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| Metric | r0 | r1 | r2 | |
|---|---|---|---|---|
| Total Time (s) | 107.99 | 115.47 | 106.96 | |
| Profiled Time (s) | 104.36 | 111.16 | 103.46 | |
| GFLOPS | 732.867 | 681.016 | 739.389 | |
| Time in analyzed loops (%) | 62.9 | 67.8 | 62.8 | |
| Time in analyzed innermost loops (%) | 62.8 | 67.6 | 62.6 | |
| Time in user code (%) | 62.1 | 68.1 | 62.0 | |
| Compilation Options Score (%) | 100 | 99.9 | 100 | |
| Array Access Efficiency (%) | 92.9 | 93.6 | 94.7 | |
| Potential Speedups | ||||
| Perfect Flow Complexity | 1.00 | 1.02 | 1.02 | |
| Perfect OpenMP + MPI + Pthread | 1.01 | 1.00 | 1.01 | |
| Perfect OpenMP + MPI + Pthread + Perfect Load Distribution | 1.03 | 1.04 | 1.02 | |
| No Scalar Integer | Potential Speedup | 1.04 | 1.03 | 1.04 |
| Nb Loops to get 80% | 2 | 1 | 2 | |
| FP Vectorised | Potential Speedup | 1.26 | 1.29 | 1.24 |
| Nb Loops to get 80% | 3 | 3 | 3 | |
| Fully Vectorised | Potential Speedup | 1.80 | 2.33 | 1.81 |
| Nb Loops to get 80% | 5 | 9 | 6 | |
| Only FP Arithmetic | Potential Speedup | 1.13 | 1.12 | 1.09 |
| Nb Loops to get 80% | 3 | 2 | 3 | |
| Source Object | Issue |
|---|---|
| ▼exec | |
| ▼DiracDeterminantRef.cpp | |
| ○ | |
| ▼WaveFunction.cpp | |
| ○ | |
| ▼NonLocalPP.hpp | |
| ○ | |
| ▼OhmmsVector.h | |
| ○ | |
| ▼ParticleBConds3DSoa.h | |
| ○ | |
| ▼TwoBodyJastrowRef.h | |
| ○ | |
| ▼BsplineFunctor.h | |
| ○ | |
| ▼SPOSet.h | |
| ○ | |
| ▼einspline_spo_ref.hpp | |
| ○ | |
| ▼SoaDistanceTableABOMPTarget.h | |
| ○ | |
| ▼DiracMatrix.h | |
| ○ | |
| ▼SoaDistanceTableAAOMPTarget.h | |
| ○ | |
| ▼OneBodyJastrowRef.h | |
| ○ | |
| ▼ParticleSet.cpp | |
| ○ | |
| ▼miniqmc.cpp | |
| ○ | |
| ▼NewTimer.cpp | |
| ○ |
| r0 | r1 | r2 | |
|---|---|---|---|
| Experiment Name | |||
| Application | /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/run/oneview_runs/defaults/orig/exec | /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/run/binaries/gcc_15/exec | /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/run/binaries/icx_3/exec |
| Timestamp | 2024-03-26 14:31:59 | 2024-03-26 18:01:48 | 2024-03-26 17:59:25 |
| Experiment Type | MPI; OpenMP; | same as r0 | same as r0 |
| Machine | idp09.benchmarkcenter.megware.com | same as r0 | same as r0 |
| Architecture | x86_64 | same as r0 | same as r0 |
| Micro Architecture | SAPPHIRE_RAPIDS | same as r0 | same as r0 |
| Model Name | Intel (R) Xeon (R) CPU Max 9468 | same as r0 | same as r0 |
| Cache Size | 107520 KB | same as r0 | same as r0 |
| Number of Cores | 48 | same as r0 | same as r0 |
| Maximal Frequency | 3.5 GHz | same as r0 | same as r0 |
| OS Version | Linux 5.14.0-362.13.1.el9_3.x86_64 #1 SMP PREEMPT_DYNAMIC Thu Dec 21 07:12:43 EST 2023 | same as r0 | same as r0 |
| Architecture used during static analysis | x86_64 | same as r0 | same as r0 |
| Micro Architecture used during static analysis | SAPPHIRE_RAPIDS | same as r0 | same as r0 |
| Compilation Options | exec: clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.0.0 (2024.0.0.20231017) /cluster/intel/oneapi/2024.0.0/compiler/2024.0/bin/compiler/clang --driver-mode=g++ --intel -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/build/src -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Particle -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Utilities -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Platforms -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Platforms/Host -I /cluster/intel/oneapi/2024.0.0/mpi/2021.11/include -D ADD_ -D H5_USE_16_API -D HAVE_CONFIG_H -D HAVE_MKL -D MPICH_SKIP_MPICXX -D OMPI_SKIP_MPICXX -D OPENMP_NO_COMPLEX -D _MPICC_H -D restrict=__restrict__ -isystem /cluster/intel/oneapi/2024.0.0/mkl/2024.0/include -O3 -march=native -g -grecord-command-line -fno-omit-frame-pointer -fcf-protection=none -nopie -fiopenmp -fstrict-aliasing -O3 -D NDEBUG -std=c++17 -MD -MT src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o -MF src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o.d -o src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o -c /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/QMCWaveFunctions/SPOSet_builder.cpp -fveclib=SVML -fheinous-gnu-extensions --driver-mode=g++ --intel -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/build/src -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Particle -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Utilities -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Platforms -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Platforms/Host -I /cluster/intel/oneapi/2024.0.0/mpi/2021.11/include -D ADD_ -D H5_USE_16_API -D HAVE_CONFIG_H -D HAVE_MKL -D MPICH_SKIP_MPICXX -D OMPI_SKIP_MPICXX -D OPENMP_NO_COMPLEX -D _MPICC_H -D restrict=__restrict__ -isystem /cluster/intel/oneapi/2024.0.0/mkl/2024.0/include -O3 -march=native -g -grecord-command-line -fno-omit-frame-pointer -fcf-protection=none -nopie -fiopenmp -fstrict-aliasing -O3 -D NDEBUG -std=c++17 -MD -MT src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o -MF src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o.d -o src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o -c /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/QMCWaveFunctions/SPOSet_builder.cpp -fveclib=SVML -fheinous-gnu-extensions | libplatform_cpu_LA.so: N/A libqmcwfs.so: GNU GIMPLE 13.2.0 -march=haswell -g -g -O2 -O2 -fno-openacc -fcf-protection=none -fPIC -funroll-loops -fno-omit-frame-pointer -fcf-protection=none -fopenmp -finline-limit=1000 -fstrict-aliasing -funroll-all-loops -ffast-math -fltrans libqmcutil.so: GNU GIMPLE 13.2.0 -march=haswell -g -g -O2 -O2 -fno-openacc -fcf-protection=none -fPIC -funroll-loops -fno-omit-frame-pointer -fcf-protection=none -fopenmp -finline-limit=1000 -fstrict-aliasing -funroll-all-loops -ffast-math -fltrans libqmcparticle_omptarget.so: GNU GIMPLE 13.2.0 -march=haswell -g -g -O2 -O2 -fno-openacc -fcf-protection=none -fPIC -funroll-loops -fno-omit-frame-pointer -fcf-protection=none -fopenmp -finline-limit=1000 -fstrict-aliasing -funroll-all-loops -ffast-math -fltrans exec: N/A + [vdso]: N/A libqmcparticle.so: GNU C++17 13.2.0 -march=haswell -g -O2 -std=c++17 -flto -funroll-loops -fno-omit-frame-pointer -fcf-protection=none -fopenmp -finline-limit=1000 -fstrict-aliasing -funroll-all-loops -ffast-math -fPIC | exec: clang based Intel(R) oneAPI DPC++/C++ Compiler 2024.0.0 (2024.0.0.20231017) --driver-mode=g++ --intel -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/icx_3/src -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Particle -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Utilities -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Platforms -I /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/Platforms/Host -I /cluster/intel/oneapi/2024.0.0/mpi/2021.11/include -D ADD_ -D H5_USE_16_API -D HAVE_CONFIG_H -D HAVE_MKL -D MPICH_SKIP_MPICXX -D OMPI_SKIP_MPICXX -D OPENMP_NO_COMPLEX -D _MPICC_H -D restrict=__restrict__ -isystem /cluster/intel/oneapi/2024.0.0/mkl/2024.0/include -O3 -O3 -x CORE-AVX2 -g -fno-omit-frame-pointer -fcf-protection=none -nopie -fiopenmp -fstrict-aliasing -O3 -D NDEBUG -std=c++17 -MD -MT src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o -MF src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o.d -o src/QMCWaveFunctions/CMakeFiles/qmcwfs.dir/SPOSet_builder.cpp.o -c /home/eoseret/qaas_runs_CPU_9468/171-145-9236/intel/miniqmc/build/miniqmc/src/QMCWaveFunctions/SPOSet_builder.cpp -fveclib=SVML -fheinous-gnu-extensions |
| Number of processes observed | 2 | same as r0 | same as r0 |
| Number of threads observed | 96 | same as r0 | same as r0 |
| Frequency Driver | intel_pstate | same as r0 | same as r0 |
| Frequency Governor | performance | same as r0 | same as r0 |
| Huge Pages | always | same as r0 | same as r0 |
| Hyperthreading | on | same as r0 | same as r0 |
| Number of sockets | 2 | same as r0 | same as r0 |
| Number of cores per socket | 48 | same as r0 | same as r0 |
| MAQAO version | 2.19.1 | same as r0 | same as r0 |
| MAQAO build | e26c8ffcefb997f114892e36591c060f98f53e6a::20240206-190005 | same as r0 | same as r0 |
| Comments | Execution on the Megware (https://www.megware.com/en/) benchmarking cluster | same as r0 | same as r0 |