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- r0: 6x1
- r1: 96x1
- r2: 120x1
- r3: 126x1
- r4: 144x1
- r5: 168x1
- r6: 192x1
- r7: 216x1
- r8: 240x1
- r9: 256x1
| Metric | r0 | r1 | r2 | r3 | r4 | r5 | r6 | r7 | r8 | r9 |
|---|
| Total Time (s) | 2.45 E3 | 190.60 | 158.90 | 147.61 | 159.39 | 133.38 | 134.38 | 122.40 | 112.95 | 114.60 |
| Max (Thread Active Time) (s) | 2.45 E3 | 186.42 | 152.83 | 141.24 | 151.38 | 124.43 | 122.89 | 108.54 | 97.16 | 99.04 |
| Average Active Time (s) | 2.45 E3 | 185.98 | 152.27 | 140.68 | 150.79 | 123.44 | 121.87 | 107.18 | 95.74 | 97.53 |
| Activity Ratio (%) | 99.9 | 97.7 | 96.0 | 95.5 | 94.8 | 92.8 | 91.0 | 88.0 | 85.2 | 85.7 |
| Average number of active threads | 5.996 | 93.674 | 114.995 | 120.084 | 136.230 | 155.480 | 174.127 | 189.134 | 203.442 | 217.859 |
| Affinity Stability (%) | 100.0 | 98.1 | 96.6 | 96.1 | 95.8 | 94.0 | 92.7 | 90.3 | 88.2 | 88.4 |
| GFLOPS | 14.820 | 195.045 | 237.936 | 257.216 | 239.846 | 291.473 | 294.412 | 332.562 | 372.554 | 365.038 |
| Time in analyzed loops (%) | 96.9 | 95.8 | 93.9 | 92.3 | 83.5 | 86.4 | 92.6 | 88.3 | 90.0 | 85.0 |
| Time in analyzed innermost loops (%) | 92.6 | 92.2 | 90.4 | 88.6 | 80.3 | 83.1 | 89.2 | 84.8 | 86.5 | 81.8 |
| Time in user code (%) | 97.1 | 96.0 | 94.1 | 92.5 | 83.7 | 86.6 | 92.8 | 88.5 | 90.2 | 85.3 |
| Compilation Options Score (%) | 100 | 100 | 100 | 100 | 100 | 100 | 100 | 100 | 100 | 100 |
| Array Access Efficiency (%) | 50.1 | 51.1 | 51.3 | 51.4 | 51.0 | 51.4 | 52.3 | 51.6 | 52.2 | 51.4 |
|
| Potential Speedups | |
| Perfect Flow Complexity | 3.76 | 3.58 | 3.40 | 3.23 | 2.69 | 2.84 | 3.22 | 2.94 | 3.02 | 2.76 |
| Perfect OpenMP/MPI/Pthread/TBB | 1.00 | 1.02 | 1.02 | 1.02 | 1.02 | 1.02 | 1.02 | 1.03 | 1.04 | 1.03 |
| Perfect OpenMP/MPI/Pthread/TBB + Perfect Load Distribution | 1.03 | 1.04 | 1.06 | 1.08 | 1.19 | 1.16 | 1.08 | 1.14 | 1.12 | 1.19 |
| Scalability - Gap | 1.00 | 1.24 | 1.30 | 1.26 | 1.56 | 1.52 | 1.75 | 1.80 | 1.84 | 1.99 |
| No Scalar Integer | Potential Speedup | 1.32 | 1.31 | 1.31 | 1.30 | 1.26 | 1.27 | 1.30 | 1.28 | 1.29 | 1.27 |
| Nb Loops to get 80% | 2 | 3 | 3 | 3 | 2 | 3 | 3 | 3 | 3 | 3 |
| FP Vectorised | Potential Speedup | 1.70 | 1.68 | 1.66 | 1.64 | 1.55 | 1.57 | 1.64 | 1.59 | 1.61 | 1.56 |
| Nb Loops to get 80% | 3 | 3 | 3 | 3 | 3 | 3 | 3 | 3 | 3 | 3 |
| Fully Vectorised | Potential Speedup | 4.59 | 4.36 | 4.09 | 3.89 | 3.05 | 3.28 | 3.91 | 3.46 | 3.62 | 3.17 |
| Nb Loops to get 80% | 4 | 5 | 5 | 5 | 4 | 4 | 5 | 4 | 5 | 4 |
| Only FP Arithmetic | Potential Speedup | 1.51 | 1.49 | 1.48 | 1.47 | 1.41 | 1.42 | 1.47 | 1.44 | 1.45 | 1.42 |
| Nb Loops to get 80% | 3 | 3 | 3 | 3 | 3 | 3 | 3 | 3 | 3 | 3 |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| Source Object | Issue |
|---|
| ▼exec– | |
| ▼npair_bin.cpp– | |
| ○ | |
| ▼fix_nve.cpp– | |
| ○ | |
| ▼nbin.cpp– | |
| ○ | |
| ▼pair.cpp– | |
| ○ | |
| ▼pair_eam.cpp– | |
| ○ | |
| ▼neighbor.cpp– | |
| ○ | |
| ▼nbin_standard.cpp– | |
| ○ | |
| ▼atom_vec.cpp– | |
| ○ | |
| ▼comm_brick.cpp– | |
| ○ | |
| ▼domain_omp.cpp– | |
| ○ | |
| r0 | r1 | r2 | r3 | r4 | r5 | r6 | r7 | r8 | r9 |
|---|
| Application | /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/run/oneview_runs/defaults/orig/exec | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Timestamp | 2025-09-17 00:36:46 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Experiment Type | MPI; | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Machine | isix03.benchmarkcenter.megware.com | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Architecture | x86_64 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Micro Architecture | GRANITE_RAPIDS | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Model Name | Intel(R) Xeon(R) 6980P | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Cache Size | 516096 KB | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Number of Cores | 128 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Maximal Frequency | 3.9 GHz | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| OS Version | Linux 5.14.0-570.39.1.el9_6.x86_64 #1 SMP PREEMPT_DYNAMIC Thu Sep 4 05:08:52 EDT 2025 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Architecture used during static analysis | x86_64 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Micro Architecture used during static analysis | GRANITE_RAPIDS | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | 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 /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/third_party -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/ASPHERE -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/CLASS2 -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/DPD-BASIC -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/KSPACE -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/MANYBODY -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/MEAM -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/MISC -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/MOLECULE -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/REPLICA -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/RIGID -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/OPENMP -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/OPT -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/build/lammps/cmake/styles -I /cluster/intel/oneapi/2024.0.0/mpi/2021.11/include -D FFT_MKL -D FFT_MKL_THREADS -D LAMMPS_GZIP -D LAMMPS_MEMALIGN=64 -D LAMMPS_OMP_COMPAT=4 -D LAMMPS_PNG -D LAMMPS_SMALLBIG -D LMP_OPENMP -D MPICH_SKIP_MPICXX -D OMPI_SKIP_MPICXX -D _MPICC_H -isystem /cluster/intel/oneapi/2024.0.0/mkl/2024.0/include -O3 -x Host -mprefer-vector-width=512 -ffp-model=fast -qoverride-limits -g -fno-omit-frame-pointer -fcf-protection=none -nopie -grecord-command-line -Wno-tautological-constant-compare -Wno-unused-command-line-argument -std=c++17 -fPIC -fiopenmp -MD -MT lammps/cmake/CMakeFiles/lammps.dir/__/src/MANYBODY/pair_eam.cpp.o -MF lammps/cmake/CMakeFiles/lammps.dir/__/src/MANYBODY/pair_eam.cpp.o.d -o lammps/cmake/CMakeFiles/lammps.dir/__/src/MANYBODY/pair_eam.cpp.o -c /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-803-9958/intel/LAMMPS/build/LAMMPS/lammps/src/MANYBODY/pair_eam.cpp -fveclib=SVML -fheinous-gnu-extensions | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Number of processes observed | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 |
|---|
| Number of threads observed | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 |
|---|
| Frequency Driver | intel_pstate | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Frequency Governor | performance | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Huge Pages | always | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Hyperthreading | on | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Number of sockets | 2 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Number of cores per socket | 128 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| MAQAO version | 2025.1.2 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| MAQAO build | d7816a4ef31d96c8cb7cb54a3ec2554ac0d7ef52::20250912-183832 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
| Comments | OV scalability run using icx | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
|---|
