options

Help is available by moving the cursor above any symbol or by checking MAQAO website.

Global Metrics

Metricr0r1r2r3r4r5
Total Time (s)660.1994.7073.2862.5355.1150.63
Max (Thread Active Time) (s)659.4493.7572.1461.1552.9648.56
Average Active Time (s)659.3793.7072.0461.0152.8348.36
Activity Ratio (%)99.999.198.598.096.496.2
Average number of active threads7.99063.32394.377124.907153.389183.397
Affinity Stability (%)99.999.198.697.996.496.3
GFLOPS64.297452.550587.918694.213802.220875.460
Time in analyzed loops (%)93.689.686.183.884.484.1
Time in analyzed innermost loops (%)58.657.956.756.157.257.6
Time in user code (%)98.093.189.587.588.287.8
Compilation Options Score (%)100100100100100100
Array Access Efficiency (%)42.044.545.947.048.048.9
Potential Speedups
Perfect Flow Complexity1.001.001.011.011.011.01
Perfect OpenMP/MPI/Pthread/TBB1.021.031.041.041.041.04
Perfect OpenMP/MPI/Pthread/TBB + Perfect Load Distribution1.021.051.081.111.091.08
Scalability - Gap1.001.151.331.521.671.84
No Scalar IntegerPotential Speedup1.021.021.021.021.021.02
Nb Loops to get 80%678888
FP VectorisedPotential Speedup1.001.001.011.011.011.01
Nb Loops to get 80%444444
Fully VectorisedPotential Speedup1.051.061.071.071.071.07
Nb Loops to get 80%131515151515
Only FP ArithmeticPotential Speedup7.485.224.263.813.773.65
Nb Loops to get 80%141414131414

FLOPS Breakdown

Scalability Speedup

Cumulated Speedup If No Scalar Integer

Cumulated Speedup If FP Vectorized

Cumulated Speedup If Fully Vectorized

Cumulated Speedup If Only FP Arithmetic

Loop Based Profiles

Innermost / Single Loops

Inbetween Loops

Outermost Loops

Cumulated Coverage With All Loops

Innermost Loop Based Profiles

Coverage

Count

Application Categorization

Time

Coverage

Compilation Options

Source ObjectIssue
exec
pair_eam_intel.cpp
fix_nve_intel.cpp
stl_map.h
stl_tree.h
atom.cpp
platform.cpp
stl_vector.h
atom_vec.h
domain_omp.cpp
lattice.cpp
unordered_map.h
verlet.cpp
intel_buffers.cpp
random_park.cpp
fix.h
output.cpp
compute.cpp
atom_vec.cpp
nbin_intel.cpp
npair.cpp
npair_intel.cpp
fix_intel.cpp
new_allocator.h
nbin.cpp
memory.cpp
comm_brick.cpp
fix_intel.h
compute_temp.cpp
input.cpp
hashtable.h
compute_pressure.cpp
thermo.cpp
integrate.cpp
modify.cpp
npair_bin_intel.cpp
variable.cpp
pair_eam.cpp
core.h
comm.cpp
basic_string.h
finish.cpp
neighbor.cpp
timer.cpp
force.cpp
format.h

Path Count Profiles

Coverage

Count

Low Iteration Count Profiles

Coverage

Count

Average Number of Active Threads

Run 1 - 8x1

Run 2 - 64x1

Run 3 - 96x1

Run 4 - 128x1

Run 5 - 160x1

Run 6 - 192x1

Experiment Summaries

r0r1r2r3r4r5
Application/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/run/binaries/icx_2/execsame as r0same as r0same as r0same as r0same as r0
Timestamp2025-09-18 00:28:24same as r0same as r0same as r0same as r0same as r0
Experiment TypeMPI; same as r0same as r0same as r0same as r0same as r0
Machinegmz17.benchmarkcenter.megware.comsame as r0same as r0same as r0same as r0same as r0
Architecturex86_64same as r0same as r0same as r0same as r0same as r0
Micro ArchitectureZEN_V5same as r0same as r0same as r0same as r0same as r0
Model NameAMD EPYC 9655 96-Core Processorsame as r0same as r0same as r0same as r0same as r0
Cache Size1024 KBsame as r0same as r0same as r0same as r0same as r0
Number of Cores96same as r0same as r0same as r0same as r0same as r0
Maximal Frequency4.509375 GHzsame as r0same as r0same as r0same as r0same as r0
OS VersionLinux 5.14.0-570.39.1.el9_6.x86_64 #1 SMP PREEMPT_DYNAMIC Thu Sep 4 05:08:52 EDT 2025same as r0same as r0same as r0same as r0same as r0
Architecture used during static analysisx86_64same as r0same as r0same as r0same as r0same as r0
Micro Architecture used during static analysisZEN_V5same as r0same as r0same as r0same as r0same as r0
Compilation Options exec: clang based Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317) /cluster/intel/oneapi/2025.1.0/compiler/2025.1/bin/compiler/clang --driver-mode=g++ --intel -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_INTEL -D LMP_INTEL_USELRT -D LMP_OPENMP -D LMP_USE_MKL_RNG -D MPICH_SKIP_MPICXX -D OMPI_SKIP_MPICXX -D _MPICC_H -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/third_party -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/ASPHERE -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/CLASS2 -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/DPD-BASIC -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/KSPACE -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/MANYBODY -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/MEAM -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/MISC -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/MOLECULE -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/REPLICA -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/RIGID -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/OPENMP -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/OPT -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/INTEL -I /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/icx_2/lammps/cmake/styles -isystem /cluster/intel/oneapi/2025.1.0/mkl/2025.1/include -isystem /cluster/intel/oneapi/2025.1.0/tbb/2022.1/include -O3 -ffp-model=fast -mprefer-vector-width=512 -O3 -march=znver5 -axCORE-AVX512 -mprefer-vector-width=512 -g -fno-omit-frame-pointer -fcf-protection=none -no-pie -grecord-command-line -fno-finite-math-only -Wno-tautological-constant-compare -Wno-unused-command-line-argument -std=c++17 -fPIC -fiopenmp -MD -MT lammps/cmake/CMakeFiles/lammps.dir/__/src/INTEL/pair_eam_intel.cpp.o -MF lammps/cmake/CMakeFiles/lammps.dir/__/src/INTEL/pair_eam_intel.cpp.o.d -o lammps/cmake/CMakeFiles/lammps.dir/__/src/INTEL/pair_eam_intel.cpp.o -c /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3649/intel/LAMMPS/build/LAMMPS/lammps/src/INTEL/pair_eam_intel.cpp -I /cluster/intel/oneapi/2025.1.0/mpi/2021.15/include -fveclib=SVML same as r0same as r0same as r0same as r0same as r0
Number of processes observed86496128160192
Number of threads observed86496128160192
Frequency Driveracpi-cpufreqsame as r0same as r0same as r0same as r0same as r0
Frequency Governorperformancesame as r0same as r0same as r0same as r0same as r0
Huge Pagesalwayssame as r0same as r0same as r0same as r0same as r0
Hyperthreadingonsame as r0same as r0same as r0same as r0same as r0
Number of sockets2same as r0same as r0same as r0same as r0same as r0
Number of cores per socket96same as r0same as r0same as r0same as r0same as r0
MAQAO version2025.1.2same as r0same as r0same as r0same as r0same as r0
MAQAO buildd7816a4ef31d96c8cb7cb54a3ec2554ac0d7ef52::20250912-183832same as r0same as r0same as r0same as r0same as r0
CommentsOV scalability run using icx_2same as r0same as r0same as r0same as r0same as r0
×