| Name | Module | 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 |
|---|
| ○__kmp_hardware_timestamp | libomp.so | 30.52 | 4.03 | 3.55 | 192 | 3.37 | 0.37 | OMP (%): 100.00 | 0.00 | |
| ►.omp_outlined..5#0x20eed0+ | exec | 30.52 | 4.26 | 3.55 | 192 | 3.50 | 0.40 | Exe (%): 100.00 | 900.89 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►Loop 83 - ljForce.c:173-216 - exec [...]+ | | 0.02 | 0.02 | 0 | 185 | 0.03 | 0.00 | | 0.00 | |
| ►Loop 85 - ljForce.c:178-216 - exec [...]+ | | 0.12 | 0.04 | 0.01 | 192 | 0.07 | 0.01 | | 1759.27 | |
| ►Loop 86 - ljForce.c:187-216 - exec [...]+ | | 0.27 | 0.08 | 0.03 | 192 | 0.12 | 0.01 | | 992.89 | |
| ○Loop 87 - ljForce.c:191-216 - exec [...] | | 30.11 | 4.2 | 3.5 | 192 | 3.45 | 0.40 | | 900.00 | |
| ○Loop 84 - ljForce.c:178-216 - exec [...] | | 0 | 0 | 0 | 0 | 0.00 | 0.00 | | 0.00 | |
| ○Loop 82 - ljForce.c:172-172 - exec | | 0 | 0 | 0 | 0 | 0.00 | 0.00 | | 0.00 | |
| ○_ZL27__kmp_hyper_barrier_release12barrier_typeP8kmp_infoiiiPv | libomp.so | 30.38 | 4.12 | 3.53 | 190 | 2.55 | 0.28 | OMP (%): 100.00 | 0.00 | |
| ►sortAtomsInCell+ | exec | 2.17 | 0.46 | 0.25 | 192 | 1.14 | 0.13 | Exe (%): 100.00 | 22.11 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ○Loop 69 - haloExchange.c:621-630 - exec | | 2.03 | 0.45 | 0.24 | 192 | 1.08 | 0.12 | | 21.69 | |
| ○Loop 71 - haloExchange.c:633-642 - exec | | 0.04 | 0.02 | 0 | 127 | 0.04 | 0.00 | | 0.00 | |
| ○Loop 72 - haloExchange.c:633-642 - exec | | 0.03 | 0.05 | 0 | 85 | 0.07 | 0.01 | | 0.00 | |
| ○Loop 70 - haloExchange.c:633-642 - exec | | 0.03 | 0.04 | 0 | 82 | 0.07 | 0.01 | | 0.00 | |
| ►.omp_outlined.#0x20edc0+ | exec | 1.89 | 0.36 | 0.22 | 192 | 0.79 | 0.09 | Exe (%): 100.00 | 7.88 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ○Loop 31 - ljForce.c:158-161 - exec [...] | | 1.89 | 0.36 | 0.22 | 192 | 0.79 | 0.09 | | 7.88 | |
| ►.omp_outlined.#0x211980+ | exec | 1.32 | 0.26 | 0.15 | 192 | 0.62 | 0.07 | Exe (%): 100.00 | 30.44 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►Loop 27 - timestep.c:72-78 - exec+ | | 0 | 0 | 0 | 100 | 0.02 | 0.00 | | 0.00 | |
| ○Loop 29 - timestep.c:74-78 - exec | | 1.26 | 0.25 | 0.15 | 192 | 0.60 | 0.07 | | 26.56 | |
| ○Loop 28 - timestep.c:74-78 - exec | | 0.05 | 0.03 | 0.01 | 172 | 0.06 | 0.01 | | 26.75 | |
| ○Loop 30 - timestep.c:74-78 - exec | | 0.01 | 0.01 | 0 | 111 | 0.03 | 0.00 | | 0.00 | |
| ○_ZL26__kmp_hyper_barrier_gather12barrier_typeP8kmp_infoiiPFvPvS2_ES2_ | libomp.so | 1.03 | 0.99 | 0.12 | 75 | 1.95 | 0.22 | OMP (%): 100.00 | 0.04 | |
| ►.omp_outlined..2+ | exec | 0.69 | 0.14 | 0.08 | 192 | 0.28 | 0.03 | Exe (%): 100.00 | 65.30 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►Loop 111 - timestep.c:86-94 - exec+ | | 0 | 0 | 0 | 41 | 0.02 | 0.00 | | 0.00 | |
| ○Loop 112 - timestep.c:88-94 - exec | | 0.68 | 0.14 | 0.08 | 192 | 0.28 | 0.03 | | 64.56 | |
| ○__GI___sched_yield | libc.so.6 | 0.56 | 0.12 | 0.07 | 192 | 0.18 | 0.02 | System (%): 100.00 | 0.00 | |
| ►updateLinkCells+ | exec | 0.34 | 4.32 | 0.04 | 2 | 7.39 | 0.86 | Exe (%): 100.00 | 294.41 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►Loop 101 - linkCells.c:211-373 - exec [...]+ | | 0 | 0.02 | 0 | 2 | 0.09 | 0.01 | | 0.00 | |
| ○Loop 102 - linkCells.c:211-373 - exec [...] | | 0.34 | 4.3 | 0.04 | 2 | 7.30 | 0.85 | | 292.63 | |
| ○Loop 103 - linkCells.c:384-385 - exec | | 0 | 0 | 0 | 0 | 0.00 | 0.00 | | 0.00 | |
| ○unknown_function | Unknown module | 0.17 | 0.29 | 0.02 | 192 | 0.19 | 0.02 | Others (%): 100.00 | 188.19 | |
| ○putAtomInBox | exec | 0.09 | 1.07 | 0.01 | 2 | 1.88 | 0.22 | Exe (%): 100.00 | 224.75 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►.omp_outlined..4+ | exec | 0.07 | 0.01 | 0.01 | 186 | 0.04 | 0.00 | Exe (%): 100.00 | 45.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ○Loop 113 - timestep.c:107-107 - exec | | 0 | 0 | 0 | 0 | 0.00 | 0.00 | | 0.00 | |
| ►Loop 114 - timestep.c:108-116 - exec+ | | 0 | 0 | 0 | 5 | 0.00 | 0.00 | | 0.00 | |
| ○Loop 115 - timestep.c:110-116 - exec | | 0.07 | 0.01 | 0.01 | 186 | 0.03 | 0.00 | | 44.38 | |
| ○sortAtomsById | exec | 0.06 | 0.03 | 0.01 | 180 | 0.05 | 0.01 | Exe (%): 100.00 | 41.25 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ○__kmp_yield | libomp.so | 0.05 | 0.02 | 0.01 | 119 | 0.04 | 0.00 | OMP (%): 100.00 | 0.00 | |
| ►loadAtomsBuffer+ | exec | 0.04 | 0.47 | 0 | 2 | 0.43 | 0.05 | Exe (%): 100.00 | 0.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►Loop 54 - haloExchange.c:376-389 - exec+ | | 0 | 0.01 | 0 | 2 | 0.03 | 0.00 | | 0.00 | |
| ○Loop 55 - haloExchange.c:380-389 - exec | | 0.04 | 0.45 | 0 | 2 | 0.40 | 0.05 | | 0.00 | |
| ○getBoxFromTuple | exec | 0.02 | 0.25 | 0 | 2 | 0.49 | 0.06 | Exe (%): 100.00 | 0.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ○MPIDI_OFI_progress | libmpi.so.12.0.0 | 0.01 | 0.15 | 0 | 1 | 0.00 | 0.00 | MPI (%): 100.00 | 0.00 | |
| ○ucp_worker_progress | libucp.so.0.0.0 | 0.01 | 0.16 | 0 | 1 | 0.00 | 0.00 | Others (%): 100.00 | 0.00 | |
| ►.omp_outlined..6#0x212240+ | exec | 0.01 | 0.01 | 0 | 30 | 0.02 | 0.00 | Exe (%): 100.00 | 0.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ○Loop 35 - timestep.c:153-154 - exec | | 0 | 0.01 | 0 | 22 | 0.03 | 0.00 | | 0.00 | |
| ○uct_rc_mlx5_iface_check_rx_completion | libuct_ib.so.0.0.0 | 0.01 | 0.15 | 0 | 1 | 0.00 | 0.00 | Others (%): 100.00 | 0.00 | |
| ►.omp_outlined..7+ | exec | 0.01 | 0 | 0 | 40 | 0.01 | 0.00 | Exe (%): 100.00 | 0.00 | AMD clang version 16.0.3 (CLANG: AOCC_4.1.0-Build#270 2023_07_10) /cluster/comp/aocc/4.1.0/bin/clang-16 -I /beegfs/hackathon/users/eoseret/qaas_runs/170-850-7424/intel/CoMD/build/CoMD/CoMD/src-openmp -I . -O3 -march=native -D DO_MPI -g -grecord-command-lin... |
| ►Loop 90 - initAtoms.c:175-181 - exec+ | | 0 | 0 | 0 | 3 | 0.03 | 0.00 | | 0.00 | |
| ○Loop 92 - initAtoms.c:177-181 - exec | | 0.01 | 0 | 0 | 32 | 0.01 | 0.00 | | 0.00 | |
| ○Loop 93 - initAtoms.c:177-181 - exec | | 0 | 0 | 0 | 1 | 0.00 | 0.00 | | 0.00 | |
| ○Loop 91 - initAtoms.c:177-181 - exec | | 0 | 0 | 0 | 3 | 0.00 | 0.00 | | 0.00 | |
| ○ofi_cq_progress | libmlx-fi.so | 0.01 | 0.17 | 0 | 1 | 0.00 | 0.00 | Others (%): 100.00 | 0.00 | |
| ○uct_iface_mpool_empty_warn | libuct.so.0.0.0 | 0.01 | 0.2 | 0 | 1 | 0.00 | 0.00 | Others (%): 100.00 | 0.00 | |
| ○MPID_Progress_wait | libmpi.so.12.0.0 | 0.01 | 0.16 | 0 | 2 | 0.91 | 0.11 | MPI (%): 100.00 | 0.00 | |
