.010.00Math (%): 100.000.00
qmcplusplus::ParticleSet::acceptMove(int)+exec0.010.020.01780.010.01Exe (%): 100.000.00clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.1.0 (2024.1.0.20240308) /opt/intel/oneapi/compiler/2024.1/bin/compiler/clang --driver-mode=g++ --intel -I /scratch_na/users/xoserete/qaas_runs/171-284-5202/intel/miniqmc/build/miniqmc/src -I /scratch_na/u...
Loop 1238 - ParticleSet.cpp:389-390 - exec [...]00.020230.000.000.00
×