* [MAQAO] Info: Detected 6 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 280585 isix04.benchmarkcenter.megware.com {0-42,256-298}
[0] MPI startup(): 1 280583 isix04.benchmarkcenter.megware.com {43-85,299-341}
[0] MPI startup(): 2 280584 isix04.benchmarkcenter.megware.com {86-127,342-383}
[0] MPI startup(): 3 280588 isix04.benchmarkcenter.megware.com {128-170,384-426}
[0] MPI startup(): 4 280587 isix04.benchmarkcenter.megware.com {171-213,427-469}
[0] MPI startup(): 5 280586 isix04.benchmarkcenter.megware.com {214-255,470-511}
OMP: pid 280583 tid 280583 thread 0 bound to OS proc set {43}
OMP: pid 280587 tid 280587 thread 0 bound to OS proc set {171}
OMP: pid 280586 tid 280586 thread 0 bound to OS proc set {214}
OMP: pid 280588 tid 280588 thread 0 bound to OS proc set {128}
OMP: pid 280584 tid 280584 thread 0 bound to OS proc set {86}
OMP: pid 280585 tid 280585 thread 0 bound to OS proc set {0}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
3 by 1 by 2 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.266 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 4.725e+04 | 4.732e+04 | 4.747e+04 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 14.7389 on 6 procs for 10 steps with 32768000 atoms
Performance: 0.293 ns/day, 81.883 hours/ns, 0.678 timesteps/s, 22.232 Matom-step/s
99.4% CPU use with 6 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 12.353 | 12.387 | 12.419 | 0.6 | 84.04
Neigh | 0.82021 | 0.82219 | 0.82334 | 0.1 | 5.58
Comm | 0.76092 | 0.79289 | 0.81964 | 2.1 | 5.38
Output | 0.01076 | 0.011337 | 0.011882 | 0.3 | 0.08
Modify | 0.5036 | 0.50991 | 0.51693 | 0.7 | 3.46
Other | | 0.2156 | | | 1.46
Nlocal: 5.46133e+06 ave 5.46575e+06 max 5.45254e+06 min
Histogram: 2 0 0 0 0 0 0 0 0 4
Nghost: 542678 ave 545498 max 541240 min
Histogram: 4 0 0 0 0 0 0 0 1 1
Neighs: 2.05574e+08 ave 2.05756e+08 max 2.05245e+08 min
Histogram: 2 0 0 0 0 0 0 0 0 4
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 4.725e+04 | 4.732e+04 | 4.747e+04 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.824
350 797.80491 -1.12579e+08 0 -1.0919982e+08 51537.469
400 797.74785 -1.1257875e+08 0 -1.0919981e+08 51540.398
450 797.84596 -1.1257917e+08 0 -1.0919981e+08 51536.932
500 797.72451 -1.1257864e+08 0 -1.091998e+08 51543.024
510 797.68252 -1.1257846e+08 0 -1.091998e+08 51545.154
Loop time of 801.119 on 6 procs for 500 steps with 32768000 atoms
Performance: 0.270 ns/day, 89.013 hours/ns, 0.624 timesteps/s, 20.451 Matom-step/s
99.6% CPU use with 6 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 636.73 | 638.05 | 638.75 | 2.9 | 79.65
Neigh | 70.345 | 70.61 | 70.805 | 2.0 | 8.81
Comm | 55.631 | 56.583 | 57.917 | 11.0 | 7.06
Output | 0.11733 | 0.12009 | 0.12407 | 0.7 | 0.01
Modify | 25.316 | 25.602 | 25.958 | 4.8 | 3.20
Other | | 10.15 | | | 1.27
Nlocal: 5.46133e+06 ave 5.46624e+06 max 5.45255e+06 min
Histogram: 2 0 0 0 0 0 0 0 1 3
Nghost: 541921 ave 543179 max 540724 min
Histogram: 2 0 0 0 1 1 0 0 1 1
Neighs: 2.06149e+08 ave 2.0635e+08 max 2.05812e+08 min
Histogram: 2 0 0 0 0 0 0 0 2 2
Total # of neighbors = 1.2368968e+09
Ave neighs/atom = 37.747094
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:13:41
[MAQAO] Info: 5/6 lprof instances finished
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_0 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 96 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 280993 isix04.benchmarkcenter.megware.com {0-2,256-258}
[0] MPI startup(): 1 280982 isix04.benchmarkcenter.megware.com {3-5,259-261}
[0] MPI startup(): 2 281023 isix04.benchmarkcenter.megware.com {6-8,262-264}
[0] MPI startup(): 3 280983 isix04.benchmarkcenter.megware.com {9-11,265-267}
[0] MPI startup(): 4 281022 isix04.benchmarkcenter.megware.com {12-14,268-270}
[0] MPI startup(): 5 280994 isix04.benchmarkcenter.megware.com {15-17,271-273}
[0] MPI startup(): 6 281046 isix04.benchmarkcenter.megware.com {18-20,274-276}
[0] MPI startup(): 7 280991 isix04.benchmarkcenter.megware.com {21-23,277-279}
[0] MPI startup(): 8 280985 isix04.benchmarkcenter.megware.com {24-26,280-282}
[0] MPI startup(): 9 281053 isix04.benchmarkcenter.megware.com {27-29,283-285}
[0] MPI startup(): 10 280978 isix04.benchmarkcenter.megware.com {30-32,286-288}
[0] MPI startup(): 11 281052 isix04.benchmarkcenter.megware.com {33-34,289-290}
[0] MPI startup(): 12 280984 isix04.benchmarkcenter.megware.com {35-36,291-292}
[0] MPI startup(): 13 281066 isix04.benchmarkcenter.megware.com {37-38,293-294}
[0] MPI startup(): 14 281057 isix04.benchmarkcenter.megware.com {39-40,295-296}
[0] MPI startup(): 15 281042 isix04.benchmarkcenter.megware.com {41-42,297-298}
[0] MPI startup(): 16 281035 isix04.benchmarkcenter.megware.com {43-45,299-301}
[0] MPI startup(): 17 280975 isix04.benchmarkcenter.megware.com {46-48,302-304}
[0] MPI startup(): 18 281024 isix04.benchmarkcenter.megware.com {49-51,305-307}
[0] MPI startup(): 19 281018 isix04.benchmarkcenter.megware.com {52-54,308-310}
[0] MPI startup(): 20 280992 isix04.benchmarkcenter.megware.com {55-57,311-313}
[0] MPI startup(): 21 281002 isix04.benchmarkcenter.megware.com {58-60,314-316}
[0] MPI startup(): 22 281025 isix04.benchmarkcenter.megware.com {61-63,317-319}
[0] MPI startup(): 23 281029 isix04.benchmarkcenter.megware.com {64-66,320-322}
[0] MPI startup(): 24 281011 isix04.benchmarkcenter.megware.com {67-69,323-325}
[0] MPI startup(): 25 281004 isix04.benchmarkcenter.megware.com {70-72,326-328}
[0] MPI startup(): 26 280987 isix04.benchmarkcenter.megware.com {73-75,329-331}
[0] MPI startup(): 27 280995 isix04.benchmarkcenter.megware.com {76-77,332-333}
[0] MPI startup(): 28 281032 isix04.benchmarkcenter.megware.com {78-79,334-335}
[0] MPI startup(): 29 281007 isix04.benchmarkcenter.megware.com {80-81,336-337}
[0] MPI startup(): 30 280989 isix04.benchmarkcenter.megware.com {82-83,338-339}
[0] MPI startup(): 31 281021 isix04.benchmarkcenter.megware.com {84-85,340-341}
[0] MPI startup(): 32 281017 isix04.benchmarkcenter.megware.com {86-88,342-344}
[0] MPI startup(): 33 281033 isix04.benchmarkcenter.megware.com {89-91,345-347}
[0] MPI startup(): 34 280972 isix04.benchmarkcenter.megware.com {92-94,348-350}
[0] MPI startup(): 35 281060 isix04.benchmarkcenter.megware.com {95-97,351-353}
[0] MPI startup(): 36 281061 isix04.benchmarkcenter.megware.com {98-100,354-356}
[0] MPI startup(): 37 281030 isix04.benchmarkcenter.megware.com {101-103,357-359}
[0] MPI startup(): 38 281016 isix04.benchmarkcenter.megware.com {104-106,360-362}
[0] MPI startup(): 39 281010 isix04.benchmarkcenter.megware.com {107-109,363-365}
[0] MPI startup(): 40 280974 isix04.benchmarkcenter.megware.com {110-112,366-368}
[0] MPI startup(): 41 281036 isix04.benchmarkcenter.megware.com {113-115,369-371}
[0] MPI startup(): 42 280986 isix04.benchmarkcenter.megware.com {116-117,372-373}
[0] MPI startup(): 43 280980 isix04.benchmarkcenter.megware.com {118-119,374-375}
[0] MPI startup(): 44 281020 isix04.benchmarkcenter.megware.com {120-121,376-377}
[0] MPI startup(): 45 281038 isix04.benchmarkcenter.megware.com {122-123,378-379}
[0] MPI startup(): 46 281026 isix04.benchmarkcenter.megware.com {124-125,380-381}
[0] MPI startup(): 47 281031 isix04.benchmarkcenter.megware.com {126-127,382-383}
[0] MPI startup(): 48 281028 isix04.benchmarkcenter.megware.com {128-130,384-386}
[0] MPI startup(): 49 280988 isix04.benchmarkcenter.megware.com {131-133,387-389}
[0] MPI startup(): 50 281065 isix04.benchmarkcenter.megware.com {134-136,390-392}
[0] MPI startup(): 51 281049 isix04.benchmarkcenter.megware.com {137-139,393-395}
[0] MPI startup(): 52 281019 isix04.benchmarkcenter.megware.com {140-142,396-398}
[0] MPI startup(): 53 281040 isix04.benchmarkcenter.megware.com {143-145,399-401}
[0] MPI startup(): 54 281039 isix04.benchmarkcenter.megware.com {146-148,402-404}
[0] MPI startup(): 55 281064 isix04.benchmarkcenter.megware.com {149-151,405-407}
[0] MPI startup(): 56 281034 isix04.benchmarkcenter.megware.com {152-154,408-410}
[0] MPI startup(): 57 280979 isix04.benchmarkcenter.megware.com {155-157,411-413}
[0] MPI startup(): 58 281008 isix04.benchmarkcenter.megware.com {158-160,414-416}
[0] MPI startup(): 59 281063 isix04.benchmarkcenter.megware.com {161-162,417-418}
[0] MPI startup(): 60 281003 isix04.benchmarkcenter.megware.com {163-164,419-420}
[0] MPI startup(): 61 281001 isix04.benchmarkcenter.megware.com {165-166,421-422}
[0] MPI startup(): 62 281000 isix04.benchmarkcenter.megware.com {167-168,423-424}
[0] MPI startup(): 63 281056 isix04.benchmarkcenter.megware.com {169-170,425-426}
[0] MPI startup(): 64 280973 isix04.benchmarkcenter.megware.com {171-173,427-429}
[0] MPI startup(): 65 281045 isix04.benchmarkcenter.megware.com {174-176,430-432}
[0] MPI startup(): 66 281006 isix04.benchmarkcenter.megware.com {177-179,433-435}
[0] MPI startup(): 67 281068 isix04.benchmarkcenter.megware.com {180-182,436-438}
[0] MPI startup(): 68 281009 isix04.benchmarkcenter.megware.com {183-185,439-441}
[0] MPI startup(): 69 281050 isix04.benchmarkcenter.megware.com {186-188,442-444}
[0] MPI startup(): 70 280999 isix04.benchmarkcenter.megware.com {189-191,445-447}
[0] MPI startup(): 71 280998 isix04.benchmarkcenter.megware.com {192-194,448-450}
[0] MPI startup(): 72 281067 isix04.benchmarkcenter.megware.com {195-197,451-453}
[0] MPI startup(): 73 281012 isix04.benchmarkcenter.megware.com {198-200,454-456}
[0] MPI startup(): 74 280977 isix04.benchmarkcenter.megware.com {201-203,457-459}
[0] MPI startup(): 75 280990 isix04.benchmarkcenter.megware.com {204-205,460-461}
[0] MPI startup(): 76 281051 isix04.benchmarkcenter.megware.com {206-207,462-463}
[0] MPI startup(): 77 281037 isix04.benchmarkcenter.megware.com {208-209,464-465}
[0] MPI startup(): 78 281048 isix04.benchmarkcenter.megware.com {210-211,466-467}
[0] MPI startup(): 79 281043 isix04.benchmarkcenter.megware.com {212-213,468-469}
[0] MPI startup(): 80 281005 isix04.benchmarkcenter.megware.com {214-216,470-472}
[0] MPI startup(): 81 281027 isix04.benchmarkcenter.megware.com {217-219,473-475}
[0] MPI startup(): 82 281013 isix04.benchmarkcenter.megware.com {220-222,476-478}
[0] MPI startup(): 83 281055 isix04.benchmarkcenter.megware.com {223-225,479-481}
[0] MPI startup(): 84 280981 isix04.benchmarkcenter.megware.com {226-228,482-484}
[0] MPI startup(): 85 281047 isix04.benchmarkcenter.megware.com {229-231,485-487}
[0] MPI startup(): 86 281059 isix04.benchmarkcenter.megware.com {232-234,488-490}
[0] MPI startup(): 87 281054 isix04.benchmarkcenter.megware.com {235-237,491-493}
[0] MPI startup(): 88 281015 isix04.benchmarkcenter.megware.com {238-240,494-496}
[0] MPI startup(): 89 281044 isix04.benchmarkcenter.megware.com {241-243,497-499}
[0] MPI startup(): 90 281014 isix04.benchmarkcenter.megware.com {244-245,500-501}
[0] MPI startup(): 91 280976 isix04.benchmarkcenter.megware.com {246-247,502-503}
[0] MPI startup(): 92 280997 isix04.benchmarkcenter.megware.com {248-249,504-505}
[0] MPI startup(): 93 280996 isix04.benchmarkcenter.megware.com {250-251,506-507}
[0] MPI startup(): 94 281041 isix04.benchmarkcenter.megware.com {252-253,508-509}
[0] MPI startup(): 95 281058 isix04.benchmarkcenter.megware.com {254-255,510-511}
OMP: pid 281046 tid 281046 thread 0 bound to OS proc set {18}
OMP: pid 281029 tid 281029 thread 0 bound to OS proc set {64}
OMP: pid 280978 tid 280978 thread 0 bound to OS proc set {30}
OMP: pid 280982 tid 280982 thread 0 bound to OS proc set {3}
OMP: pid 281018 tid 281018 thread 0 bound to OS proc set {52}
OMP: pid 280992 tid 280992 thread 0 bound to OS proc set {55}
OMP: pid 281002 tid 281002 thread 0 bound to OS proc set {58}
OMP: pid 281066 tid 281066 thread 0 bound to OS proc set {37}
OMP: pid 280975 tid 280975 thread 0 bound to OS proc set {46}
OMP: pid 281022 tid 281022 thread 0 bound to OS proc set {12}
OMP: pid 281025 tid 281025 thread 0 bound to OS proc set {61}
OMP: pid 280987 tid 280987 thread 0 bound to OS proc set {73}
OMP: pid 281023 tid 281023 thread 0 bound to OS proc set {6}
OMP: pid 280995 tid 280995 thread 0 bound to OS proc set {76}
OMP: pid 281036 tid 281036 thread 0 bound to OS proc set {113}
OMP: pid 281060 tid 281060 thread 0 bound to OS proc set {95}
OMP: pid 281028 tid 281028 thread 0 bound to OS proc set {128}
OMP: pid 281035 tid 281035 thread 0 bound to OS proc set {43}
OMP: pid 280985 tid 280985 thread 0 bound to OS proc set {24}
OMP: pid 280972 tid 280972 thread 0 bound to OS proc set {92}
OMP: pid 280988 tid 280988 thread 0 bound to OS proc set {131}
OMP: pid 280994 tid 280994 thread 0 bound to OS proc set {15}
OMP: pid 280989 tid 280989 thread 0 bound to OS proc set {82}
OMP: pid 281032 tid 281032 thread 0 bound to OS proc set {78}
OMP: pid 281010 tid 281010 thread 0 bound to OS proc set {107}
OMP: pid 281053 tid 281053 thread 0 bound to OS proc set {27}
OMP: pid 281006 tid 281006 thread 0 bound to OS proc set {177}
OMP: pid 281054 tid 281054 thread 0 bound to OS proc set {235}
OMP: pid 281047 tid 281047 thread 0 bound to OS proc set {229}
OMP: pid 281042 tid 281042 thread 0 bound to OS proc set {41}
OMP: pid 281038 tid 281038 thread 0 bound to OS proc set {122}
OMP: pid 281045 tid 281045 thread 0 bound to OS proc set {174}
OMP: pid 281004 tid 281004 thread 0 bound to OS proc set {70}
OMP: pid 281024 tid 281024 thread 0 bound to OS proc set {49}
OMP: pid 280991 tid 280991 thread 0 bound to OS proc set {21}
OMP: pid 280997 tid 280997 thread 0 bound to OS proc set {248}
OMP: pid 281061 tid 281061 thread 0 bound to OS proc set {98}
OMP: pid 281019 tid 281019 thread 0 bound to OS proc set {140}
OMP: pid 281064 tid 281064 thread 0 bound to OS proc set {149}
OMP: pid 281039 tid 281039 thread 0 bound to OS proc set {146}
OMP: pid 280986 tid 280986 thread 0 bound to OS proc set {116}
OMP: pid 281016 tid 281016 thread 0 bound to OS proc set {104}
OMP: pid 281063 tid 281063 thread 0 bound to OS proc set {161}
OMP: pid 281017 tid 281017 thread 0 bound to OS proc set {86}
OMP: pid 280983 tid 280983 thread 0 bound to OS proc set {9}
OMP: pid 281068 tid 281068 thread 0 bound to OS proc set {180}
OMP: pid 280980 tid 280980 thread 0 bound to OS proc set {118}
OMP: pid 280984 tid 280984 thread 0 bound to OS proc set {35}
OMP: pid 281015 tid 281015 thread 0 bound to OS proc set {238}
OMP: pid 281052 tid 281052 thread 0 bound to OS proc set {33}
OMP: pid 280973 tid 280973 thread 0 bound to OS proc set {171}
OMP: pid 281044 tid 281044 thread 0 bound to OS proc set {241}
OMP: pid 281005 tid 281005 thread 0 bound to OS proc set {214}
OMP: pid 281065 tid 281065 thread 0 bound to OS proc set {134}
OMP: pid 281043 tid 281043 thread 0 bound to OS proc set {212}
OMP: pid 281051 tid 281051 thread 0 bound to OS proc set {206}
OMP: pid 281021 tid 281021 thread 0 bound to OS proc set {84}
OMP: pid 281011 tid 281011 thread 0 bound to OS proc set {67}
OMP: pid 281026 tid 281026 thread 0 bound to OS proc set {124}
OMP: pid 280993 tid 280993 thread 0 bound to OS proc set {0}
OMP: pid 281049 tid 281049 thread 0 bound to OS proc set {137}
OMP: pid 281050 tid 281050 thread 0 bound to OS proc set {186}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 280977 tid 280977 thread 0 bound to OS proc set {201}
OMP: pid 281000 tid 281000 thread 0 bound to OS proc set {167}
OMP: pid 281037 tid 281037 thread 0 bound to OS proc set {208}
OMP: pid 281020 tid 281020 thread 0 bound to OS proc set {120}
OMP: pid 281041 tid 281041 thread 0 bound to OS proc set {252}
OMP: pid 281031 tid 281031 thread 0 bound to OS proc set {126}
OMP: pid 281013 tid 281013 thread 0 bound to OS proc set {220}
OMP: pid 281009 tid 281009 thread 0 bound to OS proc set {183}
OMP: pid 281040 tid 281040 thread 0 bound to OS proc set {143}
OMP: pid 281034 tid 281034 thread 0 bound to OS proc set {152}
OMP: pid 280990 tid 280990 thread 0 bound to OS proc set {204}
OMP: pid 281057 tid 281057 thread 0 bound to OS proc set {39}
OMP: pid 280976 tid 280976 thread 0 bound to OS proc set {246}
OMP: pid 281007 tid 281007 thread 0 bound to OS proc set {80}
OMP: pid 281008 tid 281008 thread 0 bound to OS proc set {158}
OMP: pid 281067 tid 281067 thread 0 bound to OS proc set {195}
OMP: pid 281056 tid 281056 thread 0 bound to OS proc set {169}
OMP: pid 280979 tid 280979 thread 0 bound to OS proc set {155}
OMP: pid 281014 tid 281014 thread 0 bound to OS proc set {244}
OMP: pid 280974 tid 280974 thread 0 bound to OS proc set {110}
OMP: pid 281058 tid 281058 thread 0 bound to OS proc set {254}
OMP: pid 281033 tid 281033 thread 0 bound to OS proc set {89}
OMP: pid 281003 tid 281003 thread 0 bound to OS proc set {163}
OMP: pid 281059 tid 281059 thread 0 bound to OS proc set {232}
OMP: pid 281055 tid 281055 thread 0 bound to OS proc set {223}
OMP: pid 281027 tid 281027 thread 0 bound to OS proc set {217}
OMP: pid 281001 tid 281001 thread 0 bound to OS proc set {165}
OMP: pid 280998 tid 280998 thread 0 bound to OS proc set {192}
OMP: pid 281012 tid 281012 thread 0 bound to OS proc set {198}
OMP: pid 280981 tid 280981 thread 0 bound to OS proc set {226}
OMP: pid 280996 tid 280996 thread 0 bound to OS proc set {250}
OMP: pid 281030 tid 281030 thread 0 bound to OS proc set {101}
OMP: pid 280999 tid 280999 thread 0 bound to OS proc set {189}
OMP: pid 281048 tid 281048 thread 0 bound to OS proc set {210}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
6 by 4 by 4 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.025 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 2885 | 2973 | 3054 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 1.08977 on 96 procs for 10 steps with 32768000 atoms
Performance: 3.964 ns/day, 6.054 hours/ns, 9.176 timesteps/s, 300.688 Matom-step/s
99.0% CPU use with 96 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.81841 | 0.83067 | 0.85625 | 0.6 | 76.22
Neigh | 0.054927 | 0.056512 | 0.059916 | 0.3 | 5.19
Comm | 0.084423 | 0.095682 | 0.1138 | 2.2 | 8.78
Output | 0.0015006 | 0.002785 | 0.0041806 | 1.7 | 0.26
Modify | 0.069979 | 0.080046 | 0.086422 | 1.5 | 7.35
Other | | 0.02407 | | | 2.21
Nlocal: 341333 ave 342574 max 340648 min
Histogram: 45 19 0 0 0 0 0 0 13 19
Nghost: 87167.4 ave 88307 max 85075 min
Histogram: 32 0 0 0 0 0 0 0 1 63
Neighs: 1.28484e+07 ave 1.29035e+07 max 1.2809e+07 min
Histogram: 16 16 17 13 2 0 4 11 2 15
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 2885 | 2973 | 3055 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68646 -1.125785e+08 0 -1.0919982e+08 51538.824
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74785 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84599 -1.1257917e+08 0 -1.0919981e+08 51536.933
500 797.72449 -1.1257864e+08 0 -1.091998e+08 51543.023
510 797.68251 -1.1257846e+08 0 -1.091998e+08 51545.152
Loop time of 58.6458 on 96 procs for 500 steps with 32768000 atoms
Performance: 3.683 ns/day, 6.516 hours/ns, 8.526 timesteps/s, 279.372 Matom-step/s
99.2% CPU use with 96 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 42.339 | 42.559 | 43.812 | 2.2 | 72.57
Neigh | 4.7305 | 4.7611 | 4.9411 | 1.2 | 8.12
Comm | 5.4774 | 5.9438 | 6.3302 | 9.4 | 10.14
Output | 0.01734 | 0.03053 | 0.044168 | 4.9 | 0.05
Modify | 3.636 | 4.2396 | 4.51 | 11.1 | 7.23
Other | | 1.112 | | | 1.90
Nlocal: 341333 ave 342794 max 340344 min
Histogram: 13 20 22 9 0 0 3 6 15 8
Nghost: 87081.4 ave 88642 max 84850 min
Histogram: 16 13 3 0 0 0 4 18 29 13
Neighs: 1.28843e+07 ave 1.29513e+07 max 1.28331e+07 min
Histogram: 8 12 18 18 8 2 7 11 6 6
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747091
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:01:00
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_1 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 120 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 283034 isix04.benchmarkcenter.megware.com {0-2,256-258}
[0] MPI startup(): 1 283012 isix04.benchmarkcenter.megware.com {3-5,259-261}
[0] MPI startup(): 2 283037 isix04.benchmarkcenter.megware.com {6-8,262-264}
[0] MPI startup(): 3 283112 isix04.benchmarkcenter.megware.com {9-10,265-266}
[0] MPI startup(): 4 283110 isix04.benchmarkcenter.megware.com {11-12,267-268}
[0] MPI startup(): 5 283078 isix04.benchmarkcenter.megware.com {13-14,269-270}
[0] MPI startup(): 6 283067 isix04.benchmarkcenter.megware.com {15-16,271-272}
[0] MPI startup(): 7 283054 isix04.benchmarkcenter.megware.com {17-18,273-274}
[0] MPI startup(): 8 283098 isix04.benchmarkcenter.megware.com {19-20,275-276}
[0] MPI startup(): 9 283072 isix04.benchmarkcenter.megware.com {21-22,277-278}
[0] MPI startup(): 10 283059 isix04.benchmarkcenter.megware.com {23-24,279-280}
[0] MPI startup(): 11 283096 isix04.benchmarkcenter.megware.com {25-26,281-282}
[0] MPI startup(): 12 283042 isix04.benchmarkcenter.megware.com {27-28,283-284}
[0] MPI startup(): 13 283038 isix04.benchmarkcenter.megware.com {29-30,285-286}
[0] MPI startup(): 14 283060 isix04.benchmarkcenter.megware.com {31-32,287-288}
[0] MPI startup(): 15 283061 isix04.benchmarkcenter.megware.com {33-34,289-290}
[0] MPI startup(): 16 283125 isix04.benchmarkcenter.megware.com {35-36,291-292}
[0] MPI startup(): 17 283065 isix04.benchmarkcenter.megware.com {37-38,293-294}
[0] MPI startup(): 18 283126 isix04.benchmarkcenter.megware.com {39-40,295-296}
[0] MPI startup(): 19 283044 isix04.benchmarkcenter.megware.com {41-42,297-298}
[0] MPI startup(): 20 283120 isix04.benchmarkcenter.megware.com {43-45,299-301}
[0] MPI startup(): 21 283051 isix04.benchmarkcenter.megware.com {46-48,302-304}
[0] MPI startup(): 22 283121 isix04.benchmarkcenter.megware.com {49-51,305-307}
[0] MPI startup(): 23 283066 isix04.benchmarkcenter.megware.com {52-53,308-309}
[0] MPI startup(): 24 283087 isix04.benchmarkcenter.megware.com {54-55,310-311}
[0] MPI startup(): 25 283088 isix04.benchmarkcenter.megware.com {56-57,312-313}
[0] MPI startup(): 26 283069 isix04.benchmarkcenter.megware.com {58-59,314-315}
[0] MPI startup(): 27 283055 isix04.benchmarkcenter.megware.com {60-61,316-317}
[0] MPI startup(): 28 283113 isix04.benchmarkcenter.megware.com {62-63,318-319}
[0] MPI startup(): 29 283097 isix04.benchmarkcenter.megware.com {64-65,320-321}
[0] MPI startup(): 30 283077 isix04.benchmarkcenter.megware.com {66-67,322-323}
[0] MPI startup(): 31 283062 isix04.benchmarkcenter.megware.com {68-69,324-325}
[0] MPI startup(): 32 283035 isix04.benchmarkcenter.megware.com {70-71,326-327}
[0] MPI startup(): 33 283130 isix04.benchmarkcenter.megware.com {72-73,328-329}
[0] MPI startup(): 34 283068 isix04.benchmarkcenter.megware.com {74-75,330-331}
[0] MPI startup(): 35 283063 isix04.benchmarkcenter.megware.com {76-77,332-333}
[0] MPI startup(): 36 283019 isix04.benchmarkcenter.megware.com {78-79,334-335}
[0] MPI startup(): 37 283080 isix04.benchmarkcenter.megware.com {80-81,336-337}
[0] MPI startup(): 38 283081 isix04.benchmarkcenter.megware.com {82-83,338-339}
[0] MPI startup(): 39 283073 isix04.benchmarkcenter.megware.com {84-85,340-341}
[0] MPI startup(): 40 283115 isix04.benchmarkcenter.megware.com {86-88,342-344}
[0] MPI startup(): 41 283052 isix04.benchmarkcenter.megware.com {89-91,345-347}
[0] MPI startup(): 42 283015 isix04.benchmarkcenter.megware.com {92-93,348-349}
[0] MPI startup(): 43 283114 isix04.benchmarkcenter.megware.com {94-95,350-351}
[0] MPI startup(): 44 283119 isix04.benchmarkcenter.megware.com {96-97,352-353}
[0] MPI startup(): 45 283014 isix04.benchmarkcenter.megware.com {98-99,354-355}
[0] MPI startup(): 46 283095 isix04.benchmarkcenter.megware.com {100-101,356-357}
[0] MPI startup(): 47 283056 isix04.benchmarkcenter.megware.com {102-103,358-359}
[0] MPI startup(): 48 283040 isix04.benchmarkcenter.megware.com {104-105,360-361}
[0] MPI startup(): 49 283028 isix04.benchmarkcenter.megware.com {106-107,362-363}
[0] MPI startup(): 50 283071 isix04.benchmarkcenter.megware.com {108-109,364-365}
[0] MPI startup(): 51 283107 isix04.benchmarkcenter.megware.com {110-111,366-367}
[0] MPI startup(): 52 283094 isix04.benchmarkcenter.megware.com {112-113,368-369}
[0] MPI startup(): 53 283027 isix04.benchmarkcenter.megware.com {114-115,370-371}
[0] MPI startup(): 54 283070 isix04.benchmarkcenter.megware.com {116-117,372-373}
[0] MPI startup(): 55 283057 isix04.benchmarkcenter.megware.com {118-119,374-375}
[0] MPI startup(): 56 283064 isix04.benchmarkcenter.megware.com {120-121,376-377}
[0] MPI startup(): 57 283050 isix04.benchmarkcenter.megware.com {122-123,378-379}
[0] MPI startup(): 58 283058 isix04.benchmarkcenter.megware.com {124-125,380-381}
[0] MPI startup(): 59 283092 isix04.benchmarkcenter.megware.com {126-127,382-383}
[0] MPI startup(): 60 283085 isix04.benchmarkcenter.megware.com {128-130,384-386}
[0] MPI startup(): 61 283100 isix04.benchmarkcenter.megware.com {131-133,387-389}
[0] MPI startup(): 62 283131 isix04.benchmarkcenter.megware.com {134-136,390-392}
[0] MPI startup(): 63 283021 isix04.benchmarkcenter.megware.com {137-138,393-394}
[0] MPI startup(): 64 283022 isix04.benchmarkcenter.megware.com {139-140,395-396}
[0] MPI startup(): 65 283129 isix04.benchmarkcenter.megware.com {141-142,397-398}
[0] MPI startup(): 66 283101 isix04.benchmarkcenter.megware.com {143-144,399-400}
[0] MPI startup(): 67 283102 isix04.benchmarkcenter.megware.com {145-146,401-402}
[0] MPI startup(): 68 283020 isix04.benchmarkcenter.megware.com {147-148,403-404}
[0] MPI startup(): 69 283116 isix04.benchmarkcenter.megware.com {149-150,405-406}
[0] MPI startup(): 70 283018 isix04.benchmarkcenter.megware.com {151-152,407-408}
[0] MPI startup(): 71 283016 isix04.benchmarkcenter.megware.com {153-154,409-410}
[0] MPI startup(): 72 283053 isix04.benchmarkcenter.megware.com {155-156,411-412}
[0] MPI startup(): 73 283082 isix04.benchmarkcenter.megware.com {157-158,413-414}
[0] MPI startup(): 74 283091 isix04.benchmarkcenter.megware.com {159-160,415-416}
[0] MPI startup(): 75 283045 isix04.benchmarkcenter.megware.com {161-162,417-418}
[0] MPI startup(): 76 283086 isix04.benchmarkcenter.megware.com {163-164,419-420}
[0] MPI startup(): 77 283011 isix04.benchmarkcenter.megware.com {165-166,421-422}
[0] MPI startup(): 78 283123 isix04.benchmarkcenter.megware.com {167-168,423-424}
[0] MPI startup(): 79 283118 isix04.benchmarkcenter.megware.com {169-170,425-426}
[0] MPI startup(): 80 283106 isix04.benchmarkcenter.megware.com {171-173,427-429}
[0] MPI startup(): 81 283023 isix04.benchmarkcenter.megware.com {174-176,430-432}
[0] MPI startup(): 82 283074 isix04.benchmarkcenter.megware.com {177-179,433-435}
[0] MPI startup(): 83 283046 isix04.benchmarkcenter.megware.com {180-181,436-437}
[0] MPI startup(): 84 283036 isix04.benchmarkcenter.megware.com {182-183,438-439}
[0] MPI startup(): 85 283132 isix04.benchmarkcenter.megware.com {184-185,440-441}
[0] MPI startup(): 86 283099 isix04.benchmarkcenter.megware.com {186-187,442-443}
[0] MPI startup(): 87 283122 isix04.benchmarkcenter.megware.com {188-189,444-445}
[0] MPI startup(): 88 283117 isix04.benchmarkcenter.megware.com {190-191,446-447}
[0] MPI startup(): 89 283128 isix04.benchmarkcenter.megware.com {192-193,448-449}
[0] MPI startup(): 90 283043 isix04.benchmarkcenter.megware.com {194-195,450-451}
[0] MPI startup(): 91 283075 isix04.benchmarkcenter.megware.com {196-197,452-453}
[0] MPI startup(): 92 283017 isix04.benchmarkcenter.megware.com {198-199,454-455}
[0] MPI startup(): 93 283024 isix04.benchmarkcenter.megware.com {200-201,456-457}
[0] MPI startup(): 94 283013 isix04.benchmarkcenter.megware.com {202-203,458-459}
[0] MPI startup(): 95 283105 isix04.benchmarkcenter.megware.com {204-205,460-461}
[0] MPI startup(): 96 283103 isix04.benchmarkcenter.megware.com {206-207,462-463}
[0] MPI startup(): 97 283084 isix04.benchmarkcenter.megware.com {208-209,464-465}
[0] MPI startup(): 98 283047 isix04.benchmarkcenter.megware.com {210-211,466-467}
[0] MPI startup(): 99 283041 isix04.benchmarkcenter.megware.com {212-213,468-469}
[0] MPI startup(): 100 283089 isix04.benchmarkcenter.megware.com {214-216,470-472}
[0] MPI startup(): 101 283026 isix04.benchmarkcenter.megware.com {217-219,473-475}
[0] MPI startup(): 102 283090 isix04.benchmarkcenter.megware.com {220-221,476-477}
[0] MPI startup(): 103 283048 isix04.benchmarkcenter.megware.com {222-223,478-479}
[0] MPI startup(): 104 283029 isix04.benchmarkcenter.megware.com {224-225,480-481}
[0] MPI startup(): 105 283079 isix04.benchmarkcenter.megware.com {226-227,482-483}
[0] MPI startup(): 106 283093 isix04.benchmarkcenter.megware.com {228-229,484-485}
[0] MPI startup(): 107 283032 isix04.benchmarkcenter.megware.com {230-231,486-487}
[0] MPI startup(): 108 283111 isix04.benchmarkcenter.megware.com {232-233,488-489}
[0] MPI startup(): 109 283127 isix04.benchmarkcenter.megware.com {234-235,490-491}
[0] MPI startup(): 110 283025 isix04.benchmarkcenter.megware.com {236-237,492-493}
[0] MPI startup(): 111 283104 isix04.benchmarkcenter.megware.com {238-239,494-495}
[0] MPI startup(): 112 283076 isix04.benchmarkcenter.megware.com {240-241,496-497}
[0] MPI startup(): 113 283039 isix04.benchmarkcenter.megware.com {242-243,498-499}
[0] MPI startup(): 114 283108 isix04.benchmarkcenter.megware.com {244-245,500-501}
[0] MPI startup(): 115 283033 isix04.benchmarkcenter.megware.com {246-247,502-503}
[0] MPI startup(): 116 283124 isix04.benchmarkcenter.megware.com {248-249,504-505}
[0] MPI startup(): 117 283030 isix04.benchmarkcenter.megware.com {250-251,506-507}
[0] MPI startup(): 118 283049 isix04.benchmarkcenter.megware.com {252-253,508-509}
[0] MPI startup(): 119 283031 isix04.benchmarkcenter.megware.com {254-255,510-511}
OMP: pid 283059 tid 283059 thread 0 bound to OS proc set {23}
OMP: pid 283096 tid 283096 thread 0 bound to OS proc set {25}
OMP: pid 283037 tid 283037 thread 0 bound to OS proc set {6}
OMP: pid 283088 tid 283088 thread 0 bound to OS proc set {56}
OMP: pid 283110 tid 283110 thread 0 bound to OS proc set {11}
OMP: pid 283042 tid 283042 thread 0 bound to OS proc set {27}
OMP: pid 283051 tid 283051 thread 0 bound to OS proc set {46}
OMP: pid 283067 tid 283067 thread 0 bound to OS proc set {15}
OMP: pid 283072 tid 283072 thread 0 bound to OS proc set {21}
OMP: pid 283098 tid 283098 thread 0 bound to OS proc set {19}
OMP: pid 283061 tid 283061 thread 0 bound to OS proc set {33}
OMP: pid 283069 tid 283069 thread 0 bound to OS proc set {58}
OMP: pid 283125 tid 283125 thread 0 bound to OS proc set {35}
OMP: pid 283100 tid 283100 thread 0 bound to OS proc set {131}
OMP: pid 283015 tid 283015 thread 0 bound to OS proc set {92}
OMP: pid 283130 tid 283130 thread 0 bound to OS proc set {72}
OMP: pid 283050 tid 283050 thread 0 bound to OS proc set {122}
OMP: pid 283126 tid 283126 thread 0 bound to OS proc set {39}
OMP: pid 283087 tid 283087 thread 0 bound to OS proc set {54}
OMP: pid 283068 tid 283068 thread 0 bound to OS proc set {74}
OMP: pid 283078 tid 283078 thread 0 bound to OS proc set {13}
OMP: pid 283055 tid 283055 thread 0 bound to OS proc set {60}
OMP: pid 283107 tid 283107 thread 0 bound to OS proc set {110}
OMP: pid 283089 tid 283089 thread 0 bound to OS proc set {214}
OMP: pid 283071 tid 283071 thread 0 bound to OS proc set {108}
OMP: pid 283121 tid 283121 thread 0 bound to OS proc set {49}
OMP: pid 283054 tid 283054 thread 0 bound to OS proc set {17}
OMP: pid 283056 tid 283056 thread 0 bound to OS proc set {102}
OMP: pid 283094 tid 283094 thread 0 bound to OS proc set {112}
OMP: pid 283012 tid 283012 thread 0 bound to OS proc set {3}
OMP: pid 283044 tid 283044 thread 0 bound to OS proc set {41}
OMP: pid 283093 tid 283093 thread 0 bound to OS proc set {228}
OMP: pid 283080 tid 283080 thread 0 bound to OS proc set {80}
OMP: pid 283040 tid 283040 thread 0 bound to OS proc set {104}
OMP: pid 283091 tid 283091 thread 0 bound to OS proc set {159}
OMP: pid 283115 tid 283115 thread 0 bound to OS proc set {86}
OMP: pid 283120 tid 283120 thread 0 bound to OS proc set {43}
OMP: pid 283045 tid 283045 thread 0 bound to OS proc set {161}
OMP: pid 283097 tid 283097 thread 0 bound to OS proc set {64}
OMP: pid 283062 tid 283062 thread 0 bound to OS proc set {68}
OMP: pid 283052 tid 283052 thread 0 bound to OS proc set {89}
OMP: pid 283122 tid 283122 thread 0 bound to OS proc set {188}
OMP: pid 283014 tid 283014 thread 0 bound to OS proc set {98}
OMP: pid 283113 tid 283113 thread 0 bound to OS proc set {62}
OMP: pid 283057 tid 283057 thread 0 bound to OS proc set {118}
OMP: pid 283102 tid 283102 thread 0 bound to OS proc set {145}
OMP: pid 283118 tid 283118 thread 0 bound to OS proc set {169}
OMP: pid 283036 tid 283036 thread 0 bound to OS proc set {182}
OMP: pid 283079 tid 283079 thread 0 bound to OS proc set {226}
OMP: pid 283035 tid 283035 thread 0 bound to OS proc set {70}
OMP: pid 283048 tid 283048 thread 0 bound to OS proc set {222}
OMP: pid 283027 tid 283027 thread 0 bound to OS proc set {114}
OMP: pid 283019 tid 283019 thread 0 bound to OS proc set {78}
OMP: pid 283116 tid 283116 thread 0 bound to OS proc set {149}
OMP: pid 283063 tid 283063 thread 0 bound to OS proc set {76}
OMP: pid 283127 tid 283127 thread 0 bound to OS proc set {234}
OMP: pid 283129 tid 283129 thread 0 bound to OS proc set {141}
OMP: pid 283011 tid 283011 thread 0 bound to OS proc set {165}
OMP: pid 283073 tid 283073 thread 0 bound to OS proc set {84}
OMP: pid 283105 tid 283105 thread 0 bound to OS proc set {204}
OMP: pid 283131 tid 283131 thread 0 bound to OS proc set {134}
OMP: pid 283013 tid 283013 thread 0 bound to OS proc set {202}
OMP: pid 283119 tid 283119 thread 0 bound to OS proc set {96}
OMP: pid 283058 tid 283058 thread 0 bound to OS proc set {124}
OMP: pid 283046 tid 283046 thread 0 bound to OS proc set {180}
OMP: pid 283021 tid 283021 thread 0 bound to OS proc set {137}
OMP: pid 283032 tid 283032 thread 0 bound to OS proc set {230}
OMP: pid 283066 tid 283066 thread 0 bound to OS proc set {52}
OMP: pid 283084 tid 283084 thread 0 bound to OS proc set {208}
OMP: pid 283128 tid 283128 thread 0 bound to OS proc set {192}
OMP: pid 283090 tid 283090 thread 0 bound to OS proc set {220}
OMP: pid 283077 tid 283077 thread 0 bound to OS proc set {66}
OMP: pid 283075 tid 283075 thread 0 bound to OS proc set {196}
OMP: pid 283038 tid 283038 thread 0 bound to OS proc set {29}
OMP: pid 283114 tid 283114 thread 0 bound to OS proc set {94}
OMP: pid 283029 tid 283029 thread 0 bound to OS proc set {224}
OMP: pid 283085 tid 283085 thread 0 bound to OS proc set {128}
OMP: pid 283070 tid 283070 thread 0 bound to OS proc set {116}
OMP: pid 283053 tid 283053 thread 0 bound to OS proc set {155}
OMP: pid 283016 tid 283016 thread 0 bound to OS proc set {153}
OMP: pid 283033 tid 283033 thread 0 bound to OS proc set {246}
OMP: pid 283034 tid 283034 thread 0 bound to OS proc set {0}
OMP: pid 283112 tid 283112 thread 0 bound to OS proc set {9}
OMP: pid 283074 tid 283074 thread 0 bound to OS proc set {177}
OMP: pid 283095 tid 283095 thread 0 bound to OS proc set {100}
OMP: pid 283020 tid 283020 thread 0 bound to OS proc set {147}
LAMMPS (22 Jul 2025)
OMP: pid 283081 tid 283081 thread 0 bound to OS proc set {82}
using 1 OpenMP thread(s) per MPI task
OMP: pid 283101 tid 283101 thread 0 bound to OS proc set {143}
OMP: pid 283018 tid 283018 thread 0 bound to OS proc set {151}
OMP: pid 283108 tid 283108 thread 0 bound to OS proc set {244}
OMP: pid 283060 tid 283060 thread 0 bound to OS proc set {31}
OMP: pid 283086 tid 283086 thread 0 bound to OS proc set {163}
OMP: pid 283022 tid 283022 thread 0 bound to OS proc set {139}
OMP: pid 283025 tid 283025 thread 0 bound to OS proc set {236}
OMP: pid 283065 tid 283065 thread 0 bound to OS proc set {37}
OMP: pid 283092 tid 283092 thread 0 bound to OS proc set {126}
OMP: pid 283132 tid 283132 thread 0 bound to OS proc set {184}
OMP: pid 283039 tid 283039 thread 0 bound to OS proc set {242}
OMP: pid 283023 tid 283023 thread 0 bound to OS proc set {174}
OMP: pid 283030 tid 283030 thread 0 bound to OS proc set {250}
OMP: pid 283049 tid 283049 thread 0 bound to OS proc set {252}
OMP: pid 283082 tid 283082 thread 0 bound to OS proc set {157}
OMP: pid 283103 tid 283103 thread 0 bound to OS proc set {206}
OMP: pid 283026 tid 283026 thread 0 bound to OS proc set {217}
OMP: pid 283117 tid 283117 thread 0 bound to OS proc set {190}
OMP: pid 283076 tid 283076 thread 0 bound to OS proc set {240}
OMP: pid 283041 tid 283041 thread 0 bound to OS proc set {212}
OMP: pid 283043 tid 283043 thread 0 bound to OS proc set {194}
OMP: pid 283064 tid 283064 thread 0 bound to OS proc set {120}
OMP: pid 283031 tid 283031 thread 0 bound to OS proc set {254}
OMP: pid 283028 tid 283028 thread 0 bound to OS proc set {106}
OMP: pid 283123 tid 283123 thread 0 bound to OS proc set {167}
OMP: pid 283047 tid 283047 thread 0 bound to OS proc set {210}
OMP: pid 283104 tid 283104 thread 0 bound to OS proc set {238}
OMP: pid 283017 tid 283017 thread 0 bound to OS proc set {198}
OMP: pid 283124 tid 283124 thread 0 bound to OS proc set {248}
OMP: pid 283106 tid 283106 thread 0 bound to OS proc set {171}
OMP: pid 283111 tid 283111 thread 0 bound to OS proc set {232}
OMP: pid 283024 tid 283024 thread 0 bound to OS proc set {200}
OMP: pid 283099 tid 283099 thread 0 bound to OS proc set {186}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
6 by 4 by 5 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.023 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 2302 | 2381 | 2453 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.903177 on 120 procs for 10 steps with 32768000 atoms
Performance: 4.783 ns/day, 5.018 hours/ns, 11.072 timesteps/s, 362.808 Matom-step/s
99.1% CPU use with 120 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.65996 | 0.67109 | 0.70439 | 0.7 | 74.30
Neigh | 0.043588 | 0.044903 | 0.049246 | 0.4 | 4.97
Comm | 0.073107 | 0.089286 | 0.10495 | 2.5 | 9.89
Output | 0.0014489 | 0.0028039 | 0.0043437 | 1.5 | 0.31
Modify | 0.060858 | 0.073237 | 0.083218 | 2.5 | 8.11
Other | | 0.02186 | | | 2.42
Nlocal: 273067 ave 274057 max 272483 min
Histogram: 38 42 0 0 0 0 0 0 13 27
Nghost: 76628 ave 77555 max 74944 min
Histogram: 38 2 0 0 0 0 0 0 5 75
Neighs: 1.02787e+07 ave 1.03384e+07 max 1.02326e+07 min
Histogram: 16 6 24 16 11 15 7 12 5 8
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 2303 | 2381 | 2453 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74785 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.934
500 797.7245 -1.1257864e+08 0 -1.091998e+08 51543.023
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.153
Loop time of 48.3657 on 120 procs for 500 steps with 32768000 atoms
Performance: 4.466 ns/day, 5.374 hours/ns, 10.338 timesteps/s, 338.753 Matom-step/s
99.2% CPU use with 120 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 33.982 | 34.247 | 35.731 | 2.9 | 70.81
Neigh | 3.7951 | 3.8299 | 4.0038 | 1.9 | 7.92
Comm | 4.8197 | 5.3284 | 5.7007 | 11.1 | 11.02
Output | 0.016349 | 0.029373 | 0.040907 | 4.5 | 0.06
Modify | 3.1944 | 3.9522 | 4.3029 | 15.9 | 8.17
Other | | 0.9784 | | | 2.02
Nlocal: 273067 ave 274300 max 272242 min
Histogram: 16 27 24 10 3 2 4 8 17 9
Nghost: 76557.5 ave 77906 max 74701 min
Histogram: 21 13 6 0 0 1 9 25 31 14
Neighs: 1.03075e+07 ave 1.03724e+07 max 1.02483e+07 min
Histogram: 2 12 20 19 13 20 9 12 7 6
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747092
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:49
[MAQAO] Info: 32/120 lprof instances finished
[MAQAO] Info: 36/120 lprof instances finished
[MAQAO] Info: 40/120 lprof instances finished
[MAQAO] Info: 43/120 lprof instances finished
[MAQAO] Info: 48/120 lprof instances finished
[MAQAO] Info: 66/120 lprof instances finished
[MAQAO] Info: 80/120 lprof instances finished
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_2 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 126 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 285753 isix04.benchmarkcenter.megware.com {0-2,256-258}
[0] MPI startup(): 1 285825 isix04.benchmarkcenter.megware.com {3-4,259-260}
[0] MPI startup(): 2 285758 isix04.benchmarkcenter.megware.com {5-6,261-262}
[0] MPI startup(): 3 285728 isix04.benchmarkcenter.megware.com {7-8,263-264}
[0] MPI startup(): 4 285800 isix04.benchmarkcenter.megware.com {9-10,265-266}
[0] MPI startup(): 5 285799 isix04.benchmarkcenter.megware.com {11-12,267-268}
[0] MPI startup(): 6 285748 isix04.benchmarkcenter.megware.com {13-14,269-270}
[0] MPI startup(): 7 285733 isix04.benchmarkcenter.megware.com {15-16,271-272}
[0] MPI startup(): 8 285845 isix04.benchmarkcenter.megware.com {17-18,273-274}
[0] MPI startup(): 9 285843 isix04.benchmarkcenter.megware.com {19-20,275-276}
[0] MPI startup(): 10 285810 isix04.benchmarkcenter.megware.com {21-22,277-278}
[0] MPI startup(): 11 285822 isix04.benchmarkcenter.megware.com {23-24,279-280}
[0] MPI startup(): 12 285832 isix04.benchmarkcenter.megware.com {25-26,281-282}
[0] MPI startup(): 13 285777 isix04.benchmarkcenter.megware.com {27-28,283-284}
[0] MPI startup(): 14 285786 isix04.benchmarkcenter.megware.com {29-30,285-286}
[0] MPI startup(): 15 285814 isix04.benchmarkcenter.megware.com {31-32,287-288}
[0] MPI startup(): 16 285842 isix04.benchmarkcenter.megware.com {33-34,289-290}
[0] MPI startup(): 17 285846 isix04.benchmarkcenter.megware.com {35-36,291-292}
[0] MPI startup(): 18 285766 isix04.benchmarkcenter.megware.com {37-38,293-294}
[0] MPI startup(): 19 285732 isix04.benchmarkcenter.megware.com {39-40,295-296}
[0] MPI startup(): 20 285780 isix04.benchmarkcenter.megware.com {41-42,297-298}
[0] MPI startup(): 21 285823 isix04.benchmarkcenter.megware.com {43-45,299-301}
[0] MPI startup(): 22 285833 isix04.benchmarkcenter.megware.com {46-47,302-303}
[0] MPI startup(): 23 285827 isix04.benchmarkcenter.megware.com {48-49,304-305}
[0] MPI startup(): 24 285776 isix04.benchmarkcenter.megware.com {50-51,306-307}
[0] MPI startup(): 25 285757 isix04.benchmarkcenter.megware.com {52-53,308-309}
[0] MPI startup(): 26 285784 isix04.benchmarkcenter.megware.com {54-55,310-311}
[0] MPI startup(): 27 285820 isix04.benchmarkcenter.megware.com {56-57,312-313}
[0] MPI startup(): 28 285821 isix04.benchmarkcenter.megware.com {58-59,314-315}
[0] MPI startup(): 29 285807 isix04.benchmarkcenter.megware.com {60-61,316-317}
[0] MPI startup(): 30 285841 isix04.benchmarkcenter.megware.com {62-63,318-319}
[0] MPI startup(): 31 285741 isix04.benchmarkcenter.megware.com {64-65,320-321}
[0] MPI startup(): 32 285831 isix04.benchmarkcenter.megware.com {66-67,322-323}
[0] MPI startup(): 33 285828 isix04.benchmarkcenter.megware.com {68-69,324-325}
[0] MPI startup(): 34 285804 isix04.benchmarkcenter.megware.com {70-71,326-327}
[0] MPI startup(): 35 285819 isix04.benchmarkcenter.megware.com {72-73,328-329}
[0] MPI startup(): 36 285795 isix04.benchmarkcenter.megware.com {74-75,330-331}
[0] MPI startup(): 37 285740 isix04.benchmarkcenter.megware.com {76-77,332-333}
[0] MPI startup(): 38 285829 isix04.benchmarkcenter.megware.com {78-79,334-335}
[0] MPI startup(): 39 285787 isix04.benchmarkcenter.megware.com {80-81,336-337}
[0] MPI startup(): 40 285824 isix04.benchmarkcenter.megware.com {82-83,338-339}
[0] MPI startup(): 41 285798 isix04.benchmarkcenter.megware.com {84-85,340-341}
[0] MPI startup(): 42 285809 isix04.benchmarkcenter.megware.com {86-87,342-343}
[0] MPI startup(): 43 285806 isix04.benchmarkcenter.megware.com {88-89,344-345}
[0] MPI startup(): 44 285751 isix04.benchmarkcenter.megware.com {90-91,346-347}
[0] MPI startup(): 45 285788 isix04.benchmarkcenter.megware.com {92-93,348-349}
[0] MPI startup(): 46 285808 isix04.benchmarkcenter.megware.com {94-95,350-351}
[0] MPI startup(): 47 285815 isix04.benchmarkcenter.megware.com {96-97,352-353}
[0] MPI startup(): 48 285813 isix04.benchmarkcenter.megware.com {98-99,354-355}
[0] MPI startup(): 49 285736 isix04.benchmarkcenter.megware.com {100-101,356-357}
[0] MPI startup(): 50 285849 isix04.benchmarkcenter.megware.com {102-103,358-359}
[0] MPI startup(): 51 285761 isix04.benchmarkcenter.megware.com {104-105,360-361}
[0] MPI startup(): 52 285759 isix04.benchmarkcenter.megware.com {106-107,362-363}
[0] MPI startup(): 53 285762 isix04.benchmarkcenter.megware.com {108-109,364-365}
[0] MPI startup(): 54 285785 isix04.benchmarkcenter.megware.com {110-111,366-367}
[0] MPI startup(): 55 285735 isix04.benchmarkcenter.megware.com {112-113,368-369}
[0] MPI startup(): 56 285816 isix04.benchmarkcenter.megware.com {114-115,370-371}
[0] MPI startup(): 57 285731 isix04.benchmarkcenter.megware.com {116-117,372-373}
[0] MPI startup(): 58 285768 isix04.benchmarkcenter.megware.com {118-119,374-375}
[0] MPI startup(): 59 285805 isix04.benchmarkcenter.megware.com {120-121,376-377}
[0] MPI startup(): 60 285738 isix04.benchmarkcenter.megware.com {122-123,378-379}
[0] MPI startup(): 61 285755 isix04.benchmarkcenter.megware.com {124-125,380-381}
[0] MPI startup(): 62 285760 isix04.benchmarkcenter.megware.com {126-127,382-383}
[0] MPI startup(): 63 285749 isix04.benchmarkcenter.megware.com {128-130,384-386}
[0] MPI startup(): 64 285797 isix04.benchmarkcenter.megware.com {131-132,387-388}
[0] MPI startup(): 65 285754 isix04.benchmarkcenter.megware.com {133-134,389-390}
[0] MPI startup(): 66 285840 isix04.benchmarkcenter.megware.com {135-136,391-392}
[0] MPI startup(): 67 285826 isix04.benchmarkcenter.megware.com {137-138,393-394}
[0] MPI startup(): 68 285763 isix04.benchmarkcenter.megware.com {139-140,395-396}
[0] MPI startup(): 69 285769 isix04.benchmarkcenter.megware.com {141-142,397-398}
[0] MPI startup(): 70 285839 isix04.benchmarkcenter.megware.com {143-144,399-400}
[0] MPI startup(): 71 285778 isix04.benchmarkcenter.megware.com {145-146,401-402}
[0] MPI startup(): 72 285793 isix04.benchmarkcenter.megware.com {147-148,403-404}
[0] MPI startup(): 73 285742 isix04.benchmarkcenter.megware.com {149-150,405-406}
[0] MPI startup(): 74 285847 isix04.benchmarkcenter.megware.com {151-152,407-408}
[0] MPI startup(): 75 285801 isix04.benchmarkcenter.megware.com {153-154,409-410}
[0] MPI startup(): 76 285848 isix04.benchmarkcenter.megware.com {155-156,411-412}
[0] MPI startup(): 77 285781 isix04.benchmarkcenter.megware.com {157-158,413-414}
[0] MPI startup(): 78 285796 isix04.benchmarkcenter.megware.com {159-160,415-416}
[0] MPI startup(): 79 285767 isix04.benchmarkcenter.megware.com {161-162,417-418}
[0] MPI startup(): 80 285850 isix04.benchmarkcenter.megware.com {163-164,419-420}
[0] MPI startup(): 81 285764 isix04.benchmarkcenter.megware.com {165-166,421-422}
[0] MPI startup(): 82 285790 isix04.benchmarkcenter.megware.com {167-168,423-424}
[0] MPI startup(): 83 285834 isix04.benchmarkcenter.megware.com {169-170,425-426}
[0] MPI startup(): 84 285773 isix04.benchmarkcenter.megware.com {171-173,427-429}
[0] MPI startup(): 85 285779 isix04.benchmarkcenter.megware.com {174-175,430-431}
[0] MPI startup(): 86 285836 isix04.benchmarkcenter.megware.com {176-177,432-433}
[0] MPI startup(): 87 285851 isix04.benchmarkcenter.megware.com {178-179,434-435}
[0] MPI startup(): 88 285802 isix04.benchmarkcenter.megware.com {180-181,436-437}
[0] MPI startup(): 89 285789 isix04.benchmarkcenter.megware.com {182-183,438-439}
[0] MPI startup(): 90 285830 isix04.benchmarkcenter.megware.com {184-185,440-441}
[0] MPI startup(): 91 285747 isix04.benchmarkcenter.megware.com {186-187,442-443}
[0] MPI startup(): 92 285745 isix04.benchmarkcenter.megware.com {188-189,444-445}
[0] MPI startup(): 93 285852 isix04.benchmarkcenter.megware.com {190-191,446-447}
[0] MPI startup(): 94 285756 isix04.benchmarkcenter.megware.com {192-193,448-449}
[0] MPI startup(): 95 285774 isix04.benchmarkcenter.megware.com {194-195,450-451}
[0] MPI startup(): 96 285783 isix04.benchmarkcenter.megware.com {196-197,452-453}
[0] MPI startup(): 97 285792 isix04.benchmarkcenter.megware.com {198-199,454-455}
[0] MPI startup(): 98 285844 isix04.benchmarkcenter.megware.com {200-201,456-457}
[0] MPI startup(): 99 285794 isix04.benchmarkcenter.megware.com {202-203,458-459}
[0] MPI startup(): 100 285853 isix04.benchmarkcenter.megware.com {204-205,460-461}
[0] MPI startup(): 101 285775 isix04.benchmarkcenter.megware.com {206-207,462-463}
[0] MPI startup(): 102 285729 isix04.benchmarkcenter.megware.com {208-209,464-465}
[0] MPI startup(): 103 285750 isix04.benchmarkcenter.megware.com {210-211,466-467}
[0] MPI startup(): 104 285791 isix04.benchmarkcenter.megware.com {212-213,468-469}
[0] MPI startup(): 105 285817 isix04.benchmarkcenter.megware.com {214-215,470-471}
[0] MPI startup(): 106 285838 isix04.benchmarkcenter.megware.com {216-217,472-473}
[0] MPI startup(): 107 285772 isix04.benchmarkcenter.megware.com {218-219,474-475}
[0] MPI startup(): 108 285835 isix04.benchmarkcenter.megware.com {220-221,476-477}
[0] MPI startup(): 109 285746 isix04.benchmarkcenter.megware.com {222-223,478-479}
[0] MPI startup(): 110 285730 isix04.benchmarkcenter.megware.com {224-225,480-481}
[0] MPI startup(): 111 285811 isix04.benchmarkcenter.megware.com {226-227,482-483}
[0] MPI startup(): 112 285782 isix04.benchmarkcenter.megware.com {228-229,484-485}
[0] MPI startup(): 113 285734 isix04.benchmarkcenter.megware.com {230-231,486-487}
[0] MPI startup(): 114 285743 isix04.benchmarkcenter.megware.com {232-233,488-489}
[0] MPI startup(): 115 285737 isix04.benchmarkcenter.megware.com {234-235,490-491}
[0] MPI startup(): 116 285770 isix04.benchmarkcenter.megware.com {236-237,492-493}
[0] MPI startup(): 117 285812 isix04.benchmarkcenter.megware.com {238-239,494-495}
[0] MPI startup(): 118 285771 isix04.benchmarkcenter.megware.com {240-241,496-497}
[0] MPI startup(): 119 285744 isix04.benchmarkcenter.megware.com {242-243,498-499}
[0] MPI startup(): 120 285739 isix04.benchmarkcenter.megware.com {244-245,500-501}
[0] MPI startup(): 121 285765 isix04.benchmarkcenter.megware.com {246-247,502-503}
[0] MPI startup(): 122 285818 isix04.benchmarkcenter.megware.com {248-249,504-505}
[0] MPI startup(): 123 285752 isix04.benchmarkcenter.megware.com {250-251,506-507}
[0] MPI startup(): 124 285803 isix04.benchmarkcenter.megware.com {252-253,508-509}
[0] MPI startup(): 125 285837 isix04.benchmarkcenter.megware.com {254-255,510-511}
OMP: pid 285799 tid 285799 thread 0 bound to OS proc set {11}
OMP: pid 285766 tid 285766 thread 0 bound to OS proc set {37}
OMP: pid 285822 tid 285822 thread 0 bound to OS proc set {23}
OMP: pid 285832 tid 285832 thread 0 bound to OS proc set {25}
OMP: pid 285846 tid 285846 thread 0 bound to OS proc set {35}
OMP: pid 285786 tid 285786 thread 0 bound to OS proc set {29}
OMP: pid 285845 tid 285845 thread 0 bound to OS proc set {17}
OMP: pid 285842 tid 285842 thread 0 bound to OS proc set {33}
OMP: pid 285843 tid 285843 thread 0 bound to OS proc set {19}
OMP: pid 285732 tid 285732 thread 0 bound to OS proc set {39}
OMP: pid 285757 tid 285757 thread 0 bound to OS proc set {52}
OMP: pid 285748 tid 285748 thread 0 bound to OS proc set {13}
OMP: pid 285853 tid 285853 thread 0 bound to OS proc set {204}
OMP: pid 285800 tid 285800 thread 0 bound to OS proc set {9}
OMP: pid 285795 tid 285795 thread 0 bound to OS proc set {74}
OMP: pid 285814 tid 285814 thread 0 bound to OS proc set {31}
OMP: pid 285827 tid 285827 thread 0 bound to OS proc set {48}
OMP: pid 285821 tid 285821 thread 0 bound to OS proc set {58}
OMP: pid 285815 tid 285815 thread 0 bound to OS proc set {96}
OMP: pid 285840 tid 285840 thread 0 bound to OS proc set {135}
OMP: pid 285776 tid 285776 thread 0 bound to OS proc set {50}
OMP: pid 285823 tid 285823 thread 0 bound to OS proc set {43}
OMP: pid 285825 tid 285825 thread 0 bound to OS proc set {3}
OMP: pid 285812 tid 285812 thread 0 bound to OS proc set {238}
OMP: pid 285829 tid 285829 thread 0 bound to OS proc set {78}
OMP: pid 285850 tid 285850 thread 0 bound to OS proc set {163}
OMP: pid 285733 tid 285733 thread 0 bound to OS proc set {15}
OMP: pid 285751 tid 285751 thread 0 bound to OS proc set {90}
OMP: pid 285760 tid 285760 thread 0 bound to OS proc set {126}
OMP: pid 285820 tid 285820 thread 0 bound to OS proc set {56}
OMP: pid 285810 tid 285810 thread 0 bound to OS proc set {21}
OMP: pid 285780 tid 285780 thread 0 bound to OS proc set {41}
OMP: pid 285809 tid 285809 thread 0 bound to OS proc set {86}
OMP: pid 285741 tid 285741 thread 0 bound to OS proc set {64}
OMP: pid 285841 tid 285841 thread 0 bound to OS proc set {62}
OMP: pid 285837 tid 285837 thread 0 bound to OS proc set {254}
OMP: pid 285735 tid 285735 thread 0 bound to OS proc set {112}
OMP: pid 285805 tid 285805 thread 0 bound to OS proc set {120}
OMP: pid 285824 tid 285824 thread 0 bound to OS proc set {82}
OMP: pid 285806 tid 285806 thread 0 bound to OS proc set {88}
OMP: pid 285808 tid 285808 thread 0 bound to OS proc set {94}
OMP: pid 285819 tid 285819 thread 0 bound to OS proc set {72}
OMP: pid 285833 tid 285833 thread 0 bound to OS proc set {46}
OMP: pid 285745 tid 285745 thread 0 bound to OS proc set {188}
OMP: pid 285740 tid 285740 thread 0 bound to OS proc set {76}
OMP: pid 285774 tid 285774 thread 0 bound to OS proc set {194}
OMP: pid 285787 tid 285787 thread 0 bound to OS proc set {80}
OMP: pid 285758 tid 285758 thread 0 bound to OS proc set {5}
OMP: pid 285798 tid 285798 thread 0 bound to OS proc set {84}
OMP: pid 285791 tid 285791 thread 0 bound to OS proc set {212}
OMP: pid 285828 tid 285828 thread 0 bound to OS proc set {68}
OMP: pid 285813 tid 285813 thread 0 bound to OS proc set {98}
OMP: pid 285844 tid 285844 thread 0 bound to OS proc set {200}
OMP: pid 285753 tid 285753 thread 0 bound to OS proc set {0}
OMP: pid 285783 tid 285783 thread 0 bound to OS proc set {196}
OMP: pid 285794 tid 285794 thread 0 bound to OS proc set {202}
OMP: pid 285767 tid 285767 thread 0 bound to OS proc set {161}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 285739 tid 285739 thread 0 bound to OS proc set {244}
OMP: pid 285804 tid 285804 thread 0 bound to OS proc set {70}
OMP: pid 285728 tid 285728 thread 0 bound to OS proc set {7}
OMP: pid 285835 tid 285835 thread 0 bound to OS proc set {220}
OMP: pid 285852 tid 285852 thread 0 bound to OS proc set {190}
OMP: pid 285816 tid 285816 thread 0 bound to OS proc set {114}
OMP: pid 285768 tid 285768 thread 0 bound to OS proc set {118}
OMP: pid 285755 tid 285755 thread 0 bound to OS proc set {124}
OMP: pid 285778 tid 285778 thread 0 bound to OS proc set {145}
OMP: pid 285742 tid 285742 thread 0 bound to OS proc set {149}
OMP: pid 285772 tid 285772 thread 0 bound to OS proc set {218}
OMP: pid 285818 tid 285818 thread 0 bound to OS proc set {248}
OMP: pid 285770 tid 285770 thread 0 bound to OS proc set {236}
OMP: pid 285796 tid 285796 thread 0 bound to OS proc set {159}
OMP: pid 285736 tid 285736 thread 0 bound to OS proc set {100}
OMP: pid 285836 tid 285836 thread 0 bound to OS proc set {176}
OMP: pid 285784 tid 285784 thread 0 bound to OS proc set {54}
OMP: pid 285807 tid 285807 thread 0 bound to OS proc set {60}
OMP: pid 285764 tid 285764 thread 0 bound to OS proc set {165}
OMP: pid 285746 tid 285746 thread 0 bound to OS proc set {222}
OMP: pid 285834 tid 285834 thread 0 bound to OS proc set {169}
OMP: pid 285763 tid 285763 thread 0 bound to OS proc set {139}
OMP: pid 285759 tid 285759 thread 0 bound to OS proc set {106}
OMP: pid 285797 tid 285797 thread 0 bound to OS proc set {131}
OMP: pid 285752 tid 285752 thread 0 bound to OS proc set {250}
OMP: pid 285847 tid 285847 thread 0 bound to OS proc set {151}
OMP: pid 285785 tid 285785 thread 0 bound to OS proc set {110}
OMP: pid 285788 tid 285788 thread 0 bound to OS proc set {92}
OMP: pid 285851 tid 285851 thread 0 bound to OS proc set {178}
OMP: pid 285773 tid 285773 thread 0 bound to OS proc set {171}
OMP: pid 285769 tid 285769 thread 0 bound to OS proc set {141}
OMP: pid 285761 tid 285761 thread 0 bound to OS proc set {104}
OMP: pid 285747 tid 285747 thread 0 bound to OS proc set {186}
OMP: pid 285849 tid 285849 thread 0 bound to OS proc set {102}
OMP: pid 285771 tid 285771 thread 0 bound to OS proc set {240}
OMP: pid 285848 tid 285848 thread 0 bound to OS proc set {155}
OMP: pid 285789 tid 285789 thread 0 bound to OS proc set {182}
OMP: pid 285790 tid 285790 thread 0 bound to OS proc set {167}
OMP: pid 285817 tid 285817 thread 0 bound to OS proc set {214}
OMP: pid 285754 tid 285754 thread 0 bound to OS proc set {133}
OMP: pid 285838 tid 285838 thread 0 bound to OS proc set {216}
OMP: pid 285811 tid 285811 thread 0 bound to OS proc set {226}
OMP: pid 285762 tid 285762 thread 0 bound to OS proc set {108}
OMP: pid 285743 tid 285743 thread 0 bound to OS proc set {232}
OMP: pid 285765 tid 285765 thread 0 bound to OS proc set {246}
OMP: pid 285756 tid 285756 thread 0 bound to OS proc set {192}
OMP: pid 285830 tid 285830 thread 0 bound to OS proc set {184}
OMP: pid 285839 tid 285839 thread 0 bound to OS proc set {143}
OMP: pid 285744 tid 285744 thread 0 bound to OS proc set {242}
OMP: pid 285731 tid 285731 thread 0 bound to OS proc set {116}
OMP: pid 285729 tid 285729 thread 0 bound to OS proc set {208}
OMP: pid 285831 tid 285831 thread 0 bound to OS proc set {66}
OMP: pid 285777 tid 285777 thread 0 bound to OS proc set {27}
OMP: pid 285793 tid 285793 thread 0 bound to OS proc set {147}
OMP: pid 285737 tid 285737 thread 0 bound to OS proc set {234}
OMP: pid 285750 tid 285750 thread 0 bound to OS proc set {210}
OMP: pid 285826 tid 285826 thread 0 bound to OS proc set {137}
OMP: pid 285779 tid 285779 thread 0 bound to OS proc set {174}
OMP: pid 285803 tid 285803 thread 0 bound to OS proc set {252}
OMP: pid 285734 tid 285734 thread 0 bound to OS proc set {230}
OMP: pid 285730 tid 285730 thread 0 bound to OS proc set {224}
OMP: pid 285792 tid 285792 thread 0 bound to OS proc set {198}
OMP: pid 285782 tid 285782 thread 0 bound to OS proc set {228}
OMP: pid 285801 tid 285801 thread 0 bound to OS proc set {153}
OMP: pid 285749 tid 285749 thread 0 bound to OS proc set {128}
OMP: pid 285802 tid 285802 thread 0 bound to OS proc set {180}
OMP: pid 285775 tid 285775 thread 0 bound to OS proc set {206}
OMP: pid 285781 tid 285781 thread 0 bound to OS proc set {157}
OMP: pid 285738 tid 285738 thread 0 bound to OS proc set {122}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
7 by 3 by 6 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.022 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 2227 | 2267 | 2316 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.878401 on 126 procs for 10 steps with 32768000 atoms
Performance: 4.918 ns/day, 4.880 hours/ns, 11.384 timesteps/s, 373.042 Matom-step/s
99.0% CPU use with 126 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.63329 | 0.64696 | 0.66081 | 0.7 | 73.65
Neigh | 0.042195 | 0.044481 | 0.04837 | 0.8 | 5.06
Comm | 0.071368 | 0.085376 | 0.10231 | 2.4 | 9.72
Output | 0.0014254 | 0.0027915 | 0.0049238 | 1.6 | 0.32
Modify | 0.051453 | 0.076307 | 0.082776 | 1.9 | 8.69
Other | | 0.02249 | | | 2.56
Nlocal: 260063 ave 263375 max 256799 min
Histogram: 12 6 8 25 11 28 4 11 13 8
Nghost: 72260.8 ave 74889 max 68845 min
Histogram: 8 4 8 20 15 11 17 7 24 12
Neighs: 9.78925e+06 ave 9.95568e+06 max 9.65795e+06 min
Histogram: 12 16 10 20 12 22 13 5 12 4
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 2230 | 2268 | 2316 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74786 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.934
500 797.7245 -1.1257864e+08 0 -1.091998e+08 51543.023
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.153
Loop time of 47.2966 on 126 procs for 500 steps with 32768000 atoms
Performance: 4.567 ns/day, 5.255 hours/ns, 10.572 timesteps/s, 346.410 Matom-step/s
99.1% CPU use with 126 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 32.784 | 33.36 | 34.065 | 5.6 | 70.53
Neigh | 3.5789 | 3.6861 | 3.8764 | 3.3 | 7.79
Comm | 4.4982 | 5.4359 | 6.3252 | 17.3 | 11.49
Output | 0.01859 | 0.031546 | 0.050042 | 4.9 | 0.07
Modify | 2.6183 | 3.7658 | 4.0924 | 15.4 | 7.96
Other | | 1.017 | | | 2.15
Nlocal: 260063 ave 263500 max 256426 min
Histogram: 11 1 14 8 28 15 17 17 7 8
Nghost: 72053.3 ave 75204 max 68718 min
Histogram: 12 1 7 18 25 18 9 18 17 1
Neighs: 9.81664e+06 ave 9.98144e+06 max 9.67213e+06 min
Histogram: 7 7 22 14 18 23 12 8 11 4
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747092
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:48
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_3 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 144 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 289047 isix04.benchmarkcenter.megware.com {0-1,256-257}
[0] MPI startup(): 1 289096 isix04.benchmarkcenter.megware.com {2-3,258-259}
[0] MPI startup(): 2 289158 isix04.benchmarkcenter.megware.com {4-5,260-261}
[0] MPI startup(): 3 289072 isix04.benchmarkcenter.megware.com {6-7,262-263}
[0] MPI startup(): 4 289084 isix04.benchmarkcenter.megware.com {8-9,264-265}
[0] MPI startup(): 5 289159 isix04.benchmarkcenter.megware.com {10-11,266-267}
[0] MPI startup(): 6 289073 isix04.benchmarkcenter.megware.com {12-13,268-269}
[0] MPI startup(): 7 289093 isix04.benchmarkcenter.megware.com {14-15,270-271}
[0] MPI startup(): 8 289065 isix04.benchmarkcenter.megware.com {16-17,272-273}
[0] MPI startup(): 9 289060 isix04.benchmarkcenter.megware.com {18-19,274-275}
[0] MPI startup(): 10 289035 isix04.benchmarkcenter.megware.com {20-21,276-277}
[0] MPI startup(): 11 289098 isix04.benchmarkcenter.megware.com {22-23,278-279}
[0] MPI startup(): 12 289124 isix04.benchmarkcenter.megware.com {24-25,280-281}
[0] MPI startup(): 13 289063 isix04.benchmarkcenter.megware.com {26-27,282-283}
[0] MPI startup(): 14 289043 isix04.benchmarkcenter.megware.com {28-29,284-285}
[0] MPI startup(): 15 289075 isix04.benchmarkcenter.megware.com {30-31,286-287}
[0] MPI startup(): 16 289053 isix04.benchmarkcenter.megware.com {32-33,288-289}
[0] MPI startup(): 17 289114 isix04.benchmarkcenter.megware.com {34-35,290-291}
[0] MPI startup(): 18 289121 isix04.benchmarkcenter.megware.com {36-37,292-293}
[0] MPI startup(): 19 289123 isix04.benchmarkcenter.megware.com {38,294}
[0] MPI startup(): 20 289176 isix04.benchmarkcenter.megware.com {39,295}
[0] MPI startup(): 21 289116 isix04.benchmarkcenter.megware.com {40,296}
[0] MPI startup(): 22 289118 isix04.benchmarkcenter.megware.com {41,297}
[0] MPI startup(): 23 289062 isix04.benchmarkcenter.megware.com {42,298}
[0] MPI startup(): 24 289132 isix04.benchmarkcenter.megware.com {43-44,299-300}
[0] MPI startup(): 25 289163 isix04.benchmarkcenter.megware.com {45-46,301-302}
[0] MPI startup(): 26 289078 isix04.benchmarkcenter.megware.com {47-48,303-304}
[0] MPI startup(): 27 289156 isix04.benchmarkcenter.megware.com {49-50,305-306}
[0] MPI startup(): 28 289146 isix04.benchmarkcenter.megware.com {51-52,307-308}
[0] MPI startup(): 29 289153 isix04.benchmarkcenter.megware.com {53-54,309-310}
[0] MPI startup(): 30 289101 isix04.benchmarkcenter.megware.com {55-56,311-312}
[0] MPI startup(): 31 289076 isix04.benchmarkcenter.megware.com {57-58,313-314}
[0] MPI startup(): 32 289090 isix04.benchmarkcenter.megware.com {59-60,315-316}
[0] MPI startup(): 33 289039 isix04.benchmarkcenter.megware.com {61-62,317-318}
[0] MPI startup(): 34 289143 isix04.benchmarkcenter.megware.com {63-64,319-320}
[0] MPI startup(): 35 289091 isix04.benchmarkcenter.megware.com {65-66,321-322}
[0] MPI startup(): 36 289157 isix04.benchmarkcenter.megware.com {67-68,323-324}
[0] MPI startup(): 37 289151 isix04.benchmarkcenter.megware.com {69-70,325-326}
[0] MPI startup(): 38 289145 isix04.benchmarkcenter.megware.com {71-72,327-328}
[0] MPI startup(): 39 289144 isix04.benchmarkcenter.megware.com {73-74,329-330}
[0] MPI startup(): 40 289092 isix04.benchmarkcenter.megware.com {75-76,331-332}
[0] MPI startup(): 41 289168 isix04.benchmarkcenter.megware.com {77-78,333-334}
[0] MPI startup(): 42 289147 isix04.benchmarkcenter.megware.com {79-80,335-336}
[0] MPI startup(): 43 289049 isix04.benchmarkcenter.megware.com {81,337}
[0] MPI startup(): 44 289179 isix04.benchmarkcenter.megware.com {82,338}
[0] MPI startup(): 45 289064 isix04.benchmarkcenter.megware.com {83,339}
[0] MPI startup(): 46 289152 isix04.benchmarkcenter.megware.com {84,340}
[0] MPI startup(): 47 289055 isix04.benchmarkcenter.megware.com {85,341}
[0] MPI startup(): 48 289095 isix04.benchmarkcenter.megware.com {86-87,342-343}
[0] MPI startup(): 49 289085 isix04.benchmarkcenter.megware.com {88-89,344-345}
[0] MPI startup(): 50 289061 isix04.benchmarkcenter.megware.com {90-91,346-347}
[0] MPI startup(): 51 289148 isix04.benchmarkcenter.megware.com {92-93,348-349}
[0] MPI startup(): 52 289099 isix04.benchmarkcenter.megware.com {94-95,350-351}
[0] MPI startup(): 53 289102 isix04.benchmarkcenter.megware.com {96-97,352-353}
[0] MPI startup(): 54 289167 isix04.benchmarkcenter.megware.com {98-99,354-355}
[0] MPI startup(): 55 289138 isix04.benchmarkcenter.megware.com {100-101,356-357}
[0] MPI startup(): 56 289057 isix04.benchmarkcenter.megware.com {102-103,358-359}
[0] MPI startup(): 57 289150 isix04.benchmarkcenter.megware.com {104-105,360-361}
[0] MPI startup(): 58 289077 isix04.benchmarkcenter.megware.com {106-107,362-363}
[0] MPI startup(): 59 289139 isix04.benchmarkcenter.megware.com {108-109,364-365}
[0] MPI startup(): 60 289133 isix04.benchmarkcenter.megware.com {110-111,366-367}
[0] MPI startup(): 61 289180 isix04.benchmarkcenter.megware.com {112-113,368-369}
[0] MPI startup(): 62 289087 isix04.benchmarkcenter.megware.com {114-115,370-371}
[0] MPI startup(): 63 289113 isix04.benchmarkcenter.megware.com {116-117,372-373}
[0] MPI startup(): 64 289094 isix04.benchmarkcenter.megware.com {118-119,374-375}
[0] MPI startup(): 65 289141 isix04.benchmarkcenter.megware.com {120-121,376-377}
[0] MPI startup(): 66 289149 isix04.benchmarkcenter.megware.com {122,378}
[0] MPI startup(): 67 289097 isix04.benchmarkcenter.megware.com {123,379}
[0] MPI startup(): 68 289052 isix04.benchmarkcenter.megware.com {124,380}
[0] MPI startup(): 69 289042 isix04.benchmarkcenter.megware.com {125,381}
[0] MPI startup(): 70 289160 isix04.benchmarkcenter.megware.com {126,382}
[0] MPI startup(): 71 289154 isix04.benchmarkcenter.megware.com {127,383}
[0] MPI startup(): 72 289071 isix04.benchmarkcenter.megware.com {128-129,384-385}
[0] MPI startup(): 73 289056 isix04.benchmarkcenter.megware.com {130-131,386-387}
[0] MPI startup(): 74 289083 isix04.benchmarkcenter.megware.com {132-133,388-389}
[0] MPI startup(): 75 289036 isix04.benchmarkcenter.megware.com {134-135,390-391}
[0] MPI startup(): 76 289037 isix04.benchmarkcenter.megware.com {136-137,392-393}
[0] MPI startup(): 77 289070 isix04.benchmarkcenter.megware.com {138-139,394-395}
[0] MPI startup(): 78 289169 isix04.benchmarkcenter.megware.com {140-141,396-397}
[0] MPI startup(): 79 289100 isix04.benchmarkcenter.megware.com {142-143,398-399}
[0] MPI startup(): 80 289105 isix04.benchmarkcenter.megware.com {144-145,400-401}
[0] MPI startup(): 81 289174 isix04.benchmarkcenter.megware.com {146-147,402-403}
[0] MPI startup(): 82 289166 isix04.benchmarkcenter.megware.com {148-149,404-405}
[0] MPI startup(): 83 289134 isix04.benchmarkcenter.megware.com {150-151,406-407}
[0] MPI startup(): 84 289067 isix04.benchmarkcenter.megware.com {152-153,408-409}
[0] MPI startup(): 85 289079 isix04.benchmarkcenter.megware.com {154-155,410-411}
[0] MPI startup(): 86 289170 isix04.benchmarkcenter.megware.com {156-157,412-413}
[0] MPI startup(): 87 289104 isix04.benchmarkcenter.megware.com {158-159,414-415}
[0] MPI startup(): 88 289041 isix04.benchmarkcenter.megware.com {160-161,416-417}
[0] MPI startup(): 89 289155 isix04.benchmarkcenter.megware.com {162-163,418-419}
[0] MPI startup(): 90 289074 isix04.benchmarkcenter.megware.com {164-165,420-421}
[0] MPI startup(): 91 289044 isix04.benchmarkcenter.megware.com {166,422}
[0] MPI startup(): 92 289051 isix04.benchmarkcenter.megware.com {167,423}
[0] MPI startup(): 93 289175 isix04.benchmarkcenter.megware.com {168,424}
[0] MPI startup(): 94 289108 isix04.benchmarkcenter.megware.com {169,425}
[0] MPI startup(): 95 289173 isix04.benchmarkcenter.megware.com {170,426}
[0] MPI startup(): 96 289117 isix04.benchmarkcenter.megware.com {171-172,427-428}
[0] MPI startup(): 97 289069 isix04.benchmarkcenter.megware.com {173-174,429-430}
[0] MPI startup(): 98 289119 isix04.benchmarkcenter.megware.com {175-176,431-432}
[0] MPI startup(): 99 289140 isix04.benchmarkcenter.megware.com {177-178,433-434}
[0] MPI startup(): 100 289142 isix04.benchmarkcenter.megware.com {179-180,435-436}
[0] MPI startup(): 101 289068 isix04.benchmarkcenter.megware.com {181-182,437-438}
[0] MPI startup(): 102 289129 isix04.benchmarkcenter.megware.com {183-184,439-440}
[0] MPI startup(): 103 289059 isix04.benchmarkcenter.megware.com {185-186,441-442}
[0] MPI startup(): 104 289165 isix04.benchmarkcenter.megware.com {187-188,443-444}
[0] MPI startup(): 105 289088 isix04.benchmarkcenter.megware.com {189-190,445-446}
[0] MPI startup(): 106 289040 isix04.benchmarkcenter.megware.com {191-192,447-448}
[0] MPI startup(): 107 289111 isix04.benchmarkcenter.megware.com {193-194,449-450}
[0] MPI startup(): 108 289136 isix04.benchmarkcenter.megware.com {195-196,451-452}
[0] MPI startup(): 109 289106 isix04.benchmarkcenter.megware.com {197-198,453-454}
[0] MPI startup(): 110 289048 isix04.benchmarkcenter.megware.com {199-200,455-456}
[0] MPI startup(): 111 289177 isix04.benchmarkcenter.megware.com {201-202,457-458}
[0] MPI startup(): 112 289164 isix04.benchmarkcenter.megware.com {203-204,459-460}
[0] MPI startup(): 113 289122 isix04.benchmarkcenter.megware.com {205-206,461-462}
[0] MPI startup(): 114 289066 isix04.benchmarkcenter.megware.com {207-208,463-464}
[0] MPI startup(): 115 289112 isix04.benchmarkcenter.megware.com {209,465}
[0] MPI startup(): 116 289137 isix04.benchmarkcenter.megware.com {210,466}
[0] MPI startup(): 117 289125 isix04.benchmarkcenter.megware.com {211,467}
[0] MPI startup(): 118 289050 isix04.benchmarkcenter.megware.com {212,468}
[0] MPI startup(): 119 289107 isix04.benchmarkcenter.megware.com {213,469}
[0] MPI startup(): 120 289038 isix04.benchmarkcenter.megware.com {214-215,470-471}
[0] MPI startup(): 121 289126 isix04.benchmarkcenter.megware.com {216-217,472-473}
[0] MPI startup(): 122 289181 isix04.benchmarkcenter.megware.com {218-219,474-475}
[0] MPI startup(): 123 289128 isix04.benchmarkcenter.megware.com {220-221,476-477}
[0] MPI startup(): 124 289080 isix04.benchmarkcenter.megware.com {222-223,478-479}
[0] MPI startup(): 125 289082 isix04.benchmarkcenter.megware.com {224-225,480-481}
[0] MPI startup(): 126 289130 isix04.benchmarkcenter.megware.com {226-227,482-483}
[0] MPI startup(): 127 289058 isix04.benchmarkcenter.megware.com {228-229,484-485}
[0] MPI startup(): 128 289109 isix04.benchmarkcenter.megware.com {230-231,486-487}
[0] MPI startup(): 129 289178 isix04.benchmarkcenter.megware.com {232-233,488-489}
[0] MPI startup(): 130 289089 isix04.benchmarkcenter.megware.com {234-235,490-491}
[0] MPI startup(): 131 289054 isix04.benchmarkcenter.megware.com {236-237,492-493}
[0] MPI startup(): 132 289046 isix04.benchmarkcenter.megware.com {238-239,494-495}
[0] MPI startup(): 133 289045 isix04.benchmarkcenter.megware.com {240-241,496-497}
[0] MPI startup(): 134 289171 isix04.benchmarkcenter.megware.com {242-243,498-499}
[0] MPI startup(): 135 289120 isix04.benchmarkcenter.megware.com {244-245,500-501}
[0] MPI startup(): 136 289110 isix04.benchmarkcenter.megware.com {246-247,502-503}
[0] MPI startup(): 137 289127 isix04.benchmarkcenter.megware.com {248-249,504-505}
[0] MPI startup(): 138 289131 isix04.benchmarkcenter.megware.com {250,506}
[0] MPI startup(): 139 289081 isix04.benchmarkcenter.megware.com {251,507}
[0] MPI startup(): 140 289103 isix04.benchmarkcenter.megware.com {252,508}
[0] MPI startup(): 141 289161 isix04.benchmarkcenter.megware.com {253,509}
[0] MPI startup(): 142 289172 isix04.benchmarkcenter.megware.com {254,510}
[0] MPI startup(): 143 289135 isix04.benchmarkcenter.megware.com {255,511}
OMP: pid 289123 tid 289123 thread 0 bound to OS proc set {38}
OMP: pid 289073 tid 289073 thread 0 bound to OS proc set {12}
OMP: pid 289159 tid 289159 thread 0 bound to OS proc set {10}
OMP: pid 289125 tid 289125 thread 0 bound to OS proc set {211}
OMP: pid 289072 tid 289072 thread 0 bound to OS proc set {6}
OMP: pid 289176 tid 289176 thread 0 bound to OS proc set {39}
OMP: pid 289118 tid 289118 thread 0 bound to OS proc set {41}
OMP: pid 289062 tid 289062 thread 0 bound to OS proc set {42}
OMP: pid 289132 tid 289132 thread 0 bound to OS proc set {43}
OMP: pid 289163 tid 289163 thread 0 bound to OS proc set {45}
OMP: pid 289116 tid 289116 thread 0 bound to OS proc set {40}
OMP: pid 289042 tid 289042 thread 0 bound to OS proc set {125}
OMP: pid 289063 tid 289063 thread 0 bound to OS proc set {26}
OMP: pid 289147 tid 289147 thread 0 bound to OS proc set {79}
OMP: pid 289101 tid 289101 thread 0 bound to OS proc set {55}
OMP: pid 289124 tid 289124 thread 0 bound to OS proc set {24}
OMP: pid 289078 tid 289078 thread 0 bound to OS proc set {47}
OMP: pid 289064 tid 289064 thread 0 bound to OS proc set {83}
OMP: pid 289114 tid 289114 thread 0 bound to OS proc set {34}
OMP: pid 289149 tid 289149 thread 0 bound to OS proc set {122}
OMP: pid 289100 tid 289100 thread 0 bound to OS proc set {142}
OMP: pid 289153 tid 289153 thread 0 bound to OS proc set {53}
OMP: pid 289117 tid 289117 thread 0 bound to OS proc set {171}
OMP: pid 289053 tid 289053 thread 0 bound to OS proc set {32}
OMP: pid 289179 tid 289179 thread 0 bound to OS proc set {82}
OMP: pid 289039 tid 289039 thread 0 bound to OS proc set {61}
OMP: pid 289146 tid 289146 thread 0 bound to OS proc set {51}
OMP: pid 289167 tid 289167 thread 0 bound to OS proc set {98}
OMP: pid 289043 tid 289043 thread 0 bound to OS proc set {28}
OMP: pid 289070 tid 289070 thread 0 bound to OS proc set {138}
OMP: pid 289095 tid 289095 thread 0 bound to OS proc set {86}
OMP: pid 289093 tid 289093 thread 0 bound to OS proc set {14}
OMP: pid 289060 tid 289060 thread 0 bound to OS proc set {18}
OMP: pid 289087 tid 289087 thread 0 bound to OS proc set {114}
OMP: pid 289076 tid 289076 thread 0 bound to OS proc set {57}
OMP: pid 289144 tid 289144 thread 0 bound to OS proc set {73}
OMP: pid 289080 tid 289080 thread 0 bound to OS proc set {222}
OMP: pid 289102 tid 289102 thread 0 bound to OS proc set {96}
OMP: pid 289138 tid 289138 thread 0 bound to OS proc set {100}
OMP: pid 289054 tid 289054 thread 0 bound to OS proc set {236}
OMP: pid 289158 tid 289158 thread 0 bound to OS proc set {4}
OMP: pid 289145 tid 289145 thread 0 bound to OS proc set {71}
OMP: pid 289075 tid 289075 thread 0 bound to OS proc set {30}
OMP: pid 289174 tid 289174 thread 0 bound to OS proc set {146}
OMP: pid 289047 tid 289047 thread 0 bound to OS proc set {0}
OMP: pid 289150 tid 289150 thread 0 bound to OS proc set {104}
OMP: pid 289090 tid 289090 thread 0 bound to OS proc set {59}
OMP: pid 289180 tid 289180 thread 0 bound to OS proc set {112}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 289156 tid 289156 thread 0 bound to OS proc set {49}
OMP: pid 289092 tid 289092 thread 0 bound to OS proc set {75}
OMP: pid 289165 tid 289165 thread 0 bound to OS proc set {187}
OMP: pid 289170 tid 289170 thread 0 bound to OS proc set {156}
OMP: pid 289094 tid 289094 thread 0 bound to OS proc set {118}
OMP: pid 289055 tid 289055 thread 0 bound to OS proc set {85}
OMP: pid 289131 tid 289131 thread 0 bound to OS proc set {250}
OMP: pid 289172 tid 289172 thread 0 bound to OS proc set {254}
OMP: pid 289036 tid 289036 thread 0 bound to OS proc set {134}
OMP: pid 289130 tid 289130 thread 0 bound to OS proc set {226}
OMP: pid 289111 tid 289111 thread 0 bound to OS proc set {193}
OMP: pid 289152 tid 289152 thread 0 bound to OS proc set {84}
OMP: pid 289160 tid 289160 thread 0 bound to OS proc set {126}
OMP: pid 289169 tid 289169 thread 0 bound to OS proc set {140}
OMP: pid 289067 tid 289067 thread 0 bound to OS proc set {152}
OMP: pid 289168 tid 289168 thread 0 bound to OS proc set {77}
OMP: pid 289099 tid 289099 thread 0 bound to OS proc set {94}
OMP: pid 289113 tid 289113 thread 0 bound to OS proc set {116}
OMP: pid 289171 tid 289171 thread 0 bound to OS proc set {242}
OMP: pid 289035 tid 289035 thread 0 bound to OS proc set {20}
OMP: pid 289079 tid 289079 thread 0 bound to OS proc set {154}
OMP: pid 289050 tid 289050 thread 0 bound to OS proc set {212}
OMP: pid 289133 tid 289133 thread 0 bound to OS proc set {110}
OMP: pid 289121 tid 289121 thread 0 bound to OS proc set {36}
OMP: pid 289098 tid 289098 thread 0 bound to OS proc set {22}
OMP: pid 289085 tid 289085 thread 0 bound to OS proc set {88}
OMP: pid 289048 tid 289048 thread 0 bound to OS proc set {199}
OMP: pid 289157 tid 289157 thread 0 bound to OS proc set {67}
OMP: pid 289084 tid 289084 thread 0 bound to OS proc set {8}
OMP: pid 289143 tid 289143 thread 0 bound to OS proc set {63}
OMP: pid 289178 tid 289178 thread 0 bound to OS proc set {232}
OMP: pid 289096 tid 289096 thread 0 bound to OS proc set {2}
OMP: pid 289181 tid 289181 thread 0 bound to OS proc set {218}
OMP: pid 289038 tid 289038 thread 0 bound to OS proc set {214}
OMP: pid 289057 tid 289057 thread 0 bound to OS proc set {102}
OMP: pid 289104 tid 289104 thread 0 bound to OS proc set {158}
OMP: pid 289074 tid 289074 thread 0 bound to OS proc set {164}
OMP: pid 289061 tid 289061 thread 0 bound to OS proc set {90}
OMP: pid 289154 tid 289154 thread 0 bound to OS proc set {127}
OMP: pid 289037 tid 289037 thread 0 bound to OS proc set {136}
OMP: pid 289056 tid 289056 thread 0 bound to OS proc set {130}
OMP: pid 289069 tid 289069 thread 0 bound to OS proc set {173}
OMP: pid 289068 tid 289068 thread 0 bound to OS proc set {181}
OMP: pid 289083 tid 289083 thread 0 bound to OS proc set {132}
OMP: pid 289142 tid 289142 thread 0 bound to OS proc set {179}
OMP: pid 289166 tid 289166 thread 0 bound to OS proc set {148}
OMP: pid 289135 tid 289135 thread 0 bound to OS proc set {255}
OMP: pid 289097 tid 289097 thread 0 bound to OS proc set {123}
OMP: pid 289126 tid 289126 thread 0 bound to OS proc set {216}
OMP: pid 289046 tid 289046 thread 0 bound to OS proc set {238}
OMP: pid 289065 tid 289065 thread 0 bound to OS proc set {16}
OMP: pid 289045 tid 289045 thread 0 bound to OS proc set {240}
OMP: pid 289059 tid 289059 thread 0 bound to OS proc set {185}
OMP: pid 289151 tid 289151 thread 0 bound to OS proc set {69}
OMP: pid 289164 tid 289164 thread 0 bound to OS proc set {203}
OMP: pid 289077 tid 289077 thread 0 bound to OS proc set {106}
OMP: pid 289129 tid 289129 thread 0 bound to OS proc set {183}
OMP: pid 289122 tid 289122 thread 0 bound to OS proc set {205}
OMP: pid 289155 tid 289155 thread 0 bound to OS proc set {162}
OMP: pid 289041 tid 289041 thread 0 bound to OS proc set {160}
OMP: pid 289141 tid 289141 thread 0 bound to OS proc set {120}
OMP: pid 289091 tid 289091 thread 0 bound to OS proc set {65}
OMP: pid 289177 tid 289177 thread 0 bound to OS proc set {201}
OMP: pid 289137 tid 289137 thread 0 bound to OS proc set {210}
OMP: pid 289120 tid 289120 thread 0 bound to OS proc set {244}
OMP: pid 289081 tid 289081 thread 0 bound to OS proc set {251}
OMP: pid 289108 tid 289108 thread 0 bound to OS proc set {169}
OMP: pid 289105 tid 289105 thread 0 bound to OS proc set {144}
OMP: pid 289049 tid 289049 thread 0 bound to OS proc set {81}
OMP: pid 289119 tid 289119 thread 0 bound to OS proc set {175}
OMP: pid 289139 tid 289139 thread 0 bound to OS proc set {108}
OMP: pid 289161 tid 289161 thread 0 bound to OS proc set {253}
OMP: pid 289107 tid 289107 thread 0 bound to OS proc set {213}
OMP: pid 289071 tid 289071 thread 0 bound to OS proc set {128}
OMP: pid 289140 tid 289140 thread 0 bound to OS proc set {177}
OMP: pid 289040 tid 289040 thread 0 bound to OS proc set {191}
OMP: pid 289148 tid 289148 thread 0 bound to OS proc set {92}
OMP: pid 289136 tid 289136 thread 0 bound to OS proc set {195}
OMP: pid 289052 tid 289052 thread 0 bound to OS proc set {124}
OMP: pid 289109 tid 289109 thread 0 bound to OS proc set {230}
OMP: pid 289044 tid 289044 thread 0 bound to OS proc set {166}
OMP: pid 289066 tid 289066 thread 0 bound to OS proc set {207}
OMP: pid 289110 tid 289110 thread 0 bound to OS proc set {246}
OMP: pid 289103 tid 289103 thread 0 bound to OS proc set {252}
OMP: pid 289082 tid 289082 thread 0 bound to OS proc set {224}
OMP: pid 289088 tid 289088 thread 0 bound to OS proc set {189}
OMP: pid 289112 tid 289112 thread 0 bound to OS proc set {209}
OMP: pid 289089 tid 289089 thread 0 bound to OS proc set {234}
OMP: pid 289051 tid 289051 thread 0 bound to OS proc set {167}
OMP: pid 289175 tid 289175 thread 0 bound to OS proc set {168}
OMP: pid 289173 tid 289173 thread 0 bound to OS proc set {170}
OMP: pid 289128 tid 289128 thread 0 bound to OS proc set {220}
OMP: pid 289058 tid 289058 thread 0 bound to OS proc set {228}
OMP: pid 289106 tid 289106 thread 0 bound to OS proc set {197}
OMP: pid 289134 tid 289134 thread 0 bound to OS proc set {150}
OMP: pid 289127 tid 289127 thread 0 bound to OS proc set {248}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
9 by 4 by 4 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.022 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1932 | 1985 | 2058 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.827739 on 144 procs for 10 steps with 32768000 atoms
Performance: 5.219 ns/day, 4.599 hours/ns, 12.081 timesteps/s, 395.874 Matom-step/s
99.0% CPU use with 144 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.58819 | 0.604 | 0.62264 | 1.2 | 72.97
Neigh | 0.038541 | 0.040144 | 0.04282 | 0.3 | 4.85
Comm | 0.069403 | 0.08449 | 0.10539 | 2.8 | 10.21
Output | 0.0014236 | 0.0024249 | 0.0044943 | 1.7 | 0.29
Modify | 0.067161 | 0.076702 | 0.082623 | 1.2 | 9.27
Other | | 0.01998 | | | 2.41
Nlocal: 227556 ave 228724 max 227100 min
Histogram: 75 18 19 0 0 0 0 0 17 15
Nghost: 66464.4 ave 67856 max 64124 min
Histogram: 16 0 0 32 0 0 32 14 18 32
Neighs: 8.56559e+06 ave 8.61518e+06 max 8.54075e+06 min
Histogram: 34 22 39 14 3 0 2 11 7 12
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1932 | 1985 | 2058 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74786 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.934
500 797.7245 -1.1257864e+08 0 -1.091998e+08 51543.023
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.153
Loop time of 43.6584 on 144 procs for 500 steps with 32768000 atoms
Performance: 4.947 ns/day, 4.851 hours/ns, 11.453 timesteps/s, 375.277 Matom-step/s
99.2% CPU use with 144 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 30.159 | 30.524 | 30.783 | 2.4 | 69.92
Neigh | 3.4089 | 3.4434 | 3.638 | 1.7 | 7.89
Comm | 4.3879 | 4.7413 | 5.2832 | 9.6 | 10.86
Output | 0.016418 | 0.025166 | 0.038392 | 3.7 | 0.06
Modify | 3.2864 | 4.0119 | 4.2906 | 12.0 | 9.19
Other | | 0.9128 | | | 2.09
Nlocal: 227556 ave 228840 max 226684 min
Histogram: 8 17 45 28 11 3 3 3 16 10
Nghost: 66460.4 ave 68041 max 63930 min
Histogram: 6 7 11 17 6 4 25 24 23 21
Neighs: 8.58956e+06 ave 8.64856e+06 max 8.55392e+06 min
Histogram: 8 30 33 29 7 8 5 10 8 6
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747092
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:45
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_4 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 168 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 292870 isix04.benchmarkcenter.megware.com {0-1,256-257}
[0] MPI startup(): 1 292889 isix04.benchmarkcenter.megware.com {2-3,258-259}
[0] MPI startup(): 2 292890 isix04.benchmarkcenter.megware.com {4-5,260-261}
[0] MPI startup(): 3 292893 isix04.benchmarkcenter.megware.com {6-7,262-263}
[0] MPI startup(): 4 292945 isix04.benchmarkcenter.megware.com {8-9,264-265}
[0] MPI startup(): 5 292999 isix04.benchmarkcenter.megware.com {10-11,266-267}
[0] MPI startup(): 6 292902 isix04.benchmarkcenter.megware.com {12-13,268-269}
[0] MPI startup(): 7 292897 isix04.benchmarkcenter.megware.com {14-15,270-271}
[0] MPI startup(): 8 292950 isix04.benchmarkcenter.megware.com {16-17,272-273}
[0] MPI startup(): 9 292881 isix04.benchmarkcenter.megware.com {18-19,274-275}
[0] MPI startup(): 10 292842 isix04.benchmarkcenter.megware.com {20-21,276-277}
[0] MPI startup(): 11 292852 isix04.benchmarkcenter.megware.com {22-23,278-279}
[0] MPI startup(): 12 292892 isix04.benchmarkcenter.megware.com {24-25,280-281}
[0] MPI startup(): 13 292885 isix04.benchmarkcenter.megware.com {26-27,282-283}
[0] MPI startup(): 14 292862 isix04.benchmarkcenter.megware.com {28-29,284-285}
[0] MPI startup(): 15 292884 isix04.benchmarkcenter.megware.com {30,286}
[0] MPI startup(): 16 292863 isix04.benchmarkcenter.megware.com {31,287}
[0] MPI startup(): 17 292882 isix04.benchmarkcenter.megware.com {32,288}
[0] MPI startup(): 18 292872 isix04.benchmarkcenter.megware.com {33,289}
[0] MPI startup(): 19 292908 isix04.benchmarkcenter.megware.com {34,290}
[0] MPI startup(): 20 292914 isix04.benchmarkcenter.megware.com {35,291}
[0] MPI startup(): 21 292883 isix04.benchmarkcenter.megware.com {36,292}
[0] MPI startup(): 22 292898 isix04.benchmarkcenter.megware.com {37,293}
[0] MPI startup(): 23 292886 isix04.benchmarkcenter.megware.com {38,294}
[0] MPI startup(): 24 292880 isix04.benchmarkcenter.megware.com {39,295}
[0] MPI startup(): 25 292926 isix04.benchmarkcenter.megware.com {40,296}
[0] MPI startup(): 26 292992 isix04.benchmarkcenter.megware.com {41,297}
[0] MPI startup(): 27 292980 isix04.benchmarkcenter.megware.com {42,298}
[0] MPI startup(): 28 292879 isix04.benchmarkcenter.megware.com {43-44,299-300}
[0] MPI startup(): 29 292877 isix04.benchmarkcenter.megware.com {45-46,301-302}
[0] MPI startup(): 30 292865 isix04.benchmarkcenter.megware.com {47-48,303-304}
[0] MPI startup(): 31 292840 isix04.benchmarkcenter.megware.com {49-50,305-306}
[0] MPI startup(): 32 292960 isix04.benchmarkcenter.megware.com {51-52,307-308}
[0] MPI startup(): 33 292853 isix04.benchmarkcenter.megware.com {53-54,309-310}
[0] MPI startup(): 34 292981 isix04.benchmarkcenter.megware.com {55-56,311-312}
[0] MPI startup(): 35 293010 isix04.benchmarkcenter.megware.com {57-58,313-314}
[0] MPI startup(): 36 292991 isix04.benchmarkcenter.megware.com {59-60,315-316}
[0] MPI startup(): 37 292997 isix04.benchmarkcenter.megware.com {61-62,317-318}
[0] MPI startup(): 38 292859 isix04.benchmarkcenter.megware.com {63-64,319-320}
[0] MPI startup(): 39 292910 isix04.benchmarkcenter.megware.com {65-66,321-322}
[0] MPI startup(): 40 292961 isix04.benchmarkcenter.megware.com {67-68,323-324}
[0] MPI startup(): 41 292922 isix04.benchmarkcenter.megware.com {69-70,325-326}
[0] MPI startup(): 42 293000 isix04.benchmarkcenter.megware.com {71-72,327-328}
[0] MPI startup(): 43 293003 isix04.benchmarkcenter.megware.com {73,329}
[0] MPI startup(): 44 292929 isix04.benchmarkcenter.megware.com {74,330}
[0] MPI startup(): 45 292855 isix04.benchmarkcenter.megware.com {75,331}
[0] MPI startup(): 46 292850 isix04.benchmarkcenter.megware.com {76,332}
[0] MPI startup(): 47 292869 isix04.benchmarkcenter.megware.com {77,333}
[0] MPI startup(): 48 292858 isix04.benchmarkcenter.megware.com {78,334}
[0] MPI startup(): 49 292847 isix04.benchmarkcenter.megware.com {79,335}
[0] MPI startup(): 50 292844 isix04.benchmarkcenter.megware.com {80,336}
[0] MPI startup(): 51 292927 isix04.benchmarkcenter.megware.com {81,337}
[0] MPI startup(): 52 292955 isix04.benchmarkcenter.megware.com {82,338}
[0] MPI startup(): 53 292993 isix04.benchmarkcenter.megware.com {83,339}
[0] MPI startup(): 54 292936 isix04.benchmarkcenter.megware.com {84,340}
[0] MPI startup(): 55 292984 isix04.benchmarkcenter.megware.com {85,341}
[0] MPI startup(): 56 292957 isix04.benchmarkcenter.megware.com {86-87,342-343}
[0] MPI startup(): 57 292876 isix04.benchmarkcenter.megware.com {88-89,344-345}
[0] MPI startup(): 58 292983 isix04.benchmarkcenter.megware.com {90-91,346-347}
[0] MPI startup(): 59 292964 isix04.benchmarkcenter.megware.com {92-93,348-349}
[0] MPI startup(): 60 292907 isix04.benchmarkcenter.megware.com {94-95,350-351}
[0] MPI startup(): 61 292967 isix04.benchmarkcenter.megware.com {96-97,352-353}
[0] MPI startup(): 62 292944 isix04.benchmarkcenter.megware.com {98-99,354-355}
[0] MPI startup(): 63 292918 isix04.benchmarkcenter.megware.com {100-101,356-357}
[0] MPI startup(): 64 292903 isix04.benchmarkcenter.megware.com {102-103,358-359}
[0] MPI startup(): 65 292965 isix04.benchmarkcenter.megware.com {104-105,360-361}
[0] MPI startup(): 66 293008 isix04.benchmarkcenter.megware.com {106-107,362-363}
[0] MPI startup(): 67 293009 isix04.benchmarkcenter.megware.com {108-109,364-365}
[0] MPI startup(): 68 292969 isix04.benchmarkcenter.megware.com {110-111,366-367}
[0] MPI startup(): 69 292972 isix04.benchmarkcenter.megware.com {112-113,368-369}
[0] MPI startup(): 70 292975 isix04.benchmarkcenter.megware.com {114,370}
[0] MPI startup(): 71 292949 isix04.benchmarkcenter.megware.com {115,371}
[0] MPI startup(): 72 292930 isix04.benchmarkcenter.megware.com {116,372}
[0] MPI startup(): 73 292901 isix04.benchmarkcenter.megware.com {117,373}
[0] MPI startup(): 74 292947 isix04.benchmarkcenter.megware.com {118,374}
[0] MPI startup(): 75 293007 isix04.benchmarkcenter.megware.com {119,375}
[0] MPI startup(): 76 292934 isix04.benchmarkcenter.megware.com {120,376}
[0] MPI startup(): 77 292928 isix04.benchmarkcenter.megware.com {121,377}
[0] MPI startup(): 78 292841 isix04.benchmarkcenter.megware.com {122,378}
[0] MPI startup(): 79 292856 isix04.benchmarkcenter.megware.com {123,379}
[0] MPI startup(): 80 292941 isix04.benchmarkcenter.megware.com {124,380}
[0] MPI startup(): 81 292996 isix04.benchmarkcenter.megware.com {125,381}
[0] MPI startup(): 82 292921 isix04.benchmarkcenter.megware.com {126,382}
[0] MPI startup(): 83 292904 isix04.benchmarkcenter.megware.com {127,383}
[0] MPI startup(): 84 292878 isix04.benchmarkcenter.megware.com {128-129,384-385}
[0] MPI startup(): 85 292871 isix04.benchmarkcenter.megware.com {130-131,386-387}
[0] MPI startup(): 86 292913 isix04.benchmarkcenter.megware.com {132-133,388-389}
[0] MPI startup(): 87 292985 isix04.benchmarkcenter.megware.com {134-135,390-391}
[0] MPI startup(): 88 292895 isix04.benchmarkcenter.megware.com {136-137,392-393}
[0] MPI startup(): 89 292916 isix04.benchmarkcenter.megware.com {138-139,394-395}
[0] MPI startup(): 90 292966 isix04.benchmarkcenter.megware.com {140-141,396-397}
[0] MPI startup(): 91 292912 isix04.benchmarkcenter.megware.com {142-143,398-399}
[0] MPI startup(): 92 292977 isix04.benchmarkcenter.megware.com {144-145,400-401}
[0] MPI startup(): 93 292973 isix04.benchmarkcenter.megware.com {146-147,402-403}
[0] MPI startup(): 94 293001 isix04.benchmarkcenter.megware.com {148-149,404-405}
[0] MPI startup(): 95 292848 isix04.benchmarkcenter.megware.com {150-151,406-407}
[0] MPI startup(): 96 292909 isix04.benchmarkcenter.megware.com {152-153,408-409}
[0] MPI startup(): 97 292938 isix04.benchmarkcenter.megware.com {154-155,410-411}
[0] MPI startup(): 98 292946 isix04.benchmarkcenter.megware.com {156-157,412-413}
[0] MPI startup(): 99 292988 isix04.benchmarkcenter.megware.com {158,414}
[0] MPI startup(): 100 292974 isix04.benchmarkcenter.megware.com {159,415}
[0] MPI startup(): 101 292854 isix04.benchmarkcenter.megware.com {160,416}
[0] MPI startup(): 102 292920 isix04.benchmarkcenter.megware.com {161,417}
[0] MPI startup(): 103 292998 isix04.benchmarkcenter.megware.com {162,418}
[0] MPI startup(): 104 292987 isix04.benchmarkcenter.megware.com {163,419}
[0] MPI startup(): 105 292959 isix04.benchmarkcenter.megware.com {164,420}
[0] MPI startup(): 106 292976 isix04.benchmarkcenter.megware.com {165,421}
[0] MPI startup(): 107 292866 isix04.benchmarkcenter.megware.com {166,422}
[0] MPI startup(): 108 292989 isix04.benchmarkcenter.megware.com {167,423}
[0] MPI startup(): 109 293002 isix04.benchmarkcenter.megware.com {168,424}
[0] MPI startup(): 110 292990 isix04.benchmarkcenter.megware.com {169,425}
[0] MPI startup(): 111 292952 isix04.benchmarkcenter.megware.com {170,426}
[0] MPI startup(): 112 292932 isix04.benchmarkcenter.megware.com {171-172,427-428}
[0] MPI startup(): 113 292953 isix04.benchmarkcenter.megware.com {173-174,429-430}
[0] MPI startup(): 114 293005 isix04.benchmarkcenter.megware.com {175-176,431-432}
[0] MPI startup(): 115 293006 isix04.benchmarkcenter.megware.com {177-178,433-434}
[0] MPI startup(): 116 292954 isix04.benchmarkcenter.megware.com {179-180,435-436}
[0] MPI startup(): 117 292867 isix04.benchmarkcenter.megware.com {181-182,437-438}
[0] MPI startup(): 118 292948 isix04.benchmarkcenter.megware.com {183-184,439-440}
[0] MPI startup(): 119 292915 isix04.benchmarkcenter.megware.com {185-186,441-442}
[0] MPI startup(): 120 292942 isix04.benchmarkcenter.megware.com {187-188,443-444}
[0] MPI startup(): 121 292958 isix04.benchmarkcenter.megware.com {189-190,445-446}
[0] MPI startup(): 122 292951 isix04.benchmarkcenter.megware.com {191-192,447-448}
[0] MPI startup(): 123 292864 isix04.benchmarkcenter.megware.com {193-194,449-450}
[0] MPI startup(): 124 292978 isix04.benchmarkcenter.megware.com {195-196,451-452}
[0] MPI startup(): 125 292887 isix04.benchmarkcenter.megware.com {197-198,453-454}
[0] MPI startup(): 126 292896 isix04.benchmarkcenter.megware.com {199-200,455-456}
[0] MPI startup(): 127 292849 isix04.benchmarkcenter.megware.com {201,457}
[0] MPI startup(): 128 292962 isix04.benchmarkcenter.megware.com {202,458}
[0] MPI startup(): 129 292891 isix04.benchmarkcenter.megware.com {203,459}
[0] MPI startup(): 130 292906 isix04.benchmarkcenter.megware.com {204,460}
[0] MPI startup(): 131 292925 isix04.benchmarkcenter.megware.com {205,461}
[0] MPI startup(): 132 292994 isix04.benchmarkcenter.megware.com {206,462}
[0] MPI startup(): 133 292851 isix04.benchmarkcenter.megware.com {207,463}
[0] MPI startup(): 134 292937 isix04.benchmarkcenter.megware.com {208,464}
[0] MPI startup(): 135 292860 isix04.benchmarkcenter.megware.com {209,465}
[0] MPI startup(): 136 292888 isix04.benchmarkcenter.megware.com {210,466}
[0] MPI startup(): 137 292924 isix04.benchmarkcenter.megware.com {211,467}
[0] MPI startup(): 138 293004 isix04.benchmarkcenter.megware.com {212,468}
[0] MPI startup(): 139 292846 isix04.benchmarkcenter.megware.com {213,469}
[0] MPI startup(): 140 292861 isix04.benchmarkcenter.megware.com {214-215,470-471}
[0] MPI startup(): 141 292995 isix04.benchmarkcenter.megware.com {216-217,472-473}
[0] MPI startup(): 142 292874 isix04.benchmarkcenter.megware.com {218-219,474-475}
[0] MPI startup(): 143 292873 isix04.benchmarkcenter.megware.com {220-221,476-477}
[0] MPI startup(): 144 292986 isix04.benchmarkcenter.megware.com {222-223,478-479}
[0] MPI startup(): 145 292982 isix04.benchmarkcenter.megware.com {224-225,480-481}
[0] MPI startup(): 146 292868 isix04.benchmarkcenter.megware.com {226-227,482-483}
[0] MPI startup(): 147 292979 isix04.benchmarkcenter.megware.com {228-229,484-485}
[0] MPI startup(): 148 292933 isix04.benchmarkcenter.megware.com {230-231,486-487}
[0] MPI startup(): 149 292917 isix04.benchmarkcenter.megware.com {232-233,488-489}
[0] MPI startup(): 150 292875 isix04.benchmarkcenter.megware.com {234-235,490-491}
[0] MPI startup(): 151 292923 isix04.benchmarkcenter.megware.com {236-237,492-493}
[0] MPI startup(): 152 292845 isix04.benchmarkcenter.megware.com {238-239,494-495}
[0] MPI startup(): 153 292943 isix04.benchmarkcenter.megware.com {240-241,496-497}
[0] MPI startup(): 154 292956 isix04.benchmarkcenter.megware.com {242,498}
[0] MPI startup(): 155 292935 isix04.benchmarkcenter.megware.com {243,499}
[0] MPI startup(): 156 292968 isix04.benchmarkcenter.megware.com {244,500}
[0] MPI startup(): 157 292939 isix04.benchmarkcenter.megware.com {245,501}
[0] MPI startup(): 158 292940 isix04.benchmarkcenter.megware.com {246,502}
[0] MPI startup(): 159 292970 isix04.benchmarkcenter.megware.com {247,503}
[0] MPI startup(): 160 292963 isix04.benchmarkcenter.megware.com {248,504}
[0] MPI startup(): 161 292919 isix04.benchmarkcenter.megware.com {249,505}
[0] MPI startup(): 162 292857 isix04.benchmarkcenter.megware.com {250,506}
[0] MPI startup(): 163 292843 isix04.benchmarkcenter.megware.com {251,507}
[0] MPI startup(): 164 292899 isix04.benchmarkcenter.megware.com {252,508}
[0] MPI startup(): 165 292971 isix04.benchmarkcenter.megware.com {253,509}
[0] MPI startup(): 166 292900 isix04.benchmarkcenter.megware.com {254,510}
[0] MPI startup(): 167 292911 isix04.benchmarkcenter.megware.com {255,511}
OMP: pid 292889 tid 292889 thread 0 bound to OS proc set {2}
OMP: pid 292914 tid 292914 thread 0 bound to OS proc set {35}
OMP: pid 292950 tid 292950 thread 0 bound to OS proc set {16}
OMP: pid 292870 tid 292870 thread 0 bound to OS proc set {0}
OMP: pid 292999 tid 292999 thread 0 bound to OS proc set {10}
OMP: pid 292897 tid 292897 thread 0 bound to OS proc set {14}
OMP: pid 292852 tid 292852 thread 0 bound to OS proc set {22}
OMP: pid 292881 tid 292881 thread 0 bound to OS proc set {18}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 292862 tid 292862 thread 0 bound to OS proc set {28}
OMP: pid 292885 tid 292885 thread 0 bound to OS proc set {26}
OMP: pid 292908 tid 292908 thread 0 bound to OS proc set {34}
OMP: pid 292945 tid 292945 thread 0 bound to OS proc set {8}
OMP: pid 292863 tid 292863 thread 0 bound to OS proc set {31}
OMP: pid 292893 tid 292893 thread 0 bound to OS proc set {6}
OMP: pid 292886 tid 292886 thread 0 bound to OS proc set {38}
OMP: pid 292865 tid 292865 thread 0 bound to OS proc set {47}
OMP: pid 292902 tid 292902 thread 0 bound to OS proc set {12}
OMP: pid 292982 tid 292982 thread 0 bound to OS proc set {224}
OMP: pid 292882 tid 292882 thread 0 bound to OS proc set {32}
OMP: pid 292992 tid 292992 thread 0 bound to OS proc set {41}
OMP: pid 292980 tid 292980 thread 0 bound to OS proc set {42}
OMP: pid 292898 tid 292898 thread 0 bound to OS proc set {37}
OMP: pid 292872 tid 292872 thread 0 bound to OS proc set {33}
OMP: pid 292877 tid 292877 thread 0 bound to OS proc set {45}
OMP: pid 292842 tid 292842 thread 0 bound to OS proc set {20}
OMP: pid 292847 tid 292847 thread 0 bound to OS proc set {79}
OMP: pid 292853 tid 292853 thread 0 bound to OS proc set {53}
OMP: pid 292910 tid 292910 thread 0 bound to OS proc set {65}
OMP: pid 292977 tid 292977 thread 0 bound to OS proc set {144}
OMP: pid 292880 tid 292880 thread 0 bound to OS proc set {39}
OMP: pid 292918 tid 292918 thread 0 bound to OS proc set {100}
OMP: pid 293010 tid 293010 thread 0 bound to OS proc set {57}
OMP: pid 292913 tid 292913 thread 0 bound to OS proc set {132}
OMP: pid 292993 tid 292993 thread 0 bound to OS proc set {83}
OMP: pid 292883 tid 292883 thread 0 bound to OS proc set {36}
OMP: pid 292960 tid 292960 thread 0 bound to OS proc set {51}
OMP: pid 292892 tid 292892 thread 0 bound to OS proc set {24}
OMP: pid 292922 tid 292922 thread 0 bound to OS proc set {69}
OMP: pid 292884 tid 292884 thread 0 bound to OS proc set {30}
OMP: pid 292907 tid 292907 thread 0 bound to OS proc set {94}
OMP: pid 292840 tid 292840 thread 0 bound to OS proc set {49}
OMP: pid 292912 tid 292912 thread 0 bound to OS proc set {142}
OMP: pid 292959 tid 292959 thread 0 bound to OS proc set {164}
OMP: pid 292850 tid 292850 thread 0 bound to OS proc set {76}
OMP: pid 292961 tid 292961 thread 0 bound to OS proc set {67}
OMP: pid 292855 tid 292855 thread 0 bound to OS proc set {75}
OMP: pid 292984 tid 292984 thread 0 bound to OS proc set {85}
OMP: pid 292879 tid 292879 thread 0 bound to OS proc set {43}
OMP: pid 293000 tid 293000 thread 0 bound to OS proc set {71}
OMP: pid 292876 tid 292876 thread 0 bound to OS proc set {88}
OMP: pid 292957 tid 292957 thread 0 bound to OS proc set {86}
OMP: pid 292955 tid 292955 thread 0 bound to OS proc set {82}
OMP: pid 292987 tid 292987 thread 0 bound to OS proc set {163}
OMP: pid 292965 tid 292965 thread 0 bound to OS proc set {104}
OMP: pid 292964 tid 292964 thread 0 bound to OS proc set {92}
OMP: pid 292997 tid 292997 thread 0 bound to OS proc set {61}
OMP: pid 292983 tid 292983 thread 0 bound to OS proc set {90}
OMP: pid 292901 tid 292901 thread 0 bound to OS proc set {117}
OMP: pid 292973 tid 292973 thread 0 bound to OS proc set {146}
OMP: pid 292896 tid 292896 thread 0 bound to OS proc set {199}
OMP: pid 292989 tid 292989 thread 0 bound to OS proc set {167}
OMP: pid 292991 tid 292991 thread 0 bound to OS proc set {59}
OMP: pid 292921 tid 292921 thread 0 bound to OS proc set {126}
OMP: pid 292856 tid 292856 thread 0 bound to OS proc set {123}
OMP: pid 292930 tid 292930 thread 0 bound to OS proc set {116}
OMP: pid 292859 tid 292859 thread 0 bound to OS proc set {63}
OMP: pid 292947 tid 292947 thread 0 bound to OS proc set {118}
OMP: pid 292857 tid 292857 thread 0 bound to OS proc set {250}
OMP: pid 292934 tid 292934 thread 0 bound to OS proc set {120}
OMP: pid 292873 tid 292873 thread 0 bound to OS proc set {220}
OMP: pid 292915 tid 292915 thread 0 bound to OS proc set {185}
OMP: pid 292926 tid 292926 thread 0 bound to OS proc set {40}
OMP: pid 292988 tid 292988 thread 0 bound to OS proc set {158}
OMP: pid 292927 tid 292927 thread 0 bound to OS proc set {81}
OMP: pid 292981 tid 292981 thread 0 bound to OS proc set {55}
OMP: pid 292890 tid 292890 thread 0 bound to OS proc set {4}
OMP: pid 292948 tid 292948 thread 0 bound to OS proc set {183}
OMP: pid 292967 tid 292967 thread 0 bound to OS proc set {96}
OMP: pid 292891 tid 292891 thread 0 bound to OS proc set {203}
OMP: pid 292858 tid 292858 thread 0 bound to OS proc set {78}
OMP: pid 292844 tid 292844 thread 0 bound to OS proc set {80}
OMP: pid 293004 tid 293004 thread 0 bound to OS proc set {212}
OMP: pid 292909 tid 292909 thread 0 bound to OS proc set {152}
OMP: pid 292985 tid 292985 thread 0 bound to OS proc set {134}
OMP: pid 292996 tid 292996 thread 0 bound to OS proc set {125}
OMP: pid 292868 tid 292868 thread 0 bound to OS proc set {226}
OMP: pid 292986 tid 292986 thread 0 bound to OS proc set {222}
OMP: pid 292966 tid 292966 thread 0 bound to OS proc set {140}
OMP: pid 292861 tid 292861 thread 0 bound to OS proc set {214}
OMP: pid 292946 tid 292946 thread 0 bound to OS proc set {156}
OMP: pid 292972 tid 292972 thread 0 bound to OS proc set {112}
OMP: pid 292843 tid 292843 thread 0 bound to OS proc set {251}
OMP: pid 292846 tid 292846 thread 0 bound to OS proc set {213}
OMP: pid 292929 tid 292929 thread 0 bound to OS proc set {74}
OMP: pid 293006 tid 293006 thread 0 bound to OS proc set {177}
OMP: pid 292928 tid 292928 thread 0 bound to OS proc set {121}
OMP: pid 293009 tid 293009 thread 0 bound to OS proc set {108}
OMP: pid 292864 tid 292864 thread 0 bound to OS proc set {193}
OMP: pid 292919 tid 292919 thread 0 bound to OS proc set {249}
OMP: pid 292932 tid 292932 thread 0 bound to OS proc set {171}
OMP: pid 292952 tid 292952 thread 0 bound to OS proc set {170}
OMP: pid 292903 tid 292903 thread 0 bound to OS proc set {102}
OMP: pid 292953 tid 292953 thread 0 bound to OS proc set {173}
OMP: pid 292841 tid 292841 thread 0 bound to OS proc set {122}
OMP: pid 292976 tid 292976 thread 0 bound to OS proc set {165}
OMP: pid 292845 tid 292845 thread 0 bound to OS proc set {238}
OMP: pid 292970 tid 292970 thread 0 bound to OS proc set {247}
OMP: pid 292925 tid 292925 thread 0 bound to OS proc set {205}
OMP: pid 292904 tid 292904 thread 0 bound to OS proc set {127}
OMP: pid 292998 tid 292998 thread 0 bound to OS proc set {162}
OMP: pid 292968 tid 292968 thread 0 bound to OS proc set {244}
OMP: pid 292940 tid 292940 thread 0 bound to OS proc set {246}
OMP: pid 292944 tid 292944 thread 0 bound to OS proc set {98}
OMP: pid 292869 tid 292869 thread 0 bound to OS proc set {77}
OMP: pid 292956 tid 292956 thread 0 bound to OS proc set {242}
OMP: pid 292888 tid 292888 thread 0 bound to OS proc set {210}
OMP: pid 292895 tid 292895 thread 0 bound to OS proc set {136}
OMP: pid 292906 tid 292906 thread 0 bound to OS proc set {204}
OMP: pid 292963 tid 292963 thread 0 bound to OS proc set {248}
OMP: pid 292874 tid 292874 thread 0 bound to OS proc set {218}
OMP: pid 292866 tid 292866 thread 0 bound to OS proc set {166}
OMP: pid 292978 tid 292978 thread 0 bound to OS proc set {195}
OMP: pid 292969 tid 292969 thread 0 bound to OS proc set {110}
OMP: pid 293007 tid 293007 thread 0 bound to OS proc set {119}
OMP: pid 292975 tid 292975 thread 0 bound to OS proc set {114}
OMP: pid 293001 tid 293001 thread 0 bound to OS proc set {148}
OMP: pid 292917 tid 292917 thread 0 bound to OS proc set {232}
OMP: pid 292949 tid 292949 thread 0 bound to OS proc set {115}
OMP: pid 292936 tid 292936 thread 0 bound to OS proc set {84}
OMP: pid 292851 tid 292851 thread 0 bound to OS proc set {207}
OMP: pid 292938 tid 292938 thread 0 bound to OS proc set {154}
OMP: pid 292924 tid 292924 thread 0 bound to OS proc set {211}
OMP: pid 292994 tid 292994 thread 0 bound to OS proc set {206}
OMP: pid 293003 tid 293003 thread 0 bound to OS proc set {73}
OMP: pid 292923 tid 292923 thread 0 bound to OS proc set {236}
OMP: pid 292943 tid 292943 thread 0 bound to OS proc set {240}
OMP: pid 292958 tid 292958 thread 0 bound to OS proc set {189}
OMP: pid 292860 tid 292860 thread 0 bound to OS proc set {209}
OMP: pid 293008 tid 293008 thread 0 bound to OS proc set {106}
OMP: pid 292990 tid 292990 thread 0 bound to OS proc set {169}
OMP: pid 292899 tid 292899 thread 0 bound to OS proc set {252}
OMP: pid 292951 tid 292951 thread 0 bound to OS proc set {191}
OMP: pid 292941 tid 292941 thread 0 bound to OS proc set {124}
OMP: pid 292974 tid 292974 thread 0 bound to OS proc set {159}
OMP: pid 292900 tid 292900 thread 0 bound to OS proc set {254}
OMP: pid 292878 tid 292878 thread 0 bound to OS proc set {128}
OMP: pid 292848 tid 292848 thread 0 bound to OS proc set {150}
OMP: pid 292995 tid 292995 thread 0 bound to OS proc set {216}
OMP: pid 292954 tid 292954 thread 0 bound to OS proc set {179}
OMP: pid 292871 tid 292871 thread 0 bound to OS proc set {130}
OMP: pid 292942 tid 292942 thread 0 bound to OS proc set {187}
OMP: pid 292920 tid 292920 thread 0 bound to OS proc set {161}
OMP: pid 293005 tid 293005 thread 0 bound to OS proc set {175}
OMP: pid 292867 tid 292867 thread 0 bound to OS proc set {181}
OMP: pid 292979 tid 292979 thread 0 bound to OS proc set {228}
OMP: pid 292849 tid 292849 thread 0 bound to OS proc set {201}
OMP: pid 292935 tid 292935 thread 0 bound to OS proc set {243}
OMP: pid 292854 tid 292854 thread 0 bound to OS proc set {160}
OMP: pid 293002 tid 293002 thread 0 bound to OS proc set {168}
OMP: pid 292933 tid 292933 thread 0 bound to OS proc set {230}
OMP: pid 292962 tid 292962 thread 0 bound to OS proc set {202}
OMP: pid 292939 tid 292939 thread 0 bound to OS proc set {245}
OMP: pid 292887 tid 292887 thread 0 bound to OS proc set {197}
OMP: pid 292937 tid 292937 thread 0 bound to OS proc set {208}
OMP: pid 292911 tid 292911 thread 0 bound to OS proc set {255}
OMP: pid 292916 tid 292916 thread 0 bound to OS proc set {138}
OMP: pid 292971 tid 292971 thread 0 bound to OS proc set {253}
OMP: pid 292875 tid 292875 thread 0 bound to OS proc set {234}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
7 by 4 by 6 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.020 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1663 | 1702 | 1754 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.752812 on 168 procs for 10 steps with 32768000 atoms
Performance: 5.738 ns/day, 4.182 hours/ns, 13.284 timesteps/s, 435.275 Matom-step/s
98.6% CPU use with 168 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.53591 | 0.54524 | 0.56581 | 0.6 | 72.43
Neigh | 0.035745 | 0.036923 | 0.039212 | 0.3 | 4.90
Comm | 0.063978 | 0.072576 | 0.087885 | 1.9 | 9.64
Output | 0.0013846 | 0.0026714 | 0.0038625 | 1.3 | 0.35
Modify | 0.067835 | 0.076828 | 0.081273 | 1.0 | 10.21
Other | | 0.01858 | | | 2.47
Nlocal: 195048 ave 196955 max 192857 min
Histogram: 24 0 16 0 48 16 0 32 0 32
Nghost: 60301 ave 61773 max 58825 min
Histogram: 32 12 4 22 11 15 0 40 12 20
Neighs: 7.34194e+06 ave 7.44753e+06 max 7.25865e+06 min
Histogram: 24 7 33 2 30 24 16 15 1 16
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1663 | 1702 | 1754 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74786 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.934
500 797.7245 -1.1257864e+08 0 -1.091998e+08 51543.024
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.153
Loop time of 40.0233 on 168 procs for 500 steps with 32768000 atoms
Performance: 5.397 ns/day, 4.447 hours/ns, 12.493 timesteps/s, 409.361 Matom-step/s
99.0% CPU use with 168 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 27.423 | 27.784 | 28.876 | 3.6 | 69.42
Neigh | 3.0872 | 3.1445 | 3.3176 | 1.9 | 7.86
Comm | 3.9595 | 4.4067 | 4.9913 | 10.3 | 11.01
Output | 0.015687 | 0.027747 | 0.036836 | 3.7 | 0.07
Modify | 3.2527 | 3.8083 | 4.0483 | 6.5 | 9.52
Other | | 0.8519 | | | 2.13
Nlocal: 195048 ave 197194 max 192437 min
Histogram: 9 14 4 14 24 39 14 19 10 21
Nghost: 60195.2 ave 62304 max 58584 min
Histogram: 19 24 7 25 19 16 31 22 3 2
Neighs: 7.36248e+06 ave 7.48119e+06 max 7.26242e+06 min
Histogram: 12 13 30 14 29 25 14 15 7 9
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747092
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:41
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_5 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 192 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 296922 isix04.benchmarkcenter.megware.com {0-1,256-257}
[0] MPI startup(): 1 296851 isix04.benchmarkcenter.megware.com {2-3,258-259}
[0] MPI startup(): 2 296991 isix04.benchmarkcenter.megware.com {4-5,260-261}
[0] MPI startup(): 3 296867 isix04.benchmarkcenter.megware.com {6-7,262-263}
[0] MPI startup(): 4 296974 isix04.benchmarkcenter.megware.com {8-9,264-265}
[0] MPI startup(): 5 296894 isix04.benchmarkcenter.megware.com {10-11,266-267}
[0] MPI startup(): 6 296887 isix04.benchmarkcenter.megware.com {12-13,268-269}
[0] MPI startup(): 7 297022 isix04.benchmarkcenter.megware.com {14-15,270-271}
[0] MPI startup(): 8 296905 isix04.benchmarkcenter.megware.com {16-17,272-273}
[0] MPI startup(): 9 296997 isix04.benchmarkcenter.megware.com {18-19,274-275}
[0] MPI startup(): 10 296992 isix04.benchmarkcenter.megware.com {20-21,276-277}
[0] MPI startup(): 11 297007 isix04.benchmarkcenter.megware.com {22,278}
[0] MPI startup(): 12 297002 isix04.benchmarkcenter.megware.com {23,279}
[0] MPI startup(): 13 296975 isix04.benchmarkcenter.megware.com {24,280}
[0] MPI startup(): 14 296977 isix04.benchmarkcenter.megware.com {25,281}
[0] MPI startup(): 15 296904 isix04.benchmarkcenter.megware.com {26,282}
[0] MPI startup(): 16 296895 isix04.benchmarkcenter.megware.com {27,283}
[0] MPI startup(): 17 296952 isix04.benchmarkcenter.megware.com {28,284}
[0] MPI startup(): 18 296889 isix04.benchmarkcenter.megware.com {29,285}
[0] MPI startup(): 19 296880 isix04.benchmarkcenter.megware.com {30,286}
[0] MPI startup(): 20 297042 isix04.benchmarkcenter.megware.com {31,287}
[0] MPI startup(): 21 296928 isix04.benchmarkcenter.megware.com {32,288}
[0] MPI startup(): 22 297001 isix04.benchmarkcenter.megware.com {33,289}
[0] MPI startup(): 23 296863 isix04.benchmarkcenter.megware.com {34,290}
[0] MPI startup(): 24 296914 isix04.benchmarkcenter.megware.com {35,291}
[0] MPI startup(): 25 296968 isix04.benchmarkcenter.megware.com {36,292}
[0] MPI startup(): 26 297039 isix04.benchmarkcenter.megware.com {37,293}
[0] MPI startup(): 27 296956 isix04.benchmarkcenter.megware.com {38,294}
[0] MPI startup(): 28 297028 isix04.benchmarkcenter.megware.com {39,295}
[0] MPI startup(): 29 296954 isix04.benchmarkcenter.megware.com {40,296}
[0] MPI startup(): 30 297041 isix04.benchmarkcenter.megware.com {41,297}
[0] MPI startup(): 31 297011 isix04.benchmarkcenter.megware.com {42,298}
[0] MPI startup(): 32 296924 isix04.benchmarkcenter.megware.com {43-44,299-300}
[0] MPI startup(): 33 296869 isix04.benchmarkcenter.megware.com {45-46,301-302}
[0] MPI startup(): 34 296951 isix04.benchmarkcenter.megware.com {47-48,303-304}
[0] MPI startup(): 35 297019 isix04.benchmarkcenter.megware.com {49-50,305-306}
[0] MPI startup(): 36 296948 isix04.benchmarkcenter.megware.com {51-52,307-308}
[0] MPI startup(): 37 296868 isix04.benchmarkcenter.megware.com {53-54,309-310}
[0] MPI startup(): 38 296943 isix04.benchmarkcenter.megware.com {55-56,311-312}
[0] MPI startup(): 39 296912 isix04.benchmarkcenter.megware.com {57-58,313-314}
[0] MPI startup(): 40 297005 isix04.benchmarkcenter.megware.com {59-60,315-316}
[0] MPI startup(): 41 296853 isix04.benchmarkcenter.megware.com {61-62,317-318}
[0] MPI startup(): 42 297020 isix04.benchmarkcenter.megware.com {63-64,319-320}
[0] MPI startup(): 43 296940 isix04.benchmarkcenter.megware.com {65,321}
[0] MPI startup(): 44 296950 isix04.benchmarkcenter.megware.com {66,322}
[0] MPI startup(): 45 296890 isix04.benchmarkcenter.megware.com {67,323}
[0] MPI startup(): 46 297045 isix04.benchmarkcenter.megware.com {68,324}
[0] MPI startup(): 47 296980 isix04.benchmarkcenter.megware.com {69,325}
[0] MPI startup(): 48 296899 isix04.benchmarkcenter.megware.com {70,326}
[0] MPI startup(): 49 296918 isix04.benchmarkcenter.megware.com {71,327}
[0] MPI startup(): 50 296907 isix04.benchmarkcenter.megware.com {72,328}
[0] MPI startup(): 51 296941 isix04.benchmarkcenter.megware.com {73,329}
[0] MPI startup(): 52 296942 isix04.benchmarkcenter.megware.com {74,330}
[0] MPI startup(): 53 296953 isix04.benchmarkcenter.megware.com {75,331}
[0] MPI startup(): 54 296973 isix04.benchmarkcenter.megware.com {76,332}
[0] MPI startup(): 55 296949 isix04.benchmarkcenter.megware.com {77,333}
[0] MPI startup(): 56 297013 isix04.benchmarkcenter.megware.com {78,334}
[0] MPI startup(): 57 296897 isix04.benchmarkcenter.megware.com {79,335}
[0] MPI startup(): 58 296876 isix04.benchmarkcenter.megware.com {80,336}
[0] MPI startup(): 59 296959 isix04.benchmarkcenter.megware.com {81,337}
[0] MPI startup(): 60 296923 isix04.benchmarkcenter.megware.com {82,338}
[0] MPI startup(): 61 297035 isix04.benchmarkcenter.megware.com {83,339}
[0] MPI startup(): 62 296978 isix04.benchmarkcenter.megware.com {84,340}
[0] MPI startup(): 63 296882 isix04.benchmarkcenter.megware.com {85,341}
[0] MPI startup(): 64 297021 isix04.benchmarkcenter.megware.com {86-87,342-343}
[0] MPI startup(): 65 297044 isix04.benchmarkcenter.megware.com {88-89,344-345}
[0] MPI startup(): 66 296989 isix04.benchmarkcenter.megware.com {90-91,346-347}
[0] MPI startup(): 67 296936 isix04.benchmarkcenter.megware.com {92-93,348-349}
[0] MPI startup(): 68 297023 isix04.benchmarkcenter.megware.com {94-95,350-351}
[0] MPI startup(): 69 297029 isix04.benchmarkcenter.megware.com {96-97,352-353}
[0] MPI startup(): 70 297033 isix04.benchmarkcenter.megware.com {98-99,354-355}
[0] MPI startup(): 71 296906 isix04.benchmarkcenter.megware.com {100-101,356-357}
[0] MPI startup(): 72 296930 isix04.benchmarkcenter.megware.com {102-103,358-359}
[0] MPI startup(): 73 296866 isix04.benchmarkcenter.megware.com {104-105,360-361}
[0] MPI startup(): 74 297026 isix04.benchmarkcenter.megware.com {106,362}
[0] MPI startup(): 75 296996 isix04.benchmarkcenter.megware.com {107,363}
[0] MPI startup(): 76 296877 isix04.benchmarkcenter.megware.com {108,364}
[0] MPI startup(): 77 297036 isix04.benchmarkcenter.megware.com {109,365}
[0] MPI startup(): 78 296898 isix04.benchmarkcenter.megware.com {110,366}
[0] MPI startup(): 79 296926 isix04.benchmarkcenter.megware.com {111,367}
[0] MPI startup(): 80 296957 isix04.benchmarkcenter.megware.com {112,368}
[0] MPI startup(): 81 297009 isix04.benchmarkcenter.megware.com {113,369}
[0] MPI startup(): 82 297008 isix04.benchmarkcenter.megware.com {114,370}
[0] MPI startup(): 83 296874 isix04.benchmarkcenter.megware.com {115,371}
[0] MPI startup(): 84 296929 isix04.benchmarkcenter.megware.com {116,372}
[0] MPI startup(): 85 296916 isix04.benchmarkcenter.megware.com {117,373}
[0] MPI startup(): 86 296920 isix04.benchmarkcenter.megware.com {118,374}
[0] MPI startup(): 87 297015 isix04.benchmarkcenter.megware.com {119,375}
[0] MPI startup(): 88 296892 isix04.benchmarkcenter.megware.com {120,376}
[0] MPI startup(): 89 297018 isix04.benchmarkcenter.megware.com {121,377}
[0] MPI startup(): 90 296931 isix04.benchmarkcenter.megware.com {122,378}
[0] MPI startup(): 91 296925 isix04.benchmarkcenter.megware.com {123,379}
[0] MPI startup(): 92 297046 isix04.benchmarkcenter.megware.com {124,380}
[0] MPI startup(): 93 296988 isix04.benchmarkcenter.megware.com {125,381}
[0] MPI startup(): 94 297010 isix04.benchmarkcenter.megware.com {126,382}
[0] MPI startup(): 95 297047 isix04.benchmarkcenter.megware.com {127,383}
[0] MPI startup(): 96 296982 isix04.benchmarkcenter.megware.com {128-129,384-385}
[0] MPI startup(): 97 296972 isix04.benchmarkcenter.megware.com {130-131,386-387}
[0] MPI startup(): 98 297012 isix04.benchmarkcenter.megware.com {132-133,388-389}
[0] MPI startup(): 99 296870 isix04.benchmarkcenter.megware.com {134-135,390-391}
[0] MPI startup(): 100 297006 isix04.benchmarkcenter.megware.com {136-137,392-393}
[0] MPI startup(): 101 296921 isix04.benchmarkcenter.megware.com {138-139,394-395}
[0] MPI startup(): 102 296998 isix04.benchmarkcenter.megware.com {140-141,396-397}
[0] MPI startup(): 103 296893 isix04.benchmarkcenter.megware.com {142-143,398-399}
[0] MPI startup(): 104 297016 isix04.benchmarkcenter.megware.com {144-145,400-401}
[0] MPI startup(): 105 296939 isix04.benchmarkcenter.megware.com {146-147,402-403}
[0] MPI startup(): 106 296946 isix04.benchmarkcenter.megware.com {148-149,404-405}
[0] MPI startup(): 107 296981 isix04.benchmarkcenter.megware.com {150,406}
[0] MPI startup(): 108 296917 isix04.benchmarkcenter.megware.com {151,407}
[0] MPI startup(): 109 296854 isix04.benchmarkcenter.megware.com {152,408}
[0] MPI startup(): 110 296944 isix04.benchmarkcenter.megware.com {153,409}
[0] MPI startup(): 111 296938 isix04.benchmarkcenter.megware.com {154,410}
[0] MPI startup(): 112 296855 isix04.benchmarkcenter.megware.com {155,411}
[0] MPI startup(): 113 297027 isix04.benchmarkcenter.megware.com {156,412}
[0] MPI startup(): 114 296976 isix04.benchmarkcenter.megware.com {157,413}
[0] MPI startup(): 115 296937 isix04.benchmarkcenter.megware.com {158,414}
[0] MPI startup(): 116 296861 isix04.benchmarkcenter.megware.com {159,415}
[0] MPI startup(): 117 296994 isix04.benchmarkcenter.megware.com {160,416}
[0] MPI startup(): 118 296945 isix04.benchmarkcenter.megware.com {161,417}
[0] MPI startup(): 119 296961 isix04.benchmarkcenter.megware.com {162,418}
[0] MPI startup(): 120 296858 isix04.benchmarkcenter.megware.com {163,419}
[0] MPI startup(): 121 296872 isix04.benchmarkcenter.megware.com {164,420}
[0] MPI startup(): 122 296864 isix04.benchmarkcenter.megware.com {165,421}
[0] MPI startup(): 123 296884 isix04.benchmarkcenter.megware.com {166,422}
[0] MPI startup(): 124 296901 isix04.benchmarkcenter.megware.com {167,423}
[0] MPI startup(): 125 296934 isix04.benchmarkcenter.megware.com {168,424}
[0] MPI startup(): 126 297004 isix04.benchmarkcenter.megware.com {169,425}
[0] MPI startup(): 127 297000 isix04.benchmarkcenter.megware.com {170,426}
[0] MPI startup(): 128 296909 isix04.benchmarkcenter.megware.com {171-172,427-428}
[0] MPI startup(): 129 296985 isix04.benchmarkcenter.megware.com {173-174,429-430}
[0] MPI startup(): 130 296969 isix04.benchmarkcenter.megware.com {175-176,431-432}
[0] MPI startup(): 131 296891 isix04.benchmarkcenter.megware.com {177-178,433-434}
[0] MPI startup(): 132 296964 isix04.benchmarkcenter.megware.com {179-180,435-436}
[0] MPI startup(): 133 296927 isix04.benchmarkcenter.megware.com {181-182,437-438}
[0] MPI startup(): 134 296878 isix04.benchmarkcenter.megware.com {183-184,439-440}
[0] MPI startup(): 135 296960 isix04.benchmarkcenter.megware.com {185-186,441-442}
[0] MPI startup(): 136 296979 isix04.benchmarkcenter.megware.com {187-188,443-444}
[0] MPI startup(): 137 296860 isix04.benchmarkcenter.megware.com {189-190,445-446}
[0] MPI startup(): 138 296947 isix04.benchmarkcenter.megware.com {191-192,447-448}
[0] MPI startup(): 139 296993 isix04.benchmarkcenter.megware.com {193,449}
[0] MPI startup(): 140 296900 isix04.benchmarkcenter.megware.com {194,450}
[0] MPI startup(): 141 296987 isix04.benchmarkcenter.megware.com {195,451}
[0] MPI startup(): 142 297038 isix04.benchmarkcenter.megware.com {196,452}
[0] MPI startup(): 143 296873 isix04.benchmarkcenter.megware.com {197,453}
[0] MPI startup(): 144 296871 isix04.benchmarkcenter.megware.com {198,454}
[0] MPI startup(): 145 296879 isix04.benchmarkcenter.megware.com {199,455}
[0] MPI startup(): 146 297032 isix04.benchmarkcenter.megware.com {200,456}
[0] MPI startup(): 147 296888 isix04.benchmarkcenter.megware.com {201,457}
[0] MPI startup(): 148 296970 isix04.benchmarkcenter.megware.com {202,458}
[0] MPI startup(): 149 296910 isix04.benchmarkcenter.megware.com {203,459}
[0] MPI startup(): 150 296902 isix04.benchmarkcenter.megware.com {204,460}
[0] MPI startup(): 151 296971 isix04.benchmarkcenter.megware.com {205,461}
[0] MPI startup(): 152 296965 isix04.benchmarkcenter.megware.com {206,462}
[0] MPI startup(): 153 296986 isix04.benchmarkcenter.megware.com {207,463}
[0] MPI startup(): 154 296919 isix04.benchmarkcenter.megware.com {208,464}
[0] MPI startup(): 155 296911 isix04.benchmarkcenter.megware.com {209,465}
[0] MPI startup(): 156 296983 isix04.benchmarkcenter.megware.com {210,466}
[0] MPI startup(): 157 297037 isix04.benchmarkcenter.megware.com {211,467}
[0] MPI startup(): 158 296908 isix04.benchmarkcenter.megware.com {212,468}
[0] MPI startup(): 159 296984 isix04.benchmarkcenter.megware.com {213,469}
[0] MPI startup(): 160 296862 isix04.benchmarkcenter.megware.com {214-215,470-471}
[0] MPI startup(): 161 296865 isix04.benchmarkcenter.megware.com {216-217,472-473}
[0] MPI startup(): 162 296955 isix04.benchmarkcenter.megware.com {218-219,474-475}
[0] MPI startup(): 163 297040 isix04.benchmarkcenter.megware.com {220-221,476-477}
[0] MPI startup(): 164 296963 isix04.benchmarkcenter.megware.com {222-223,478-479}
[0] MPI startup(): 165 296966 isix04.benchmarkcenter.megware.com {224-225,480-481}
[0] MPI startup(): 166 297014 isix04.benchmarkcenter.megware.com {226-227,482-483}
[0] MPI startup(): 167 296915 isix04.benchmarkcenter.megware.com {228-229,484-485}
[0] MPI startup(): 168 296896 isix04.benchmarkcenter.megware.com {230-231,486-487}
[0] MPI startup(): 169 296933 isix04.benchmarkcenter.megware.com {232-233,488-489}
[0] MPI startup(): 170 297017 isix04.benchmarkcenter.megware.com {234,490}
[0] MPI startup(): 171 296958 isix04.benchmarkcenter.megware.com {235,491}
[0] MPI startup(): 172 297034 isix04.benchmarkcenter.megware.com {236,492}
[0] MPI startup(): 173 297024 isix04.benchmarkcenter.megware.com {237,493}
[0] MPI startup(): 174 296962 isix04.benchmarkcenter.megware.com {238,494}
[0] MPI startup(): 175 296932 isix04.benchmarkcenter.megware.com {239,495}
[0] MPI startup(): 176 296856 isix04.benchmarkcenter.megware.com {240,496}
[0] MPI startup(): 177 297003 isix04.benchmarkcenter.megware.com {241,497}
[0] MPI startup(): 178 296883 isix04.benchmarkcenter.megware.com {242,498}
[0] MPI startup(): 179 296875 isix04.benchmarkcenter.megware.com {243,499}
[0] MPI startup(): 180 296903 isix04.benchmarkcenter.megware.com {244,500}
[0] MPI startup(): 181 296999 isix04.benchmarkcenter.megware.com {245,501}
[0] MPI startup(): 182 296886 isix04.benchmarkcenter.megware.com {246,502}
[0] MPI startup(): 183 297030 isix04.benchmarkcenter.megware.com {247,503}
[0] MPI startup(): 184 296967 isix04.benchmarkcenter.megware.com {248,504}
[0] MPI startup(): 185 296935 isix04.benchmarkcenter.megware.com {249,505}
[0] MPI startup(): 186 296881 isix04.benchmarkcenter.megware.com {250,506}
[0] MPI startup(): 187 297043 isix04.benchmarkcenter.megware.com {251,507}
[0] MPI startup(): 188 296990 isix04.benchmarkcenter.megware.com {252,508}
[0] MPI startup(): 189 296995 isix04.benchmarkcenter.megware.com {253,509}
[0] MPI startup(): 190 297031 isix04.benchmarkcenter.megware.com {254,510}
[0] MPI startup(): 191 297025 isix04.benchmarkcenter.megware.com {255,511}
OMP: pid 296975 tid 296975 thread 0 bound to OS proc set {24}
OMP: pid 297042 tid 297042 thread 0 bound to OS proc set {31}
OMP: pid 297002 tid 297002 thread 0 bound to OS proc set {23}
OMP: pid 296974 tid 296974 thread 0 bound to OS proc set {8}
OMP: pid 296880 tid 296880 thread 0 bound to OS proc set {30}
OMP: pid 296952 tid 296952 thread 0 bound to OS proc set {28}
OMP: pid 296904 tid 296904 thread 0 bound to OS proc set {26}
OMP: pid 296851 tid 296851 thread 0 bound to OS proc set {2}
OMP: pid 297022 tid 297022 thread 0 bound to OS proc set {14}
OMP: pid 296868 tid 296868 thread 0 bound to OS proc set {53}
OMP: pid 296991 tid 296991 thread 0 bound to OS proc set {4}
OMP: pid 296856 tid 296856 thread 0 bound to OS proc set {240}
OMP: pid 297011 tid 297011 thread 0 bound to OS proc set {42}
OMP: pid 297028 tid 297028 thread 0 bound to OS proc set {39}
OMP: pid 296914 tid 296914 thread 0 bound to OS proc set {35}
OMP: pid 297041 tid 297041 thread 0 bound to OS proc set {41}
OMP: pid 296959 tid 296959 thread 0 bound to OS proc set {81}
OMP: pid 296897 tid 296897 thread 0 bound to OS proc set {79}
OMP: pid 296989 tid 296989 thread 0 bound to OS proc set {90}
OMP: pid 296954 tid 296954 thread 0 bound to OS proc set {40}
OMP: pid 296977 tid 296977 thread 0 bound to OS proc set {25}
OMP: pid 297001 tid 297001 thread 0 bound to OS proc set {33}
OMP: pid 296872 tid 296872 thread 0 bound to OS proc set {164}
OMP: pid 296957 tid 296957 thread 0 bound to OS proc set {112}
OMP: pid 296853 tid 296853 thread 0 bound to OS proc set {61}
OMP: pid 296956 tid 296956 thread 0 bound to OS proc set {38}
OMP: pid 297009 tid 297009 thread 0 bound to OS proc set {113}
OMP: pid 296895 tid 296895 thread 0 bound to OS proc set {27}
OMP: pid 296973 tid 296973 thread 0 bound to OS proc set {76}
OMP: pid 296894 tid 296894 thread 0 bound to OS proc set {10}
OMP: pid 297019 tid 297019 thread 0 bound to OS proc set {49}
OMP: pid 297039 tid 297039 thread 0 bound to OS proc set {37}
OMP: pid 296874 tid 296874 thread 0 bound to OS proc set {115}
OMP: pid 296997 tid 296997 thread 0 bound to OS proc set {18}
OMP: pid 297012 tid 297012 thread 0 bound to OS proc set {132}
OMP: pid 296876 tid 296876 thread 0 bound to OS proc set {80}
OMP: pid 296858 tid 296858 thread 0 bound to OS proc set {163}
OMP: pid 296981 tid 296981 thread 0 bound to OS proc set {150}
OMP: pid 296907 tid 296907 thread 0 bound to OS proc set {72}
OMP: pid 296980 tid 296980 thread 0 bound to OS proc set {69}
OMP: pid 297013 tid 297013 thread 0 bound to OS proc set {78}
OMP: pid 297016 tid 297016 thread 0 bound to OS proc set {144}
OMP: pid 296941 tid 296941 thread 0 bound to OS proc set {73}
OMP: pid 296890 tid 296890 thread 0 bound to OS proc set {67}
OMP: pid 296968 tid 296968 thread 0 bound to OS proc set {36}
OMP: pid 297025 tid 297025 thread 0 bound to OS proc set {255}
OMP: pid 296953 tid 296953 thread 0 bound to OS proc set {75}
OMP: pid 296905 tid 296905 thread 0 bound to OS proc set {16}
OMP: pid 296924 tid 296924 thread 0 bound to OS proc set {43}
OMP: pid 296912 tid 296912 thread 0 bound to OS proc set {57}
OMP: pid 296948 tid 296948 thread 0 bound to OS proc set {51}
OMP: pid 296884 tid 296884 thread 0 bound to OS proc set {166}
OMP: pid 296869 tid 296869 thread 0 bound to OS proc set {45}
OMP: pid 296950 tid 296950 thread 0 bound to OS proc set {66}
OMP: pid 297004 tid 297004 thread 0 bound to OS proc set {169}
OMP: pid 296882 tid 296882 thread 0 bound to OS proc set {85}
OMP: pid 296992 tid 296992 thread 0 bound to OS proc set {20}
OMP: pid 297044 tid 297044 thread 0 bound to OS proc set {88}
OMP: pid 296940 tid 296940 thread 0 bound to OS proc set {65}
OMP: pid 297005 tid 297005 thread 0 bound to OS proc set {59}
OMP: pid 296951 tid 296951 thread 0 bound to OS proc set {47}
OMP: pid 297033 tid 297033 thread 0 bound to OS proc set {98}
OMP: pid 296961 tid 296961 thread 0 bound to OS proc set {162}
OMP: pid 296855 tid 296855 thread 0 bound to OS proc set {155}
OMP: pid 296899 tid 296899 thread 0 bound to OS proc set {70}
OMP: pid 296949 tid 296949 thread 0 bound to OS proc set {77}
OMP: pid 296917 tid 296917 thread 0 bound to OS proc set {151}
OMP: pid 296934 tid 296934 thread 0 bound to OS proc set {168}
OMP: pid 296898 tid 296898 thread 0 bound to OS proc set {110}
OMP: pid 296920 tid 296920 thread 0 bound to OS proc set {118}
OMP: pid 297046 tid 297046 thread 0 bound to OS proc set {124}
OMP: pid 296996 tid 296996 thread 0 bound to OS proc set {107}
OMP: pid 296886 tid 296886 thread 0 bound to OS proc set {246}
OMP: pid 297023 tid 297023 thread 0 bound to OS proc set {94}
OMP: pid 296971 tid 296971 thread 0 bound to OS proc set {205}
OMP: pid 296877 tid 296877 thread 0 bound to OS proc set {108}
OMP: pid 297040 tid 297040 thread 0 bound to OS proc set {220}
OMP: pid 296931 tid 296931 thread 0 bound to OS proc set {122}
OMP: pid 296916 tid 296916 thread 0 bound to OS proc set {117}
OMP: pid 296889 tid 296889 thread 0 bound to OS proc set {29}
OMP: pid 296863 tid 296863 thread 0 bound to OS proc set {34}
OMP: pid 296862 tid 296862 thread 0 bound to OS proc set {214}
OMP: pid 296976 tid 296976 thread 0 bound to OS proc set {157}
OMP: pid 296864 tid 296864 thread 0 bound to OS proc set {165}
OMP: pid 297035 tid 297035 thread 0 bound to OS proc set {83}
OMP: pid 296990 tid 296990 thread 0 bound to OS proc set {252}
OMP: pid 296987 tid 296987 thread 0 bound to OS proc set {195}
OMP: pid 296866 tid 296866 thread 0 bound to OS proc set {104}
OMP: pid 297015 tid 297015 thread 0 bound to OS proc set {119}
OMP: pid 296908 tid 296908 thread 0 bound to OS proc set {212}
OMP: pid 296984 tid 296984 thread 0 bound to OS proc set {213}
OMP: pid 296887 tid 296887 thread 0 bound to OS proc set {12}
OMP: pid 296910 tid 296910 thread 0 bound to OS proc set {203}
OMP: pid 296923 tid 296923 thread 0 bound to OS proc set {82}
OMP: pid 296955 tid 296955 thread 0 bound to OS proc set {218}
OMP: pid 296985 tid 296985 thread 0 bound to OS proc set {173}
OMP: pid 296909 tid 296909 thread 0 bound to OS proc set {171}
OMP: pid 297007 tid 297007 thread 0 bound to OS proc set {22}
OMP: pid 296939 tid 296939 thread 0 bound to OS proc set {146}
OMP: pid 297036 tid 297036 thread 0 bound to OS proc set {109}
OMP: pid 297047 tid 297047 thread 0 bound to OS proc set {127}
OMP: pid 296873 tid 296873 thread 0 bound to OS proc set {197}
OMP: pid 296929 tid 296929 thread 0 bound to OS proc set {116}
OMP: pid 297037 tid 297037 thread 0 bound to OS proc set {211}
OMP: pid 297014 tid 297014 thread 0 bound to OS proc set {226}
OMP: pid 296906 tid 296906 thread 0 bound to OS proc set {100}
OMP: pid 297032 tid 297032 thread 0 bound to OS proc set {200}
OMP: pid 297038 tid 297038 thread 0 bound to OS proc set {196}
OMP: pid 297008 tid 297008 thread 0 bound to OS proc set {114}
OMP: pid 296896 tid 296896 thread 0 bound to OS proc set {230}
OMP: pid 296867 tid 296867 thread 0 bound to OS proc set {6}
OMP: pid 296902 tid 296902 thread 0 bound to OS proc set {204}
OMP: pid 296865 tid 296865 thread 0 bound to OS proc set {216}
OMP: pid 296903 tid 296903 thread 0 bound to OS proc set {244}
OMP: pid 297017 tid 297017 thread 0 bound to OS proc set {234}
OMP: pid 296942 tid 296942 thread 0 bound to OS proc set {74}
OMP: pid 296978 tid 296978 thread 0 bound to OS proc set {84}
OMP: pid 296900 tid 296900 thread 0 bound to OS proc set {194}
OMP: pid 296962 tid 296962 thread 0 bound to OS proc set {238}
OMP: pid 297018 tid 297018 thread 0 bound to OS proc set {121}
OMP: pid 296944 tid 296944 thread 0 bound to OS proc set {153}
OMP: pid 296925 tid 296925 thread 0 bound to OS proc set {123}
OMP: pid 296926 tid 296926 thread 0 bound to OS proc set {111}
OMP: pid 296879 tid 296879 thread 0 bound to OS proc set {199}
OMP: pid 297024 tid 297024 thread 0 bound to OS proc set {237}
OMP: pid 296878 tid 296878 thread 0 bound to OS proc set {183}
OMP: pid 297010 tid 297010 thread 0 bound to OS proc set {126}
OMP: pid 296870 tid 296870 thread 0 bound to OS proc set {134}
OMP: pid 296998 tid 296998 thread 0 bound to OS proc set {140}
OMP: pid 296982 tid 296982 thread 0 bound to OS proc set {128}
OMP: pid 297000 tid 297000 thread 0 bound to OS proc set {170}
OMP: pid 296921 tid 296921 thread 0 bound to OS proc set {138}
OMP: pid 296860 tid 296860 thread 0 bound to OS proc set {189}
OMP: pid 296937 tid 296937 thread 0 bound to OS proc set {158}
OMP: pid 296938 tid 296938 thread 0 bound to OS proc set {154}
OMP: pid 296861 tid 296861 thread 0 bound to OS proc set {159}
OMP: pid 296994 tid 296994 thread 0 bound to OS proc set {160}
OMP: pid 297030 tid 297030 thread 0 bound to OS proc set {247}
OMP: pid 296936 tid 296936 thread 0 bound to OS proc set {92}
OMP: pid 296928 tid 296928 thread 0 bound to OS proc set {32}
OMP: pid 297043 tid 297043 thread 0 bound to OS proc set {251}
OMP: pid 296892 tid 296892 thread 0 bound to OS proc set {120}
OMP: pid 297020 tid 297020 thread 0 bound to OS proc set {63}
OMP: pid 296972 tid 296972 thread 0 bound to OS proc set {130}
OMP: pid 296911 tid 296911 thread 0 bound to OS proc set {209}
OMP: pid 296901 tid 296901 thread 0 bound to OS proc set {167}
OMP: pid 296999 tid 296999 thread 0 bound to OS proc set {245}
OMP: pid 296893 tid 296893 thread 0 bound to OS proc set {142}
OMP: pid 297006 tid 297006 thread 0 bound to OS proc set {136}
OMP: pid 297021 tid 297021 thread 0 bound to OS proc set {86}
OMP: pid 296943 tid 296943 thread 0 bound to OS proc set {55}
OMP: pid 296891 tid 296891 thread 0 bound to OS proc set {177}
OMP: pid 297029 tid 297029 thread 0 bound to OS proc set {96}
OMP: pid 296930 tid 296930 thread 0 bound to OS proc set {102}
OMP: pid 296881 tid 296881 thread 0 bound to OS proc set {250}
OMP: pid 296945 tid 296945 thread 0 bound to OS proc set {161}
OMP: pid 296918 tid 296918 thread 0 bound to OS proc set {71}
OMP: pid 296988 tid 296988 thread 0 bound to OS proc set {125}
OMP: pid 296995 tid 296995 thread 0 bound to OS proc set {253}
OMP: pid 297045 tid 297045 thread 0 bound to OS proc set {68}
OMP: pid 296986 tid 296986 thread 0 bound to OS proc set {207}
OMP: pid 297003 tid 297003 thread 0 bound to OS proc set {241}
OMP: pid 296935 tid 296935 thread 0 bound to OS proc set {249}
OMP: pid 296927 tid 296927 thread 0 bound to OS proc set {181}
OMP: pid 296915 tid 296915 thread 0 bound to OS proc set {228}
OMP: pid 296922 tid 296922 thread 0 bound to OS proc set {0}
OMP: pid 296993 tid 296993 thread 0 bound to OS proc set {193}
OMP: pid 296919 tid 296919 thread 0 bound to OS proc set {208}
OMP: pid 296932 tid 296932 thread 0 bound to OS proc set {239}
OMP: pid 296875 tid 296875 thread 0 bound to OS proc set {243}
OMP: pid 296947 tid 296947 thread 0 bound to OS proc set {191}
OMP: pid 296979 tid 296979 thread 0 bound to OS proc set {187}
OMP: pid 296871 tid 296871 thread 0 bound to OS proc set {198}
OMP: pid 296933 tid 296933 thread 0 bound to OS proc set {232}
OMP: pid 296958 tid 296958 thread 0 bound to OS proc set {235}
OMP: pid 296946 tid 296946 thread 0 bound to OS proc set {148}
OMP: pid 296966 tid 296966 thread 0 bound to OS proc set {224}
OMP: pid 297026 tid 297026 thread 0 bound to OS proc set {106}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 297027 tid 297027 thread 0 bound to OS proc set {156}
OMP: pid 296983 tid 296983 thread 0 bound to OS proc set {210}
OMP: pid 296854 tid 296854 thread 0 bound to OS proc set {152}
OMP: pid 296967 tid 296967 thread 0 bound to OS proc set {248}
OMP: pid 297031 tid 297031 thread 0 bound to OS proc set {254}
OMP: pid 297034 tid 297034 thread 0 bound to OS proc set {236}
OMP: pid 296888 tid 296888 thread 0 bound to OS proc set {201}
OMP: pid 296964 tid 296964 thread 0 bound to OS proc set {179}
OMP: pid 296960 tid 296960 thread 0 bound to OS proc set {185}
OMP: pid 296970 tid 296970 thread 0 bound to OS proc set {202}
OMP: pid 296965 tid 296965 thread 0 bound to OS proc set {206}
OMP: pid 296883 tid 296883 thread 0 bound to OS proc set {242}
OMP: pid 296969 tid 296969 thread 0 bound to OS proc set {175}
OMP: pid 296963 tid 296963 thread 0 bound to OS proc set {222}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
8 by 4 by 6 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.020 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1445 | 1490 | 1544 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.710824 on 192 procs for 10 steps with 32768000 atoms
Performance: 6.077 ns/day, 3.949 hours/ns, 14.068 timesteps/s, 460.986 Matom-step/s
98.5% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.49144 | 0.50147 | 0.5156 | 0.7 | 70.55
Neigh | 0.032165 | 0.033905 | 0.036077 | 0.4 | 4.77
Comm | 0.065035 | 0.077683 | 0.092258 | 2.1 | 10.93
Output | 0.0014085 | 0.0024952 | 0.0042419 | 1.4 | 0.35
Modify | 0.049068 | 0.074354 | 0.081056 | 2.0 | 10.46
Other | | 0.02091 | | | 2.94
Nlocal: 170667 ave 171308 max 169512 min
Histogram: 64 0 0 0 0 0 0 0 13 115
Nghost: 55997.1 ave 56418 max 55762 min
Histogram: 27 61 32 8 0 4 15 27 13 5
Neighs: 6.4242e+06 ave 6.47799e+06 max 6.37962e+06 min
Histogram: 64 0 1 56 7 0 0 0 2 62
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1445 | 1490 | 1544 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74786 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.934
500 797.7245 -1.1257864e+08 0 -1.091998e+08 51543.024
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.153
Loop time of 37.592 on 192 procs for 500 steps with 32768000 atoms
Performance: 5.746 ns/day, 4.177 hours/ns, 13.301 timesteps/s, 435.837 Matom-step/s
99.0% CPU use with 192 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 25.111 | 25.548 | 26.114 | 4.1 | 67.96
Neigh | 2.8144 | 2.8675 | 3.0267 | 2.7 | 7.63
Comm | 3.7205 | 4.3857 | 5.4118 | 13.4 | 11.67
Output | 0.016119 | 0.028442 | 0.046039 | 4.5 | 0.08
Modify | 2.0982 | 3.8254 | 4.1527 | 15.2 | 10.18
Other | | 0.9374 | | | 2.49
Nlocal: 170667 ave 171684 max 169135 min
Histogram: 5 32 24 3 0 0 10 44 58 16
Nghost: 55896.6 ave 56661 max 55274 min
Histogram: 5 9 23 43 38 38 24 6 4 2
Neighs: 6.44217e+06 ave 6.5059e+06 max 6.38057e+06 min
Histogram: 8 35 22 20 34 9 0 10 26 28
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747092
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:38
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_6 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 216 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 301842 isix04.benchmarkcenter.megware.com {0-1,256-257}
[0] MPI startup(): 1 301891 isix04.benchmarkcenter.megware.com {2-3,258-259}
[0] MPI startup(): 2 301738 isix04.benchmarkcenter.megware.com {4-5,260-261}
[0] MPI startup(): 3 301907 isix04.benchmarkcenter.megware.com {6-7,262-263}
[0] MPI startup(): 4 301860 isix04.benchmarkcenter.megware.com {8-9,264-265}
[0] MPI startup(): 5 301902 isix04.benchmarkcenter.megware.com {10-11,266-267}
[0] MPI startup(): 6 301715 isix04.benchmarkcenter.megware.com {12-13,268-269}
[0] MPI startup(): 7 301835 isix04.benchmarkcenter.megware.com {14,270}
[0] MPI startup(): 8 301919 isix04.benchmarkcenter.megware.com {15,271}
[0] MPI startup(): 9 301836 isix04.benchmarkcenter.megware.com {16,272}
[0] MPI startup(): 10 301828 isix04.benchmarkcenter.megware.com {17,273}
[0] MPI startup(): 11 301785 isix04.benchmarkcenter.megware.com {18,274}
[0] MPI startup(): 12 301920 isix04.benchmarkcenter.megware.com {19,275}
[0] MPI startup(): 13 301773 isix04.benchmarkcenter.megware.com {20,276}
[0] MPI startup(): 14 301853 isix04.benchmarkcenter.megware.com {21,277}
[0] MPI startup(): 15 301737 isix04.benchmarkcenter.megware.com {22,278}
[0] MPI startup(): 16 301855 isix04.benchmarkcenter.megware.com {23,279}
[0] MPI startup(): 17 301801 isix04.benchmarkcenter.megware.com {24,280}
[0] MPI startup(): 18 301879 isix04.benchmarkcenter.megware.com {25,281}
[0] MPI startup(): 19 301849 isix04.benchmarkcenter.megware.com {26,282}
[0] MPI startup(): 20 301727 isix04.benchmarkcenter.megware.com {27,283}
[0] MPI startup(): 21 301754 isix04.benchmarkcenter.megware.com {28,284}
[0] MPI startup(): 22 301850 isix04.benchmarkcenter.megware.com {29,285}
[0] MPI startup(): 23 301890 isix04.benchmarkcenter.megware.com {30,286}
[0] MPI startup(): 24 301718 isix04.benchmarkcenter.megware.com {31,287}
[0] MPI startup(): 25 301756 isix04.benchmarkcenter.megware.com {32,288}
[0] MPI startup(): 26 301854 isix04.benchmarkcenter.megware.com {33,289}
[0] MPI startup(): 27 301921 isix04.benchmarkcenter.megware.com {34,290}
[0] MPI startup(): 28 301841 isix04.benchmarkcenter.megware.com {35,291}
[0] MPI startup(): 29 301911 isix04.benchmarkcenter.megware.com {36,292}
[0] MPI startup(): 30 301848 isix04.benchmarkcenter.megware.com {37,293}
[0] MPI startup(): 31 301759 isix04.benchmarkcenter.megware.com {38,294}
[0] MPI startup(): 32 301726 isix04.benchmarkcenter.megware.com {39,295}
[0] MPI startup(): 33 301917 isix04.benchmarkcenter.megware.com {40,296}
[0] MPI startup(): 34 301871 isix04.benchmarkcenter.megware.com {41,297}
[0] MPI startup(): 35 301863 isix04.benchmarkcenter.megware.com {42,298}
[0] MPI startup(): 36 301829 isix04.benchmarkcenter.megware.com {43-44,299-300}
[0] MPI startup(): 37 301805 isix04.benchmarkcenter.megware.com {45-46,301-302}
[0] MPI startup(): 38 301826 isix04.benchmarkcenter.megware.com {47-48,303-304}
[0] MPI startup(): 39 301900 isix04.benchmarkcenter.megware.com {49-50,305-306}
[0] MPI startup(): 40 301800 isix04.benchmarkcenter.megware.com {51-52,307-308}
[0] MPI startup(): 41 301885 isix04.benchmarkcenter.megware.com {53-54,309-310}
[0] MPI startup(): 42 301858 isix04.benchmarkcenter.megware.com {55-56,311-312}
[0] MPI startup(): 43 301731 isix04.benchmarkcenter.megware.com {57,313}
[0] MPI startup(): 44 301729 isix04.benchmarkcenter.megware.com {58,314}
[0] MPI startup(): 45 301760 isix04.benchmarkcenter.megware.com {59,315}
[0] MPI startup(): 46 301888 isix04.benchmarkcenter.megware.com {60,316}
[0] MPI startup(): 47 301880 isix04.benchmarkcenter.megware.com {61,317}
[0] MPI startup(): 48 301910 isix04.benchmarkcenter.megware.com {62,318}
[0] MPI startup(): 49 301720 isix04.benchmarkcenter.megware.com {63,319}
[0] MPI startup(): 50 301929 isix04.benchmarkcenter.megware.com {64,320}
[0] MPI startup(): 51 301899 isix04.benchmarkcenter.megware.com {65,321}
[0] MPI startup(): 52 301906 isix04.benchmarkcenter.megware.com {66,322}
[0] MPI startup(): 53 301872 isix04.benchmarkcenter.megware.com {67,323}
[0] MPI startup(): 54 301896 isix04.benchmarkcenter.megware.com {68,324}
[0] MPI startup(): 55 301867 isix04.benchmarkcenter.megware.com {69,325}
[0] MPI startup(): 56 301724 isix04.benchmarkcenter.megware.com {70,326}
[0] MPI startup(): 57 301804 isix04.benchmarkcenter.megware.com {71,327}
[0] MPI startup(): 58 301873 isix04.benchmarkcenter.megware.com {72,328}
[0] MPI startup(): 59 301796 isix04.benchmarkcenter.megware.com {73,329}
[0] MPI startup(): 60 301776 isix04.benchmarkcenter.megware.com {74,330}
[0] MPI startup(): 61 301783 isix04.benchmarkcenter.megware.com {75,331}
[0] MPI startup(): 62 301825 isix04.benchmarkcenter.megware.com {76,332}
[0] MPI startup(): 63 301898 isix04.benchmarkcenter.megware.com {77,333}
[0] MPI startup(): 64 301763 isix04.benchmarkcenter.megware.com {78,334}
[0] MPI startup(): 65 301765 isix04.benchmarkcenter.megware.com {79,335}
[0] MPI startup(): 66 301933 isix04.benchmarkcenter.megware.com {80,336}
[0] MPI startup(): 67 301806 isix04.benchmarkcenter.megware.com {81,337}
[0] MPI startup(): 68 301908 isix04.benchmarkcenter.megware.com {82,338}
[0] MPI startup(): 69 301741 isix04.benchmarkcenter.megware.com {83,339}
[0] MPI startup(): 70 301746 isix04.benchmarkcenter.megware.com {84,340}
[0] MPI startup(): 71 301932 isix04.benchmarkcenter.megware.com {85,341}
[0] MPI startup(): 72 301799 isix04.benchmarkcenter.megware.com {86-87,342-343}
[0] MPI startup(): 73 301901 isix04.benchmarkcenter.megware.com {88-89,344-345}
[0] MPI startup(): 74 301881 isix04.benchmarkcenter.megware.com {90-91,346-347}
[0] MPI startup(): 75 301912 isix04.benchmarkcenter.megware.com {92-93,348-349}
[0] MPI startup(): 76 301735 isix04.benchmarkcenter.megware.com {94-95,350-351}
[0] MPI startup(): 77 301875 isix04.benchmarkcenter.megware.com {96-97,352-353}
[0] MPI startup(): 78 301777 isix04.benchmarkcenter.megware.com {98,354}
[0] MPI startup(): 79 301811 isix04.benchmarkcenter.megware.com {99,355}
[0] MPI startup(): 80 301742 isix04.benchmarkcenter.megware.com {100,356}
[0] MPI startup(): 81 301916 isix04.benchmarkcenter.megware.com {101,357}
[0] MPI startup(): 82 301882 isix04.benchmarkcenter.megware.com {102,358}
[0] MPI startup(): 83 301730 isix04.benchmarkcenter.megware.com {103,359}
[0] MPI startup(): 84 301819 isix04.benchmarkcenter.megware.com {104,360}
[0] MPI startup(): 85 301774 isix04.benchmarkcenter.megware.com {105,361}
[0] MPI startup(): 86 301859 isix04.benchmarkcenter.megware.com {106,362}
[0] MPI startup(): 87 301775 isix04.benchmarkcenter.megware.com {107,363}
[0] MPI startup(): 88 301817 isix04.benchmarkcenter.megware.com {108,364}
[0] MPI startup(): 89 301915 isix04.benchmarkcenter.megware.com {109,365}
[0] MPI startup(): 90 301764 isix04.benchmarkcenter.megware.com {110,366}
[0] MPI startup(): 91 301856 isix04.benchmarkcenter.megware.com {111,367}
[0] MPI startup(): 92 301827 isix04.benchmarkcenter.megware.com {112,368}
[0] MPI startup(): 93 301808 isix04.benchmarkcenter.megware.com {113,369}
[0] MPI startup(): 94 301790 isix04.benchmarkcenter.megware.com {114,370}
[0] MPI startup(): 95 301748 isix04.benchmarkcenter.megware.com {115,371}
[0] MPI startup(): 96 301733 isix04.benchmarkcenter.megware.com {116,372}
[0] MPI startup(): 97 301788 isix04.benchmarkcenter.megware.com {117,373}
[0] MPI startup(): 98 301781 isix04.benchmarkcenter.megware.com {118,374}
[0] MPI startup(): 99 301861 isix04.benchmarkcenter.megware.com {119,375}
[0] MPI startup(): 100 301869 isix04.benchmarkcenter.megware.com {120,376}
[0] MPI startup(): 101 301905 isix04.benchmarkcenter.megware.com {121,377}
[0] MPI startup(): 102 301814 isix04.benchmarkcenter.megware.com {122,378}
[0] MPI startup(): 103 301852 isix04.benchmarkcenter.megware.com {123,379}
[0] MPI startup(): 104 301771 isix04.benchmarkcenter.megware.com {124,380}
[0] MPI startup(): 105 301778 isix04.benchmarkcenter.megware.com {125,381}
[0] MPI startup(): 106 301798 isix04.benchmarkcenter.megware.com {126,382}
[0] MPI startup(): 107 301913 isix04.benchmarkcenter.megware.com {127,383}
[0] MPI startup(): 108 301791 isix04.benchmarkcenter.megware.com {128-129,384-385}
[0] MPI startup(): 109 301903 isix04.benchmarkcenter.megware.com {130-131,386-387}
[0] MPI startup(): 110 301723 isix04.benchmarkcenter.megware.com {132-133,388-389}
[0] MPI startup(): 111 301928 isix04.benchmarkcenter.megware.com {134-135,390-391}
[0] MPI startup(): 112 301794 isix04.benchmarkcenter.megware.com {136-137,392-393}
[0] MPI startup(): 113 301716 isix04.benchmarkcenter.megware.com {138-139,394-395}
[0] MPI startup(): 114 301820 isix04.benchmarkcenter.megware.com {140-141,396-397}
[0] MPI startup(): 115 301736 isix04.benchmarkcenter.megware.com {142,398}
[0] MPI startup(): 116 301864 isix04.benchmarkcenter.megware.com {143,399}
[0] MPI startup(): 117 301757 isix04.benchmarkcenter.megware.com {144,400}
[0] MPI startup(): 118 301904 isix04.benchmarkcenter.megware.com {145,401}
[0] MPI startup(): 119 301909 isix04.benchmarkcenter.megware.com {146,402}
[0] MPI startup(): 120 301784 isix04.benchmarkcenter.megware.com {147,403}
[0] MPI startup(): 121 301925 isix04.benchmarkcenter.megware.com {148,404}
[0] MPI startup(): 122 301918 isix04.benchmarkcenter.megware.com {149,405}
[0] MPI startup(): 123 301767 isix04.benchmarkcenter.megware.com {150,406}
[0] MPI startup(): 124 301762 isix04.benchmarkcenter.megware.com {151,407}
[0] MPI startup(): 125 301797 isix04.benchmarkcenter.megware.com {152,408}
[0] MPI startup(): 126 301739 isix04.benchmarkcenter.megware.com {153,409}
[0] MPI startup(): 127 301822 isix04.benchmarkcenter.megware.com {154,410}
[0] MPI startup(): 128 301750 isix04.benchmarkcenter.megware.com {155,411}
[0] MPI startup(): 129 301868 isix04.benchmarkcenter.megware.com {156,412}
[0] MPI startup(): 130 301823 isix04.benchmarkcenter.megware.com {157,413}
[0] MPI startup(): 131 301824 isix04.benchmarkcenter.megware.com {158,414}
[0] MPI startup(): 132 301766 isix04.benchmarkcenter.megware.com {159,415}
[0] MPI startup(): 133 301769 isix04.benchmarkcenter.megware.com {160,416}
[0] MPI startup(): 134 301812 isix04.benchmarkcenter.megware.com {161,417}
[0] MPI startup(): 135 301749 isix04.benchmarkcenter.megware.com {162,418}
[0] MPI startup(): 136 301922 isix04.benchmarkcenter.megware.com {163,419}
[0] MPI startup(): 137 301878 isix04.benchmarkcenter.megware.com {164,420}
[0] MPI startup(): 138 301761 isix04.benchmarkcenter.megware.com {165,421}
[0] MPI startup(): 139 301779 isix04.benchmarkcenter.megware.com {166,422}
[0] MPI startup(): 140 301934 isix04.benchmarkcenter.megware.com {167,423}
[0] MPI startup(): 141 301818 isix04.benchmarkcenter.megware.com {168,424}
[0] MPI startup(): 142 301815 isix04.benchmarkcenter.megware.com {169,425}
[0] MPI startup(): 143 301865 isix04.benchmarkcenter.megware.com {170,426}
[0] MPI startup(): 144 301803 isix04.benchmarkcenter.megware.com {171-172,427-428}
[0] MPI startup(): 145 301802 isix04.benchmarkcenter.megware.com {173-174,429-430}
[0] MPI startup(): 146 301931 isix04.benchmarkcenter.megware.com {175-176,431-432}
[0] MPI startup(): 147 301877 isix04.benchmarkcenter.megware.com {177-178,433-434}
[0] MPI startup(): 148 301743 isix04.benchmarkcenter.megware.com {179-180,435-436}
[0] MPI startup(): 149 301837 isix04.benchmarkcenter.megware.com {181-182,437-438}
[0] MPI startup(): 150 301924 isix04.benchmarkcenter.megware.com {183-184,439-440}
[0] MPI startup(): 151 301874 isix04.benchmarkcenter.megware.com {185,441}
[0] MPI startup(): 152 301809 isix04.benchmarkcenter.megware.com {186,442}
[0] MPI startup(): 153 301717 isix04.benchmarkcenter.megware.com {187,443}
[0] MPI startup(): 154 301893 isix04.benchmarkcenter.megware.com {188,444}
[0] MPI startup(): 155 301816 isix04.benchmarkcenter.megware.com {189,445}
[0] MPI startup(): 156 301923 isix04.benchmarkcenter.megware.com {190,446}
[0] MPI startup(): 157 301807 isix04.benchmarkcenter.megware.com {191,447}
[0] MPI startup(): 158 301833 isix04.benchmarkcenter.megware.com {192,448}
[0] MPI startup(): 159 301755 isix04.benchmarkcenter.megware.com {193,449}
[0] MPI startup(): 160 301927 isix04.benchmarkcenter.megware.com {194,450}
[0] MPI startup(): 161 301745 isix04.benchmarkcenter.megware.com {195,451}
[0] MPI startup(): 162 301782 isix04.benchmarkcenter.megware.com {196,452}
[0] MPI startup(): 163 301786 isix04.benchmarkcenter.megware.com {197,453}
[0] MPI startup(): 164 301876 isix04.benchmarkcenter.megware.com {198,454}
[0] MPI startup(): 165 301895 isix04.benchmarkcenter.megware.com {199,455}
[0] MPI startup(): 166 301772 isix04.benchmarkcenter.megware.com {200,456}
[0] MPI startup(): 167 301752 isix04.benchmarkcenter.megware.com {201,457}
[0] MPI startup(): 168 301787 isix04.benchmarkcenter.megware.com {202,458}
[0] MPI startup(): 169 301889 isix04.benchmarkcenter.megware.com {203,459}
[0] MPI startup(): 170 301810 isix04.benchmarkcenter.megware.com {204,460}
[0] MPI startup(): 171 301728 isix04.benchmarkcenter.megware.com {205,461}
[0] MPI startup(): 172 301744 isix04.benchmarkcenter.megware.com {206,462}
[0] MPI startup(): 173 301813 isix04.benchmarkcenter.megware.com {207,463}
[0] MPI startup(): 174 301930 isix04.benchmarkcenter.megware.com {208,464}
[0] MPI startup(): 175 301780 isix04.benchmarkcenter.megware.com {209,465}
[0] MPI startup(): 176 301892 isix04.benchmarkcenter.megware.com {210,466}
[0] MPI startup(): 177 301935 isix04.benchmarkcenter.megware.com {211,467}
[0] MPI startup(): 178 301821 isix04.benchmarkcenter.megware.com {212,468}
[0] MPI startup(): 179 301753 isix04.benchmarkcenter.megware.com {213,469}
[0] MPI startup(): 180 301758 isix04.benchmarkcenter.megware.com {214-215,470-471}
[0] MPI startup(): 181 301839 isix04.benchmarkcenter.megware.com {216-217,472-473}
[0] MPI startup(): 182 301883 isix04.benchmarkcenter.megware.com {218-219,474-475}
[0] MPI startup(): 183 301886 isix04.benchmarkcenter.megware.com {220-221,476-477}
[0] MPI startup(): 184 301770 isix04.benchmarkcenter.megware.com {222-223,478-479}
[0] MPI startup(): 185 301845 isix04.benchmarkcenter.megware.com {224-225,480-481}
[0] MPI startup(): 186 301830 isix04.benchmarkcenter.megware.com {226,482}
[0] MPI startup(): 187 301792 isix04.benchmarkcenter.megware.com {227,483}
[0] MPI startup(): 188 301732 isix04.benchmarkcenter.megware.com {228,484}
[0] MPI startup(): 189 301789 isix04.benchmarkcenter.megware.com {229,485}
[0] MPI startup(): 190 301897 isix04.benchmarkcenter.megware.com {230,486}
[0] MPI startup(): 191 301847 isix04.benchmarkcenter.megware.com {231,487}
[0] MPI startup(): 192 301795 isix04.benchmarkcenter.megware.com {232,488}
[0] MPI startup(): 193 301734 isix04.benchmarkcenter.megware.com {233,489}
[0] MPI startup(): 194 301844 isix04.benchmarkcenter.megware.com {234,490}
[0] MPI startup(): 195 301843 isix04.benchmarkcenter.megware.com {235,491}
[0] MPI startup(): 196 301851 isix04.benchmarkcenter.megware.com {236,492}
[0] MPI startup(): 197 301747 isix04.benchmarkcenter.megware.com {237,493}
[0] MPI startup(): 198 301832 isix04.benchmarkcenter.megware.com {238,494}
[0] MPI startup(): 199 301894 isix04.benchmarkcenter.megware.com {239,495}
[0] MPI startup(): 200 301926 isix04.benchmarkcenter.megware.com {240,496}
[0] MPI startup(): 201 301887 isix04.benchmarkcenter.megware.com {241,497}
[0] MPI startup(): 202 301862 isix04.benchmarkcenter.megware.com {242,498}
[0] MPI startup(): 203 301846 isix04.benchmarkcenter.megware.com {243,499}
[0] MPI startup(): 204 301768 isix04.benchmarkcenter.megware.com {244,500}
[0] MPI startup(): 205 301914 isix04.benchmarkcenter.megware.com {245,501}
[0] MPI startup(): 206 301831 isix04.benchmarkcenter.megware.com {246,502}
[0] MPI startup(): 207 301870 isix04.benchmarkcenter.megware.com {247,503}
[0] MPI startup(): 208 301866 isix04.benchmarkcenter.megware.com {248,504}
[0] MPI startup(): 209 301725 isix04.benchmarkcenter.megware.com {249,505}
[0] MPI startup(): 210 301857 isix04.benchmarkcenter.megware.com {250,506}
[0] MPI startup(): 211 301751 isix04.benchmarkcenter.megware.com {251,507}
[0] MPI startup(): 212 301884 isix04.benchmarkcenter.megware.com {252,508}
[0] MPI startup(): 213 301838 isix04.benchmarkcenter.megware.com {253,509}
[0] MPI startup(): 214 301740 isix04.benchmarkcenter.megware.com {254,510}
[0] MPI startup(): 215 301834 isix04.benchmarkcenter.megware.com {255,511}
OMP: pid 301756 tid 301756 thread 0 bound to OS proc set {32}
OMP: pid 301836 tid 301836 thread 0 bound to OS proc set {16}
OMP: pid 301715 tid 301715 thread 0 bound to OS proc set {12}
OMP: pid 301907 tid 301907 thread 0 bound to OS proc set {6}
OMP: pid 301921 tid 301921 thread 0 bound to OS proc set {34}
OMP: pid 301835 tid 301835 thread 0 bound to OS proc set {14}
OMP: pid 301847 tid 301847 thread 0 bound to OS proc set {231}
OMP: pid 301785 tid 301785 thread 0 bound to OS proc set {18}
OMP: pid 301848 tid 301848 thread 0 bound to OS proc set {37}
OMP: pid 301854 tid 301854 thread 0 bound to OS proc set {33}
OMP: pid 301801 tid 301801 thread 0 bound to OS proc set {24}
OMP: pid 301919 tid 301919 thread 0 bound to OS proc set {15}
OMP: pid 301790 tid 301790 thread 0 bound to OS proc set {114}
OMP: pid 301718 tid 301718 thread 0 bound to OS proc set {31}
OMP: pid 301754 tid 301754 thread 0 bound to OS proc set {28}
OMP: pid 301898 tid 301898 thread 0 bound to OS proc set {77}
OMP: pid 301871 tid 301871 thread 0 bound to OS proc set {41}
OMP: pid 301723 tid 301723 thread 0 bound to OS proc set {132}
OMP: pid 301908 tid 301908 thread 0 bound to OS proc set {82}
OMP: pid 301891 tid 301891 thread 0 bound to OS proc set {2}
OMP: pid 301896 tid 301896 thread 0 bound to OS proc set {68}
OMP: pid 301805 tid 301805 thread 0 bound to OS proc set {45}
OMP: pid 301935 tid 301935 thread 0 bound to OS proc set {211}
OMP: pid 301885 tid 301885 thread 0 bound to OS proc set {53}
OMP: pid 301858 tid 301858 thread 0 bound to OS proc set {55}
OMP: pid 301933 tid 301933 thread 0 bound to OS proc set {80}
OMP: pid 301899 tid 301899 thread 0 bound to OS proc set {65}
OMP: pid 301855 tid 301855 thread 0 bound to OS proc set {23}
OMP: pid 301902 tid 301902 thread 0 bound to OS proc set {10}
OMP: pid 301730 tid 301730 thread 0 bound to OS proc set {103}
OMP: pid 301881 tid 301881 thread 0 bound to OS proc set {90}
OMP: pid 301771 tid 301771 thread 0 bound to OS proc set {124}
OMP: pid 301859 tid 301859 thread 0 bound to OS proc set {106}
OMP: pid 301828 tid 301828 thread 0 bound to OS proc set {17}
OMP: pid 301729 tid 301729 thread 0 bound to OS proc set {58}
OMP: pid 301770 tid 301770 thread 0 bound to OS proc set {222}
OMP: pid 301769 tid 301769 thread 0 bound to OS proc set {160}
OMP: pid 301799 tid 301799 thread 0 bound to OS proc set {86}
OMP: pid 301764 tid 301764 thread 0 bound to OS proc set {110}
OMP: pid 301911 tid 301911 thread 0 bound to OS proc set {36}
OMP: pid 301926 tid 301926 thread 0 bound to OS proc set {240}
OMP: pid 301798 tid 301798 thread 0 bound to OS proc set {126}
OMP: pid 301766 tid 301766 thread 0 bound to OS proc set {159}
OMP: pid 301880 tid 301880 thread 0 bound to OS proc set {61}
OMP: pid 301925 tid 301925 thread 0 bound to OS proc set {148}
OMP: pid 301910 tid 301910 thread 0 bound to OS proc set {62}
OMP: pid 301783 tid 301783 thread 0 bound to OS proc set {75}
OMP: pid 301727 tid 301727 thread 0 bound to OS proc set {27}
OMP: pid 301861 tid 301861 thread 0 bound to OS proc set {119}
OMP: pid 301916 tid 301916 thread 0 bound to OS proc set {101}
OMP: pid 301759 tid 301759 thread 0 bound to OS proc set {38}
OMP: pid 301869 tid 301869 thread 0 bound to OS proc set {120}
OMP: pid 301733 tid 301733 thread 0 bound to OS proc set {116}
OMP: pid 301780 tid 301780 thread 0 bound to OS proc set {209}
OMP: pid 301867 tid 301867 thread 0 bound to OS proc set {69}
OMP: pid 301800 tid 301800 thread 0 bound to OS proc set {51}
OMP: pid 301767 tid 301767 thread 0 bound to OS proc set {150}
OMP: pid 301863 tid 301863 thread 0 bound to OS proc set {42}
OMP: pid 301749 tid 301749 thread 0 bound to OS proc set {162}
OMP: pid 301731 tid 301731 thread 0 bound to OS proc set {57}
OMP: pid 301864 tid 301864 thread 0 bound to OS proc set {143}
OMP: pid 301758 tid 301758 thread 0 bound to OS proc set {214}
OMP: pid 301762 tid 301762 thread 0 bound to OS proc set {151}
OMP: pid 301736 tid 301736 thread 0 bound to OS proc set {142}
OMP: pid 301804 tid 301804 thread 0 bound to OS proc set {71}
OMP: pid 301872 tid 301872 thread 0 bound to OS proc set {67}
OMP: pid 301875 tid 301875 thread 0 bound to OS proc set {96}
OMP: pid 301850 tid 301850 thread 0 bound to OS proc set {29}
OMP: pid 301849 tid 301849 thread 0 bound to OS proc set {26}
OMP: pid 301810 tid 301810 thread 0 bound to OS proc set {204}
OMP: pid 301822 tid 301822 thread 0 bound to OS proc set {154}
OMP: pid 301929 tid 301929 thread 0 bound to OS proc set {64}
OMP: pid 301932 tid 301932 thread 0 bound to OS proc set {85}
OMP: pid 301811 tid 301811 thread 0 bound to OS proc set {99}
OMP: pid 301773 tid 301773 thread 0 bound to OS proc set {20}
OMP: pid 301879 tid 301879 thread 0 bound to OS proc set {25}
OMP: pid 301917 tid 301917 thread 0 bound to OS proc set {40}
OMP: pid 301806 tid 301806 thread 0 bound to OS proc set {81}
OMP: pid 301737 tid 301737 thread 0 bound to OS proc set {22}
OMP: pid 301777 tid 301777 thread 0 bound to OS proc set {98}
OMP: pid 301809 tid 301809 thread 0 bound to OS proc set {186}
OMP: pid 301817 tid 301817 thread 0 bound to OS proc set {108}
OMP: pid 301897 tid 301897 thread 0 bound to OS proc set {230}
OMP: pid 301920 tid 301920 thread 0 bound to OS proc set {19}
OMP: pid 301726 tid 301726 thread 0 bound to OS proc set {39}
OMP: pid 301724 tid 301724 thread 0 bound to OS proc set {70}
OMP: pid 301890 tid 301890 thread 0 bound to OS proc set {30}
OMP: pid 301868 tid 301868 thread 0 bound to OS proc set {156}
OMP: pid 301924 tid 301924 thread 0 bound to OS proc set {183}
OMP: pid 301826 tid 301826 thread 0 bound to OS proc set {47}
OMP: pid 301818 tid 301818 thread 0 bound to OS proc set {168}
OMP: pid 301877 tid 301877 thread 0 bound to OS proc set {177}
OMP: pid 301765 tid 301765 thread 0 bound to OS proc set {79}
OMP: pid 301738 tid 301738 thread 0 bound to OS proc set {4}
OMP: pid 301860 tid 301860 thread 0 bound to OS proc set {8}
OMP: pid 301865 tid 301865 thread 0 bound to OS proc set {170}
OMP: pid 301857 tid 301857 thread 0 bound to OS proc set {250}
OMP: pid 301802 tid 301802 thread 0 bound to OS proc set {173}
OMP: pid 301873 tid 301873 thread 0 bound to OS proc set {72}
OMP: pid 301755 tid 301755 thread 0 bound to OS proc set {193}
OMP: pid 301831 tid 301831 thread 0 bound to OS proc set {246}
OMP: pid 301906 tid 301906 thread 0 bound to OS proc set {66}
OMP: pid 301819 tid 301819 thread 0 bound to OS proc set {104}
OMP: pid 301781 tid 301781 thread 0 bound to OS proc set {118}
OMP: pid 301791 tid 301791 thread 0 bound to OS proc set {128}
OMP: pid 301909 tid 301909 thread 0 bound to OS proc set {146}
OMP: pid 301853 tid 301853 thread 0 bound to OS proc set {21}
OMP: pid 301837 tid 301837 thread 0 bound to OS proc set {181}
OMP: pid 301745 tid 301745 thread 0 bound to OS proc set {195}
OMP: pid 301856 tid 301856 thread 0 bound to OS proc set {111}
OMP: pid 301874 tid 301874 thread 0 bound to OS proc set {185}
OMP: pid 301788 tid 301788 thread 0 bound to OS proc set {117}
OMP: pid 301774 tid 301774 thread 0 bound to OS proc set {105}
OMP: pid 301915 tid 301915 thread 0 bound to OS proc set {109}
OMP: pid 301839 tid 301839 thread 0 bound to OS proc set {216}
OMP: pid 301746 tid 301746 thread 0 bound to OS proc set {84}
OMP: pid 301808 tid 301808 thread 0 bound to OS proc set {113}
OMP: pid 301900 tid 301900 thread 0 bound to OS proc set {49}
OMP: pid 301843 tid 301843 thread 0 bound to OS proc set {235}
OMP: pid 301732 tid 301732 thread 0 bound to OS proc set {228}
OMP: pid 301787 tid 301787 thread 0 bound to OS proc set {202}
OMP: pid 301928 tid 301928 thread 0 bound to OS proc set {134}
OMP: pid 301901 tid 301901 thread 0 bound to OS proc set {88}
OMP: pid 301829 tid 301829 thread 0 bound to OS proc set {43}
OMP: pid 301760 tid 301760 thread 0 bound to OS proc set {59}
OMP: pid 301912 tid 301912 thread 0 bound to OS proc set {92}
OMP: pid 301884 tid 301884 thread 0 bound to OS proc set {252}
OMP: pid 301763 tid 301763 thread 0 bound to OS proc set {78}
OMP: pid 301739 tid 301739 thread 0 bound to OS proc set {153}
OMP: pid 301743 tid 301743 thread 0 bound to OS proc set {179}
OMP: pid 301904 tid 301904 thread 0 bound to OS proc set {145}
OMP: pid 301792 tid 301792 thread 0 bound to OS proc set {227}
OMP: pid 301814 tid 301814 thread 0 bound to OS proc set {122}
OMP: pid 301812 tid 301812 thread 0 bound to OS proc set {161}
OMP: pid 301768 tid 301768 thread 0 bound to OS proc set {244}
OMP: pid 301894 tid 301894 thread 0 bound to OS proc set {239}
OMP: pid 301934 tid 301934 thread 0 bound to OS proc set {167}
OMP: pid 301870 tid 301870 thread 0 bound to OS proc set {247}
OMP: pid 301832 tid 301832 thread 0 bound to OS proc set {238}
OMP: pid 301717 tid 301717 thread 0 bound to OS proc set {187}
OMP: pid 301845 tid 301845 thread 0 bound to OS proc set {224}
OMP: pid 301720 tid 301720 thread 0 bound to OS proc set {63}
OMP: pid 301751 tid 301751 thread 0 bound to OS proc set {251}
OMP: pid 301775 tid 301775 thread 0 bound to OS proc set {107}
OMP: pid 301813 tid 301813 thread 0 bound to OS proc set {207}
OMP: pid 301741 tid 301741 thread 0 bound to OS proc set {83}
OMP: pid 301789 tid 301789 thread 0 bound to OS proc set {229}
OMP: pid 301778 tid 301778 thread 0 bound to OS proc set {125}
OMP: pid 301825 tid 301825 thread 0 bound to OS proc set {76}
OMP: pid 301889 tid 301889 thread 0 bound to OS proc set {203}
OMP: pid 301876 tid 301876 thread 0 bound to OS proc set {198}
OMP: pid 301824 tid 301824 thread 0 bound to OS proc set {158}
OMP: pid 301851 tid 301851 thread 0 bound to OS proc set {236}
OMP: pid 301761 tid 301761 thread 0 bound to OS proc set {165}
OMP: pid 301842 tid 301842 thread 0 bound to OS proc set {0}
OMP: pid 301752 tid 301752 thread 0 bound to OS proc set {201}
OMP: pid 301887 tid 301887 thread 0 bound to OS proc set {241}
OMP: pid 301728 tid 301728 thread 0 bound to OS proc set {205}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 301795 tid 301795 thread 0 bound to OS proc set {232}
OMP: pid 301803 tid 301803 thread 0 bound to OS proc set {171}
OMP: pid 301923 tid 301923 thread 0 bound to OS proc set {190}
OMP: pid 301747 tid 301747 thread 0 bound to OS proc set {237}
OMP: pid 301807 tid 301807 thread 0 bound to OS proc set {191}
OMP: pid 301852 tid 301852 thread 0 bound to OS proc set {123}
OMP: pid 301772 tid 301772 thread 0 bound to OS proc set {200}
OMP: pid 301833 tid 301833 thread 0 bound to OS proc set {192}
OMP: pid 301888 tid 301888 thread 0 bound to OS proc set {60}
OMP: pid 301776 tid 301776 thread 0 bound to OS proc set {74}
OMP: pid 301905 tid 301905 thread 0 bound to OS proc set {121}
OMP: pid 301922 tid 301922 thread 0 bound to OS proc set {163}
OMP: pid 301914 tid 301914 thread 0 bound to OS proc set {245}
OMP: pid 301820 tid 301820 thread 0 bound to OS proc set {140}
OMP: pid 301930 tid 301930 thread 0 bound to OS proc set {208}
OMP: pid 301892 tid 301892 thread 0 bound to OS proc set {210}
OMP: pid 301796 tid 301796 thread 0 bound to OS proc set {73}
OMP: pid 301878 tid 301878 thread 0 bound to OS proc set {164}
OMP: pid 301895 tid 301895 thread 0 bound to OS proc set {199}
OMP: pid 301882 tid 301882 thread 0 bound to OS proc set {102}
OMP: pid 301757 tid 301757 thread 0 bound to OS proc set {144}
OMP: pid 301866 tid 301866 thread 0 bound to OS proc set {248}
OMP: pid 301841 tid 301841 thread 0 bound to OS proc set {35}
OMP: pid 301735 tid 301735 thread 0 bound to OS proc set {94}
OMP: pid 301927 tid 301927 thread 0 bound to OS proc set {194}
OMP: pid 301786 tid 301786 thread 0 bound to OS proc set {197}
OMP: pid 301862 tid 301862 thread 0 bound to OS proc set {242}
OMP: pid 301918 tid 301918 thread 0 bound to OS proc set {149}
OMP: pid 301742 tid 301742 thread 0 bound to OS proc set {100}
OMP: pid 301816 tid 301816 thread 0 bound to OS proc set {189}
OMP: pid 301883 tid 301883 thread 0 bound to OS proc set {218}
OMP: pid 301903 tid 301903 thread 0 bound to OS proc set {130}
OMP: pid 301893 tid 301893 thread 0 bound to OS proc set {188}
OMP: pid 301913 tid 301913 thread 0 bound to OS proc set {127}
OMP: pid 301846 tid 301846 thread 0 bound to OS proc set {243}
OMP: pid 301827 tid 301827 thread 0 bound to OS proc set {112}
OMP: pid 301725 tid 301725 thread 0 bound to OS proc set {249}
OMP: pid 301753 tid 301753 thread 0 bound to OS proc set {213}
OMP: pid 301830 tid 301830 thread 0 bound to OS proc set {226}
OMP: pid 301794 tid 301794 thread 0 bound to OS proc set {136}
OMP: pid 301931 tid 301931 thread 0 bound to OS proc set {175}
OMP: pid 301734 tid 301734 thread 0 bound to OS proc set {233}
OMP: pid 301823 tid 301823 thread 0 bound to OS proc set {157}
OMP: pid 301834 tid 301834 thread 0 bound to OS proc set {255}
OMP: pid 301744 tid 301744 thread 0 bound to OS proc set {206}
OMP: pid 301784 tid 301784 thread 0 bound to OS proc set {147}
OMP: pid 301750 tid 301750 thread 0 bound to OS proc set {155}
OMP: pid 301821 tid 301821 thread 0 bound to OS proc set {212}
OMP: pid 301844 tid 301844 thread 0 bound to OS proc set {234}
OMP: pid 301815 tid 301815 thread 0 bound to OS proc set {169}
OMP: pid 301716 tid 301716 thread 0 bound to OS proc set {138}
OMP: pid 301797 tid 301797 thread 0 bound to OS proc set {152}
OMP: pid 301779 tid 301779 thread 0 bound to OS proc set {166}
OMP: pid 301782 tid 301782 thread 0 bound to OS proc set {196}
OMP: pid 301886 tid 301886 thread 0 bound to OS proc set {220}
OMP: pid 301740 tid 301740 thread 0 bound to OS proc set {254}
OMP: pid 301838 tid 301838 thread 0 bound to OS proc set {253}
OMP: pid 301748 tid 301748 thread 0 bound to OS proc set {115}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
9 by 4 by 6 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.019 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1299 | 1326 | 1374 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.684257 on 216 procs for 10 steps with 32768000 atoms
Performance: 6.313 ns/day, 3.801 hours/ns, 14.614 timesteps/s, 478.885 Matom-step/s
98.8% CPU use with 216 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.47779 | 0.48898 | 0.5173 | 0.8 | 71.46
Neigh | 0.03182 | 0.032843 | 0.038368 | 0.3 | 4.80
Comm | 0.054055 | 0.068837 | 0.089757 | 2.5 | 10.06
Output | 0.0012935 | 0.0025186 | 0.0039054 | 1.4 | 0.37
Modify | 0.052469 | 0.070781 | 0.077992 | 1.8 | 10.34
Other | | 0.0203 | | | 2.97
Nlocal: 151704 ave 152940 max 150454 min
Histogram: 54 2 0 11 5 47 65 0 0 32
Nghost: 50705.1 ave 51895 max 48986 min
Histogram: 16 8 5 29 14 15 35 34 43 17
Neighs: 5.7104e+06 ave 5.78427e+06 max 5.66234e+06 min
Histogram: 55 1 53 19 0 16 39 17 0 16
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1299 | 1326 | 1374 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68646 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74785 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84598 -1.1257917e+08 0 -1.0919981e+08 51536.933
500 797.72449 -1.1257864e+08 0 -1.091998e+08 51543.024
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.152
Loop time of 36.3182 on 216 procs for 500 steps with 32768000 atoms
Performance: 5.947 ns/day, 4.035 hours/ns, 13.767 timesteps/s, 451.123 Matom-step/s
99.0% CPU use with 216 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 24.429 | 24.874 | 26.016 | 4.1 | 68.49
Neigh | 2.7386 | 2.7843 | 3.2636 | 2.6 | 7.67
Comm | 3.5426 | 4.1504 | 5.2385 | 16.1 | 11.43
Output | 0.017485 | 0.029875 | 0.048547 | 4.4 | 0.08
Modify | 2.5166 | 3.5956 | 3.9467 | 16.0 | 9.90
Other | | 0.8837 | | | 2.43
Nlocal: 151704 ave 153166 max 150185 min
Histogram: 14 39 3 6 14 48 51 10 14 17
Nghost: 50619.1 ave 52048 max 48786 min
Histogram: 8 15 21 23 6 25 40 43 30 5
Neighs: 5.72637e+06 ave 5.80671e+06 max 5.66821e+06 min
Histogram: 21 33 23 45 10 15 31 21 7 10
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747091
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:37
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_7 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 240 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 306291 isix04.benchmarkcenter.megware.com {0-1,256-257}
[0] MPI startup(): 1 306367 isix04.benchmarkcenter.megware.com {2-3,258-259}
[0] MPI startup(): 2 306226 isix04.benchmarkcenter.megware.com {4-5,260-261}
[0] MPI startup(): 3 306292 isix04.benchmarkcenter.megware.com {6,262}
[0] MPI startup(): 4 306361 isix04.benchmarkcenter.megware.com {7,263}
[0] MPI startup(): 5 306324 isix04.benchmarkcenter.megware.com {8,264}
[0] MPI startup(): 6 306210 isix04.benchmarkcenter.megware.com {9,265}
[0] MPI startup(): 7 306241 isix04.benchmarkcenter.megware.com {10,266}
[0] MPI startup(): 8 306384 isix04.benchmarkcenter.megware.com {11,267}
[0] MPI startup(): 9 306409 isix04.benchmarkcenter.megware.com {12,268}
[0] MPI startup(): 10 306397 isix04.benchmarkcenter.megware.com {13,269}
[0] MPI startup(): 11 306244 isix04.benchmarkcenter.megware.com {14,270}
[0] MPI startup(): 12 306400 isix04.benchmarkcenter.megware.com {15,271}
[0] MPI startup(): 13 306432 isix04.benchmarkcenter.megware.com {16,272}
[0] MPI startup(): 14 306396 isix04.benchmarkcenter.megware.com {17,273}
[0] MPI startup(): 15 306380 isix04.benchmarkcenter.megware.com {18,274}
[0] MPI startup(): 16 306341 isix04.benchmarkcenter.megware.com {19,275}
[0] MPI startup(): 17 306422 isix04.benchmarkcenter.megware.com {20,276}
[0] MPI startup(): 18 306307 isix04.benchmarkcenter.megware.com {21,277}
[0] MPI startup(): 19 306419 isix04.benchmarkcenter.megware.com {22,278}
[0] MPI startup(): 20 306293 isix04.benchmarkcenter.megware.com {23,279}
[0] MPI startup(): 21 306255 isix04.benchmarkcenter.megware.com {24,280}
[0] MPI startup(): 22 306333 isix04.benchmarkcenter.megware.com {25,281}
[0] MPI startup(): 23 306294 isix04.benchmarkcenter.megware.com {26,282}
[0] MPI startup(): 24 306213 isix04.benchmarkcenter.megware.com {27,283}
[0] MPI startup(): 25 306388 isix04.benchmarkcenter.megware.com {28,284}
[0] MPI startup(): 26 306448 isix04.benchmarkcenter.megware.com {29,285}
[0] MPI startup(): 27 306349 isix04.benchmarkcenter.megware.com {30,286}
[0] MPI startup(): 28 306323 isix04.benchmarkcenter.megware.com {31,287}
[0] MPI startup(): 29 306229 isix04.benchmarkcenter.megware.com {32,288}
[0] MPI startup(): 30 306379 isix04.benchmarkcenter.megware.com {33,289}
[0] MPI startup(): 31 306365 isix04.benchmarkcenter.megware.com {34,290}
[0] MPI startup(): 32 306431 isix04.benchmarkcenter.megware.com {35,291}
[0] MPI startup(): 33 306310 isix04.benchmarkcenter.megware.com {36,292}
[0] MPI startup(): 34 306222 isix04.benchmarkcenter.megware.com {37,293}
[0] MPI startup(): 35 306262 isix04.benchmarkcenter.megware.com {38,294}
[0] MPI startup(): 36 306208 isix04.benchmarkcenter.megware.com {39,295}
[0] MPI startup(): 37 306345 isix04.benchmarkcenter.megware.com {40,296}
[0] MPI startup(): 38 306219 isix04.benchmarkcenter.megware.com {41,297}
[0] MPI startup(): 39 306207 isix04.benchmarkcenter.megware.com {42,298}
[0] MPI startup(): 40 306275 isix04.benchmarkcenter.megware.com {43-44,299-300}
[0] MPI startup(): 41 306283 isix04.benchmarkcenter.megware.com {45-46,301-302}
[0] MPI startup(): 42 306407 isix04.benchmarkcenter.megware.com {47-48,303-304}
[0] MPI startup(): 43 306248 isix04.benchmarkcenter.megware.com {49,305}
[0] MPI startup(): 44 306289 isix04.benchmarkcenter.megware.com {50,306}
[0] MPI startup(): 45 306421 isix04.benchmarkcenter.megware.com {51,307}
[0] MPI startup(): 46 306447 isix04.benchmarkcenter.megware.com {52,308}
[0] MPI startup(): 47 306404 isix04.benchmarkcenter.megware.com {53,309}
[0] MPI startup(): 48 306317 isix04.benchmarkcenter.megware.com {54,310}
[0] MPI startup(): 49 306296 isix04.benchmarkcenter.megware.com {55,311}
[0] MPI startup(): 50 306297 isix04.benchmarkcenter.megware.com {56,312}
[0] MPI startup(): 51 306251 isix04.benchmarkcenter.megware.com {57,313}
[0] MPI startup(): 52 306339 isix04.benchmarkcenter.megware.com {58,314}
[0] MPI startup(): 53 306416 isix04.benchmarkcenter.megware.com {59,315}
[0] MPI startup(): 54 306403 isix04.benchmarkcenter.megware.com {60,316}
[0] MPI startup(): 55 306359 isix04.benchmarkcenter.megware.com {61,317}
[0] MPI startup(): 56 306214 isix04.benchmarkcenter.megware.com {62,318}
[0] MPI startup(): 57 306282 isix04.benchmarkcenter.megware.com {63,319}
[0] MPI startup(): 58 306368 isix04.benchmarkcenter.megware.com {64,320}
[0] MPI startup(): 59 306217 isix04.benchmarkcenter.megware.com {65,321}
[0] MPI startup(): 60 306371 isix04.benchmarkcenter.megware.com {66,322}
[0] MPI startup(): 61 306378 isix04.benchmarkcenter.megware.com {67,323}
[0] MPI startup(): 62 306391 isix04.benchmarkcenter.megware.com {68,324}
[0] MPI startup(): 63 306225 isix04.benchmarkcenter.megware.com {69,325}
[0] MPI startup(): 64 306224 isix04.benchmarkcenter.megware.com {70,326}
[0] MPI startup(): 65 306369 isix04.benchmarkcenter.megware.com {71,327}
[0] MPI startup(): 66 306284 isix04.benchmarkcenter.megware.com {72,328}
[0] MPI startup(): 67 306423 isix04.benchmarkcenter.megware.com {73,329}
[0] MPI startup(): 68 306264 isix04.benchmarkcenter.megware.com {74,330}
[0] MPI startup(): 69 306295 isix04.benchmarkcenter.megware.com {75,331}
[0] MPI startup(): 70 306247 isix04.benchmarkcenter.megware.com {76,332}
[0] MPI startup(): 71 306376 isix04.benchmarkcenter.megware.com {77,333}
[0] MPI startup(): 72 306228 isix04.benchmarkcenter.megware.com {78,334}
[0] MPI startup(): 73 306233 isix04.benchmarkcenter.megware.com {79,335}
[0] MPI startup(): 74 306256 isix04.benchmarkcenter.megware.com {80,336}
[0] MPI startup(): 75 306276 isix04.benchmarkcenter.megware.com {81,337}
[0] MPI startup(): 76 306435 isix04.benchmarkcenter.megware.com {82,338}
[0] MPI startup(): 77 306438 isix04.benchmarkcenter.megware.com {83,339}
[0] MPI startup(): 78 306394 isix04.benchmarkcenter.megware.com {84,340}
[0] MPI startup(): 79 306442 isix04.benchmarkcenter.megware.com {85,341}
[0] MPI startup(): 80 306366 isix04.benchmarkcenter.megware.com {86-87,342-343}
[0] MPI startup(): 81 306290 isix04.benchmarkcenter.megware.com {88-89,344-345}
[0] MPI startup(): 82 306439 isix04.benchmarkcenter.megware.com {90,346}
[0] MPI startup(): 83 306311 isix04.benchmarkcenter.megware.com {91,347}
[0] MPI startup(): 84 306377 isix04.benchmarkcenter.megware.com {92,348}
[0] MPI startup(): 85 306216 isix04.benchmarkcenter.megware.com {93,349}
[0] MPI startup(): 86 306280 isix04.benchmarkcenter.megware.com {94,350}
[0] MPI startup(): 87 306373 isix04.benchmarkcenter.megware.com {95,351}
[0] MPI startup(): 88 306387 isix04.benchmarkcenter.megware.com {96,352}
[0] MPI startup(): 89 306309 isix04.benchmarkcenter.megware.com {97,353}
[0] MPI startup(): 90 306329 isix04.benchmarkcenter.megware.com {98,354}
[0] MPI startup(): 91 306268 isix04.benchmarkcenter.megware.com {99,355}
[0] MPI startup(): 92 306261 isix04.benchmarkcenter.megware.com {100,356}
[0] MPI startup(): 93 306399 isix04.benchmarkcenter.megware.com {101,357}
[0] MPI startup(): 94 306267 isix04.benchmarkcenter.megware.com {102,358}
[0] MPI startup(): 95 306265 isix04.benchmarkcenter.megware.com {103,359}
[0] MPI startup(): 96 306250 isix04.benchmarkcenter.megware.com {104,360}
[0] MPI startup(): 97 306313 isix04.benchmarkcenter.megware.com {105,361}
[0] MPI startup(): 98 306433 isix04.benchmarkcenter.megware.com {106,362}
[0] MPI startup(): 99 306243 isix04.benchmarkcenter.megware.com {107,363}
[0] MPI startup(): 100 306358 isix04.benchmarkcenter.megware.com {108,364}
[0] MPI startup(): 101 306434 isix04.benchmarkcenter.megware.com {109,365}
[0] MPI startup(): 102 306258 isix04.benchmarkcenter.megware.com {110,366}
[0] MPI startup(): 103 306308 isix04.benchmarkcenter.megware.com {111,367}
[0] MPI startup(): 104 306337 isix04.benchmarkcenter.megware.com {112,368}
[0] MPI startup(): 105 306372 isix04.benchmarkcenter.megware.com {113,369}
[0] MPI startup(): 106 306299 isix04.benchmarkcenter.megware.com {114,370}
[0] MPI startup(): 107 306390 isix04.benchmarkcenter.megware.com {115,371}
[0] MPI startup(): 108 306240 isix04.benchmarkcenter.megware.com {116,372}
[0] MPI startup(): 109 306364 isix04.benchmarkcenter.megware.com {117,373}
[0] MPI startup(): 110 306274 isix04.benchmarkcenter.megware.com {118,374}
[0] MPI startup(): 111 306383 isix04.benchmarkcenter.megware.com {119,375}
[0] MPI startup(): 112 306351 isix04.benchmarkcenter.megware.com {120,376}
[0] MPI startup(): 113 306304 isix04.benchmarkcenter.megware.com {121,377}
[0] MPI startup(): 114 306420 isix04.benchmarkcenter.megware.com {122,378}
[0] MPI startup(): 115 306302 isix04.benchmarkcenter.megware.com {123,379}
[0] MPI startup(): 116 306395 isix04.benchmarkcenter.megware.com {124,380}
[0] MPI startup(): 117 306330 isix04.benchmarkcenter.megware.com {125,381}
[0] MPI startup(): 118 306375 isix04.benchmarkcenter.megware.com {126,382}
[0] MPI startup(): 119 306236 isix04.benchmarkcenter.megware.com {127,383}
[0] MPI startup(): 120 306266 isix04.benchmarkcenter.megware.com {128-129,384-385}
[0] MPI startup(): 121 306314 isix04.benchmarkcenter.megware.com {130-131,386-387}
[0] MPI startup(): 122 306320 isix04.benchmarkcenter.megware.com {132-133,388-389}
[0] MPI startup(): 123 306362 isix04.benchmarkcenter.megware.com {134,390}
[0] MPI startup(): 124 306271 isix04.benchmarkcenter.megware.com {135,391}
[0] MPI startup(): 125 306277 isix04.benchmarkcenter.megware.com {136,392}
[0] MPI startup(): 126 306272 isix04.benchmarkcenter.megware.com {137,393}
[0] MPI startup(): 127 306392 isix04.benchmarkcenter.megware.com {138,394}
[0] MPI startup(): 128 306254 isix04.benchmarkcenter.megware.com {139,395}
[0] MPI startup(): 129 306412 isix04.benchmarkcenter.megware.com {140,396}
[0] MPI startup(): 130 306411 isix04.benchmarkcenter.megware.com {141,397}
[0] MPI startup(): 131 306331 isix04.benchmarkcenter.megware.com {142,398}
[0] MPI startup(): 132 306440 isix04.benchmarkcenter.megware.com {143,399}
[0] MPI startup(): 133 306382 isix04.benchmarkcenter.megware.com {144,400}
[0] MPI startup(): 134 306249 isix04.benchmarkcenter.megware.com {145,401}
[0] MPI startup(): 135 306443 isix04.benchmarkcenter.megware.com {146,402}
[0] MPI startup(): 136 306357 isix04.benchmarkcenter.megware.com {147,403}
[0] MPI startup(): 137 306346 isix04.benchmarkcenter.megware.com {148,404}
[0] MPI startup(): 138 306298 isix04.benchmarkcenter.megware.com {149,405}
[0] MPI startup(): 139 306381 isix04.benchmarkcenter.megware.com {150,406}
[0] MPI startup(): 140 306426 isix04.benchmarkcenter.megware.com {151,407}
[0] MPI startup(): 141 306288 isix04.benchmarkcenter.megware.com {152,408}
[0] MPI startup(): 142 306245 isix04.benchmarkcenter.megware.com {153,409}
[0] MPI startup(): 143 306393 isix04.benchmarkcenter.megware.com {154,410}
[0] MPI startup(): 144 306343 isix04.benchmarkcenter.megware.com {155,411}
[0] MPI startup(): 145 306424 isix04.benchmarkcenter.megware.com {156,412}
[0] MPI startup(): 146 306363 isix04.benchmarkcenter.megware.com {157,413}
[0] MPI startup(): 147 306444 isix04.benchmarkcenter.megware.com {158,414}
[0] MPI startup(): 148 306336 isix04.benchmarkcenter.megware.com {159,415}
[0] MPI startup(): 149 306237 isix04.benchmarkcenter.megware.com {160,416}
[0] MPI startup(): 150 306287 isix04.benchmarkcenter.megware.com {161,417}
[0] MPI startup(): 151 306445 isix04.benchmarkcenter.megware.com {162,418}
[0] MPI startup(): 152 306286 isix04.benchmarkcenter.megware.com {163,419}
[0] MPI startup(): 153 306418 isix04.benchmarkcenter.megware.com {164,420}
[0] MPI startup(): 154 306436 isix04.benchmarkcenter.megware.com {165,421}
[0] MPI startup(): 155 306415 isix04.benchmarkcenter.megware.com {166,422}
[0] MPI startup(): 156 306385 isix04.benchmarkcenter.megware.com {167,423}
[0] MPI startup(): 157 306437 isix04.benchmarkcenter.megware.com {168,424}
[0] MPI startup(): 158 306259 isix04.benchmarkcenter.megware.com {169,425}
[0] MPI startup(): 159 306386 isix04.benchmarkcenter.megware.com {170,426}
[0] MPI startup(): 160 306279 isix04.benchmarkcenter.megware.com {171-172,427-428}
[0] MPI startup(): 161 306401 isix04.benchmarkcenter.megware.com {173-174,429-430}
[0] MPI startup(): 162 306281 isix04.benchmarkcenter.megware.com {175-176,431-432}
[0] MPI startup(): 163 306350 isix04.benchmarkcenter.megware.com {177,433}
[0] MPI startup(): 164 306301 isix04.benchmarkcenter.megware.com {178,434}
[0] MPI startup(): 165 306227 isix04.benchmarkcenter.megware.com {179,435}
[0] MPI startup(): 166 306328 isix04.benchmarkcenter.megware.com {180,436}
[0] MPI startup(): 167 306305 isix04.benchmarkcenter.megware.com {181,437}
[0] MPI startup(): 168 306318 isix04.benchmarkcenter.megware.com {182,438}
[0] MPI startup(): 169 306232 isix04.benchmarkcenter.megware.com {183,439}
[0] MPI startup(): 170 306325 isix04.benchmarkcenter.megware.com {184,440}
[0] MPI startup(): 171 306321 isix04.benchmarkcenter.megware.com {185,441}
[0] MPI startup(): 172 306414 isix04.benchmarkcenter.megware.com {186,442}
[0] MPI startup(): 173 306220 isix04.benchmarkcenter.megware.com {187,443}
[0] MPI startup(): 174 306348 isix04.benchmarkcenter.megware.com {188,444}
[0] MPI startup(): 175 306221 isix04.benchmarkcenter.megware.com {189,445}
[0] MPI startup(): 176 306352 isix04.benchmarkcenter.megware.com {190,446}
[0] MPI startup(): 177 306326 isix04.benchmarkcenter.megware.com {191,447}
[0] MPI startup(): 178 306335 isix04.benchmarkcenter.megware.com {192,448}
[0] MPI startup(): 179 306239 isix04.benchmarkcenter.megware.com {193,449}
[0] MPI startup(): 180 306285 isix04.benchmarkcenter.megware.com {194,450}
[0] MPI startup(): 181 306260 isix04.benchmarkcenter.megware.com {195,451}
[0] MPI startup(): 182 306231 isix04.benchmarkcenter.megware.com {196,452}
[0] MPI startup(): 183 306405 isix04.benchmarkcenter.megware.com {197,453}
[0] MPI startup(): 184 306306 isix04.benchmarkcenter.megware.com {198,454}
[0] MPI startup(): 185 306327 isix04.benchmarkcenter.megware.com {199,455}
[0] MPI startup(): 186 306374 isix04.benchmarkcenter.megware.com {200,456}
[0] MPI startup(): 187 306347 isix04.benchmarkcenter.megware.com {201,457}
[0] MPI startup(): 188 306257 isix04.benchmarkcenter.megware.com {202,458}
[0] MPI startup(): 189 306427 isix04.benchmarkcenter.megware.com {203,459}
[0] MPI startup(): 190 306278 isix04.benchmarkcenter.megware.com {204,460}
[0] MPI startup(): 191 306413 isix04.benchmarkcenter.megware.com {205,461}
[0] MPI startup(): 192 306425 isix04.benchmarkcenter.megware.com {206,462}
[0] MPI startup(): 193 306246 isix04.benchmarkcenter.megware.com {207,463}
[0] MPI startup(): 194 306238 isix04.benchmarkcenter.megware.com {208,464}
[0] MPI startup(): 195 306253 isix04.benchmarkcenter.megware.com {209,465}
[0] MPI startup(): 196 306303 isix04.benchmarkcenter.megware.com {210,466}
[0] MPI startup(): 197 306215 isix04.benchmarkcenter.megware.com {211,467}
[0] MPI startup(): 198 306218 isix04.benchmarkcenter.megware.com {212,468}
[0] MPI startup(): 199 306342 isix04.benchmarkcenter.megware.com {213,469}
[0] MPI startup(): 200 306353 isix04.benchmarkcenter.megware.com {214-215,470-471}
[0] MPI startup(): 201 306441 isix04.benchmarkcenter.megware.com {216-217,472-473}
[0] MPI startup(): 202 306230 isix04.benchmarkcenter.megware.com {218,474}
[0] MPI startup(): 203 306242 isix04.benchmarkcenter.megware.com {219,475}
[0] MPI startup(): 204 306449 isix04.benchmarkcenter.megware.com {220,476}
[0] MPI startup(): 205 306356 isix04.benchmarkcenter.megware.com {221,477}
[0] MPI startup(): 206 306355 isix04.benchmarkcenter.megware.com {222,478}
[0] MPI startup(): 207 306344 isix04.benchmarkcenter.megware.com {223,479}
[0] MPI startup(): 208 306334 isix04.benchmarkcenter.megware.com {224,480}
[0] MPI startup(): 209 306340 isix04.benchmarkcenter.megware.com {225,481}
[0] MPI startup(): 210 306354 isix04.benchmarkcenter.megware.com {226,482}
[0] MPI startup(): 211 306406 isix04.benchmarkcenter.megware.com {227,483}
[0] MPI startup(): 212 306269 isix04.benchmarkcenter.megware.com {228,484}
[0] MPI startup(): 213 306430 isix04.benchmarkcenter.megware.com {229,485}
[0] MPI startup(): 214 306389 isix04.benchmarkcenter.megware.com {230,486}
[0] MPI startup(): 215 306428 isix04.benchmarkcenter.megware.com {231,487}
[0] MPI startup(): 216 306398 isix04.benchmarkcenter.megware.com {232,488}
[0] MPI startup(): 217 306410 isix04.benchmarkcenter.megware.com {233,489}
[0] MPI startup(): 218 306316 isix04.benchmarkcenter.megware.com {234,490}
[0] MPI startup(): 219 306402 isix04.benchmarkcenter.megware.com {235,491}
[0] MPI startup(): 220 306322 isix04.benchmarkcenter.megware.com {236,492}
[0] MPI startup(): 221 306446 isix04.benchmarkcenter.megware.com {237,493}
[0] MPI startup(): 222 306338 isix04.benchmarkcenter.megware.com {238,494}
[0] MPI startup(): 223 306235 isix04.benchmarkcenter.megware.com {239,495}
[0] MPI startup(): 224 306360 isix04.benchmarkcenter.megware.com {240,496}
[0] MPI startup(): 225 306300 isix04.benchmarkcenter.megware.com {241,497}
[0] MPI startup(): 226 306450 isix04.benchmarkcenter.megware.com {242,498}
[0] MPI startup(): 227 306451 isix04.benchmarkcenter.megware.com {243,499}
[0] MPI startup(): 228 306429 isix04.benchmarkcenter.megware.com {244,500}
[0] MPI startup(): 229 306408 isix04.benchmarkcenter.megware.com {245,501}
[0] MPI startup(): 230 306417 isix04.benchmarkcenter.megware.com {246,502}
[0] MPI startup(): 231 306252 isix04.benchmarkcenter.megware.com {247,503}
[0] MPI startup(): 232 306332 isix04.benchmarkcenter.megware.com {248,504}
[0] MPI startup(): 233 306263 isix04.benchmarkcenter.megware.com {249,505}
[0] MPI startup(): 234 306315 isix04.benchmarkcenter.megware.com {250,506}
[0] MPI startup(): 235 306319 isix04.benchmarkcenter.megware.com {251,507}
[0] MPI startup(): 236 306370 isix04.benchmarkcenter.megware.com {252,508}
[0] MPI startup(): 237 306234 isix04.benchmarkcenter.megware.com {253,509}
[0] MPI startup(): 238 306223 isix04.benchmarkcenter.megware.com {254,510}
[0] MPI startup(): 239 306270 isix04.benchmarkcenter.megware.com {255,511}
OMP: pid 306419 tid 306419 thread 0 bound to OS proc set {22}
OMP: pid 306255 tid 306255 thread 0 bound to OS proc set {24}
OMP: pid 306294 tid 306294 thread 0 bound to OS proc set {26}
OMP: pid 306213 tid 306213 thread 0 bound to OS proc set {27}
OMP: pid 306333 tid 306333 thread 0 bound to OS proc set {25}
OMP: pid 306341 tid 306341 thread 0 bound to OS proc set {19}
OMP: pid 306292 tid 306292 thread 0 bound to OS proc set {6}
OMP: pid 306384 tid 306384 thread 0 bound to OS proc set {11}
OMP: pid 306409 tid 306409 thread 0 bound to OS proc set {12}
OMP: pid 306349 tid 306349 thread 0 bound to OS proc set {30}
OMP: pid 306396 tid 306396 thread 0 bound to OS proc set {17}
OMP: pid 306432 tid 306432 thread 0 bound to OS proc set {16}
OMP: pid 306345 tid 306345 thread 0 bound to OS proc set {40}
OMP: pid 306222 tid 306222 thread 0 bound to OS proc set {37}
OMP: pid 306422 tid 306422 thread 0 bound to OS proc set {20}
OMP: pid 306397 tid 306397 thread 0 bound to OS proc set {13}
OMP: pid 306244 tid 306244 thread 0 bound to OS proc set {14}
OMP: pid 306380 tid 306380 thread 0 bound to OS proc set {18}
OMP: pid 306324 tid 306324 thread 0 bound to OS proc set {8}
OMP: pid 306219 tid 306219 thread 0 bound to OS proc set {41}
OMP: pid 306262 tid 306262 thread 0 bound to OS proc set {38}
OMP: pid 306251 tid 306251 thread 0 bound to OS proc set {57}
OMP: pid 306264 tid 306264 thread 0 bound to OS proc set {74}
OMP: pid 306210 tid 306210 thread 0 bound to OS proc set {9}
OMP: pid 306359 tid 306359 thread 0 bound to OS proc set {61}
OMP: pid 306323 tid 306323 thread 0 bound to OS proc set {31}
OMP: pid 306448 tid 306448 thread 0 bound to OS proc set {29}
OMP: pid 306214 tid 306214 thread 0 bound to OS proc set {62}
OMP: pid 306289 tid 306289 thread 0 bound to OS proc set {50}
OMP: pid 306379 tid 306379 thread 0 bound to OS proc set {33}
OMP: pid 306226 tid 306226 thread 0 bound to OS proc set {4}
OMP: pid 306228 tid 306228 thread 0 bound to OS proc set {78}
OMP: pid 306447 tid 306447 thread 0 bound to OS proc set {52}
OMP: pid 306309 tid 306309 thread 0 bound to OS proc set {97}
OMP: pid 306365 tid 306365 thread 0 bound to OS proc set {34}
OMP: pid 306369 tid 306369 thread 0 bound to OS proc set {71}
OMP: pid 306217 tid 306217 thread 0 bound to OS proc set {65}
OMP: pid 306400 tid 306400 thread 0 bound to OS proc set {15}
OMP: pid 306296 tid 306296 thread 0 bound to OS proc set {55}
OMP: pid 306403 tid 306403 thread 0 bound to OS proc set {60}
OMP: pid 306247 tid 306247 thread 0 bound to OS proc set {76}
OMP: pid 306282 tid 306282 thread 0 bound to OS proc set {63}
OMP: pid 306318 tid 306318 thread 0 bound to OS proc set {182}
OMP: pid 306229 tid 306229 thread 0 bound to OS proc set {32}
OMP: pid 306423 tid 306423 thread 0 bound to OS proc set {73}
OMP: pid 306348 tid 306348 thread 0 bound to OS proc set {188}
OMP: pid 306293 tid 306293 thread 0 bound to OS proc set {23}
OMP: pid 306241 tid 306241 thread 0 bound to OS proc set {10}
OMP: pid 306220 tid 306220 thread 0 bound to OS proc set {187}
OMP: pid 306347 tid 306347 thread 0 bound to OS proc set {201}
OMP: pid 306283 tid 306283 thread 0 bound to OS proc set {45}
OMP: pid 306389 tid 306389 thread 0 bound to OS proc set {230}
OMP: pid 306393 tid 306393 thread 0 bound to OS proc set {154}
OMP: pid 306438 tid 306438 thread 0 bound to OS proc set {83}
OMP: pid 306361 tid 306361 thread 0 bound to OS proc set {7}
OMP: pid 306431 tid 306431 thread 0 bound to OS proc set {35}
OMP: pid 306368 tid 306368 thread 0 bound to OS proc set {64}
OMP: pid 306381 tid 306381 thread 0 bound to OS proc set {150}
OMP: pid 306245 tid 306245 thread 0 bound to OS proc set {153}
OMP: pid 306248 tid 306248 thread 0 bound to OS proc set {49}
OMP: pid 306404 tid 306404 thread 0 bound to OS proc set {53}
OMP: pid 306267 tid 306267 thread 0 bound to OS proc set {102}
OMP: pid 306358 tid 306358 thread 0 bound to OS proc set {108}
OMP: pid 306416 tid 306416 thread 0 bound to OS proc set {59}
OMP: pid 306362 tid 306362 thread 0 bound to OS proc set {134}
OMP: pid 306388 tid 306388 thread 0 bound to OS proc set {28}
OMP: pid 306371 tid 306371 thread 0 bound to OS proc set {66}
OMP: pid 306313 tid 306313 thread 0 bound to OS proc set {105}
OMP: pid 306310 tid 306310 thread 0 bound to OS proc set {36}
OMP: pid 306208 tid 306208 thread 0 bound to OS proc set {39}
OMP: pid 306352 tid 306352 thread 0 bound to OS proc set {190}
OMP: pid 306339 tid 306339 thread 0 bound to OS proc set {58}
OMP: pid 306256 tid 306256 thread 0 bound to OS proc set {80}
OMP: pid 306407 tid 306407 thread 0 bound to OS proc set {47}
OMP: pid 306415 tid 306415 thread 0 bound to OS proc set {166}
OMP: pid 306343 tid 306343 thread 0 bound to OS proc set {155}
OMP: pid 306414 tid 306414 thread 0 bound to OS proc set {186}
OMP: pid 306442 tid 306442 thread 0 bound to OS proc set {85}
OMP: pid 306290 tid 306290 thread 0 bound to OS proc set {88}
OMP: pid 306275 tid 306275 thread 0 bound to OS proc set {43}
OMP: pid 306224 tid 306224 thread 0 bound to OS proc set {70}
OMP: pid 306392 tid 306392 thread 0 bound to OS proc set {138}
OMP: pid 306420 tid 306420 thread 0 bound to OS proc set {122}
OMP: pid 306246 tid 306246 thread 0 bound to OS proc set {207}
OMP: pid 306378 tid 306378 thread 0 bound to OS proc set {67}
OMP: pid 306268 tid 306268 thread 0 bound to OS proc set {99}
OMP: pid 306269 tid 306269 thread 0 bound to OS proc set {228}
OMP: pid 306297 tid 306297 thread 0 bound to OS proc set {56}
OMP: pid 306367 tid 306367 thread 0 bound to OS proc set {2}
OMP: pid 306435 tid 306435 thread 0 bound to OS proc set {82}
OMP: pid 306207 tid 306207 thread 0 bound to OS proc set {42}
OMP: pid 306295 tid 306295 thread 0 bound to OS proc set {75}
OMP: pid 306260 tid 306260 thread 0 bound to OS proc set {195}
OMP: pid 306445 tid 306445 thread 0 bound to OS proc set {162}
OMP: pid 306249 tid 306249 thread 0 bound to OS proc set {145}
OMP: pid 306375 tid 306375 thread 0 bound to OS proc set {126}
OMP: pid 306357 tid 306357 thread 0 bound to OS proc set {147}
OMP: pid 306266 tid 306266 thread 0 bound to OS proc set {128}
OMP: pid 306277 tid 306277 thread 0 bound to OS proc set {136}
OMP: pid 306221 tid 306221 thread 0 bound to OS proc set {189}
OMP: pid 306426 tid 306426 thread 0 bound to OS proc set {151}
OMP: pid 306330 tid 306330 thread 0 bound to OS proc set {125}
OMP: pid 306385 tid 306385 thread 0 bound to OS proc set {167}
OMP: pid 306390 tid 306390 thread 0 bound to OS proc set {115}
OMP: pid 306317 tid 306317 thread 0 bound to OS proc set {54}
OMP: pid 306227 tid 306227 thread 0 bound to OS proc set {179}
OMP: pid 306286 tid 306286 thread 0 bound to OS proc set {163}
OMP: pid 306386 tid 306386 thread 0 bound to OS proc set {170}
OMP: pid 306280 tid 306280 thread 0 bound to OS proc set {94}
OMP: pid 306412 tid 306412 thread 0 bound to OS proc set {140}
OMP: pid 306436 tid 306436 thread 0 bound to OS proc set {165}
OMP: pid 306399 tid 306399 thread 0 bound to OS proc set {101}
OMP: pid 306434 tid 306434 thread 0 bound to OS proc set {109}
OMP: pid 306301 tid 306301 thread 0 bound to OS proc set {178}
OMP: pid 306421 tid 306421 thread 0 bound to OS proc set {51}
OMP: pid 306433 tid 306433 thread 0 bound to OS proc set {106}
OMP: pid 306216 tid 306216 thread 0 bound to OS proc set {93}
OMP: pid 306252 tid 306252 thread 0 bound to OS proc set {247}
OMP: pid 306233 tid 306233 thread 0 bound to OS proc set {79}
OMP: pid 306350 tid 306350 thread 0 bound to OS proc set {177}
OMP: pid 306387 tid 306387 thread 0 bound to OS proc set {96}
OMP: pid 306265 tid 306265 thread 0 bound to OS proc set {103}
OMP: pid 306353 tid 306353 thread 0 bound to OS proc set {214}
OMP: pid 306427 tid 306427 thread 0 bound to OS proc set {203}
OMP: pid 306329 tid 306329 thread 0 bound to OS proc set {98}
OMP: pid 306236 tid 306236 thread 0 bound to OS proc set {127}
OMP: pid 306376 tid 306376 thread 0 bound to OS proc set {77}
OMP: pid 306356 tid 306356 thread 0 bound to OS proc set {221}
OMP: pid 306437 tid 306437 thread 0 bound to OS proc set {168}
OMP: pid 306441 tid 306441 thread 0 bound to OS proc set {216}
OMP: pid 306364 tid 306364 thread 0 bound to OS proc set {117}
OMP: pid 306271 tid 306271 thread 0 bound to OS proc set {135}
OMP: pid 306307 tid 306307 thread 0 bound to OS proc set {21}
OMP: pid 306287 tid 306287 thread 0 bound to OS proc set {161}
OMP: pid 306413 tid 306413 thread 0 bound to OS proc set {205}
OMP: pid 306258 tid 306258 thread 0 bound to OS proc set {110}
OMP: pid 306443 tid 306443 thread 0 bound to OS proc set {146}
OMP: pid 306272 tid 306272 thread 0 bound to OS proc set {137}
OMP: pid 306259 tid 306259 thread 0 bound to OS proc set {169}
OMP: pid 306411 tid 306411 thread 0 bound to OS proc set {141}
OMP: pid 306335 tid 306335 thread 0 bound to OS proc set {192}
OMP: pid 306373 tid 306373 thread 0 bound to OS proc set {95}
OMP: pid 306225 tid 306225 thread 0 bound to OS proc set {69}
OMP: pid 306366 tid 306366 thread 0 bound to OS proc set {86}
OMP: pid 306218 tid 306218 thread 0 bound to OS proc set {212}
OMP: pid 306325 tid 306325 thread 0 bound to OS proc set {184}
OMP: pid 306449 tid 306449 thread 0 bound to OS proc set {220}
OMP: pid 306232 tid 306232 thread 0 bound to OS proc set {183}
OMP: pid 306401 tid 306401 thread 0 bound to OS proc set {173}
OMP: pid 306321 tid 306321 thread 0 bound to OS proc set {185}
OMP: pid 306304 tid 306304 thread 0 bound to OS proc set {121}
OMP: pid 306230 tid 306230 thread 0 bound to OS proc set {218}
OMP: pid 306391 tid 306391 thread 0 bound to OS proc set {68}
OMP: pid 306257 tid 306257 thread 0 bound to OS proc set {202}
OMP: pid 306337 tid 306337 thread 0 bound to OS proc set {112}
OMP: pid 306314 tid 306314 thread 0 bound to OS proc set {130}
OMP: pid 306254 tid 306254 thread 0 bound to OS proc set {139}
OMP: pid 306322 tid 306322 thread 0 bound to OS proc set {236}
OMP: pid 306235 tid 306235 thread 0 bound to OS proc set {239}
OMP: pid 306354 tid 306354 thread 0 bound to OS proc set {226}
OMP: pid 306299 tid 306299 thread 0 bound to OS proc set {114}
OMP: pid 306274 tid 306274 thread 0 bound to OS proc set {118}
OMP: pid 306363 tid 306363 thread 0 bound to OS proc set {157}
OMP: pid 306444 tid 306444 thread 0 bound to OS proc set {158}
OMP: pid 306424 tid 306424 thread 0 bound to OS proc set {156}
OMP: pid 306383 tid 306383 thread 0 bound to OS proc set {119}
OMP: pid 306319 tid 306319 thread 0 bound to OS proc set {251}
OMP: pid 306278 tid 306278 thread 0 bound to OS proc set {204}
OMP: pid 306408 tid 306408 thread 0 bound to OS proc set {245}
OMP: pid 306311 tid 306311 thread 0 bound to OS proc set {91}
OMP: pid 306377 tid 306377 thread 0 bound to OS proc set {92}
OMP: pid 306351 tid 306351 thread 0 bound to OS proc set {120}
OMP: pid 306428 tid 306428 thread 0 bound to OS proc set {231}
OMP: pid 306338 tid 306338 thread 0 bound to OS proc set {238}
OMP: pid 306355 tid 306355 thread 0 bound to OS proc set {222}
OMP: pid 306250 tid 306250 thread 0 bound to OS proc set {104}
OMP: pid 306308 tid 306308 thread 0 bound to OS proc set {111}
OMP: pid 306439 tid 306439 thread 0 bound to OS proc set {90}
OMP: pid 306418 tid 306418 thread 0 bound to OS proc set {164}
OMP: pid 306240 tid 306240 thread 0 bound to OS proc set {116}
OMP: pid 306279 tid 306279 thread 0 bound to OS proc set {171}
OMP: pid 306402 tid 306402 thread 0 bound to OS proc set {235}
OMP: pid 306302 tid 306302 thread 0 bound to OS proc set {123}
OMP: pid 306394 tid 306394 thread 0 bound to OS proc set {84}
OMP: pid 306446 tid 306446 thread 0 bound to OS proc set {237}
OMP: pid 306270 tid 306270 thread 0 bound to OS proc set {255}
OMP: pid 306281 tid 306281 thread 0 bound to OS proc set {175}
OMP: pid 306261 tid 306261 thread 0 bound to OS proc set {100}
OMP: pid 306395 tid 306395 thread 0 bound to OS proc set {124}
OMP: pid 306430 tid 306430 thread 0 bound to OS proc set {229}
OMP: pid 306342 tid 306342 thread 0 bound to OS proc set {213}
OMP: pid 306239 tid 306239 thread 0 bound to OS proc set {193}
OMP: pid 306398 tid 306398 thread 0 bound to OS proc set {232}
OMP: pid 306291 tid 306291 thread 0 bound to OS proc set {0}
OMP: pid 306223 tid 306223 thread 0 bound to OS proc set {254}
OMP: pid 306285 tid 306285 thread 0 bound to OS proc set {194}
OMP: pid 306331 tid 306331 thread 0 bound to OS proc set {142}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 306276 tid 306276 thread 0 bound to OS proc set {81}
OMP: pid 306440 tid 306440 thread 0 bound to OS proc set {143}
OMP: pid 306284 tid 306284 thread 0 bound to OS proc set {72}
OMP: pid 306372 tid 306372 thread 0 bound to OS proc set {113}
OMP: pid 306340 tid 306340 thread 0 bound to OS proc set {225}
OMP: pid 306243 tid 306243 thread 0 bound to OS proc set {107}
OMP: pid 306231 tid 306231 thread 0 bound to OS proc set {196}
OMP: pid 306344 tid 306344 thread 0 bound to OS proc set {223}
OMP: pid 306382 tid 306382 thread 0 bound to OS proc set {144}
OMP: pid 306298 tid 306298 thread 0 bound to OS proc set {149}
OMP: pid 306320 tid 306320 thread 0 bound to OS proc set {132}
OMP: pid 306316 tid 306316 thread 0 bound to OS proc set {234}
OMP: pid 306300 tid 306300 thread 0 bound to OS proc set {241}
OMP: pid 306406 tid 306406 thread 0 bound to OS proc set {227}
OMP: pid 306327 tid 306327 thread 0 bound to OS proc set {199}
OMP: pid 306234 tid 306234 thread 0 bound to OS proc set {253}
OMP: pid 306306 tid 306306 thread 0 bound to OS proc set {198}
OMP: pid 306242 tid 306242 thread 0 bound to OS proc set {219}
OMP: pid 306326 tid 306326 thread 0 bound to OS proc set {191}
OMP: pid 306263 tid 306263 thread 0 bound to OS proc set {249}
OMP: pid 306451 tid 306451 thread 0 bound to OS proc set {243}
OMP: pid 306332 tid 306332 thread 0 bound to OS proc set {248}
OMP: pid 306253 tid 306253 thread 0 bound to OS proc set {209}
OMP: pid 306303 tid 306303 thread 0 bound to OS proc set {210}
OMP: pid 306328 tid 306328 thread 0 bound to OS proc set {180}
OMP: pid 306346 tid 306346 thread 0 bound to OS proc set {148}
OMP: pid 306374 tid 306374 thread 0 bound to OS proc set {200}
OMP: pid 306288 tid 306288 thread 0 bound to OS proc set {152}
OMP: pid 306305 tid 306305 thread 0 bound to OS proc set {181}
OMP: pid 306370 tid 306370 thread 0 bound to OS proc set {252}
OMP: pid 306450 tid 306450 thread 0 bound to OS proc set {242}
OMP: pid 306417 tid 306417 thread 0 bound to OS proc set {246}
OMP: pid 306336 tid 306336 thread 0 bound to OS proc set {159}
OMP: pid 306405 tid 306405 thread 0 bound to OS proc set {197}
OMP: pid 306315 tid 306315 thread 0 bound to OS proc set {250}
OMP: pid 306215 tid 306215 thread 0 bound to OS proc set {211}
OMP: pid 306360 tid 306360 thread 0 bound to OS proc set {240}
OMP: pid 306238 tid 306238 thread 0 bound to OS proc set {208}
OMP: pid 306237 tid 306237 thread 0 bound to OS proc set {160}
OMP: pid 306425 tid 306425 thread 0 bound to OS proc set {206}
OMP: pid 306334 tid 306334 thread 0 bound to OS proc set {224}
OMP: pid 306429 tid 306429 thread 0 bound to OS proc set {244}
OMP: pid 306410 tid 306410 thread 0 bound to OS proc set {233}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
12 by 4 by 5 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.020 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1154 | 1194 | 1241 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.656426 on 240 procs for 10 steps with 32768000 atoms
Performance: 6.581 ns/day, 3.647 hours/ns, 15.234 timesteps/s, 499.188 Matom-step/s
97.7% CPU use with 240 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.44722 | 0.456 | 0.46496 | 0.5 | 69.47
Neigh | 0.028686 | 0.030223 | 0.03199 | 0.4 | 4.60
Comm | 0.065229 | 0.074015 | 0.091374 | 1.7 | 11.28
Output | 0.0012612 | 0.0021274 | 0.0031389 | 0.9 | 0.32
Modify | 0.063453 | 0.076169 | 0.081304 | 1.2 | 11.60
Other | | 0.01789 | | | 2.73
Nlocal: 136533 ave 137088 max 135600 min
Histogram: 78 2 0 0 0 0 0 0 52 108
Nghost: 48442.9 ave 48757 max 48222 min
Histogram: 11 46 63 32 7 5 14 36 17 9
Neighs: 5.13936e+06 ave 5.17243e+06 max 5.09245e+06 min
Histogram: 17 28 19 16 0 7 27 59 35 32
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1154 | 1194 | 1241 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68645 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74785 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84597 -1.1257917e+08 0 -1.0919981e+08 51536.934
500 797.7245 -1.1257864e+08 0 -1.091998e+08 51543.024
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.153
Loop time of 34.1684 on 240 procs for 500 steps with 32768000 atoms
Performance: 6.322 ns/day, 3.796 hours/ns, 14.633 timesteps/s, 479.507 Matom-step/s
98.6% CPU use with 240 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 22.724 | 22.849 | 22.996 | 1.1 | 66.87
Neigh | 2.5658 | 2.6013 | 2.7141 | 1.2 | 7.61
Comm | 3.6844 | 3.8348 | 4.159 | 4.4 | 11.22
Output | 0.015638 | 0.022277 | 0.028854 | 2.3 | 0.07
Modify | 3.7055 | 4.0419 | 4.1281 | 3.2 | 11.83
Other | | 0.819 | | | 2.40
Nlocal: 136533 ave 137378 max 135210 min
Histogram: 9 25 32 13 1 0 15 58 65 22
Nghost: 48368.3 ave 49131 max 47804 min
Histogram: 6 13 33 58 59 41 17 6 4 3
Neighs: 5.15374e+06 ave 5.19489e+06 max 5.09688e+06 min
Histogram: 7 20 26 18 10 10 40 65 33 11
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747092
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:35
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_8 #
#######################################################################################################################################################################################################################
* [MAQAO] Info: Detected 256 Lprof instances in isix04.benchmarkcenter.megware.com.
If this is incorrect, rerun with number-processes-per-node=X
[0] MPI startup(): Intel(R) MPI Library, Version 2021.15 Build 20250213 (id: d233448)
[0] MPI startup(): Copyright (C) 2003-2025 Intel Corporation. All rights reserved.
[0] MPI startup(): library kind: release
[0] MPI startup(): Load tuning file: "/cluster/intel/oneapi/2025.1.0/mpi/2021.15/opt/mpi/etc/tuning_gnr_shm.dat"
[0] MPI startup(): ===== CPU pinning =====
[0] MPI startup(): Rank Pid Node name Pin cpu
[0] MPI startup(): 0 311506 isix04.benchmarkcenter.megware.com {0,256}
[0] MPI startup(): 1 311412 isix04.benchmarkcenter.megware.com {1,257}
[0] MPI startup(): 2 311478 isix04.benchmarkcenter.megware.com {2,258}
[0] MPI startup(): 3 311561 isix04.benchmarkcenter.megware.com {3,259}
[0] MPI startup(): 4 311410 isix04.benchmarkcenter.megware.com {4,260}
[0] MPI startup(): 5 311562 isix04.benchmarkcenter.megware.com {5,261}
[0] MPI startup(): 6 311613 isix04.benchmarkcenter.megware.com {6,262}
[0] MPI startup(): 7 311597 isix04.benchmarkcenter.megware.com {7,263}
[0] MPI startup(): 8 311535 isix04.benchmarkcenter.megware.com {8,264}
[0] MPI startup(): 9 311655 isix04.benchmarkcenter.megware.com {9,265}
[0] MPI startup(): 10 311489 isix04.benchmarkcenter.megware.com {10,266}
[0] MPI startup(): 11 311503 isix04.benchmarkcenter.megware.com {11,267}
[0] MPI startup(): 12 311659 isix04.benchmarkcenter.megware.com {12,268}
[0] MPI startup(): 13 311492 isix04.benchmarkcenter.megware.com {13,269}
[0] MPI startup(): 14 311526 isix04.benchmarkcenter.megware.com {14,270}
[0] MPI startup(): 15 311661 isix04.benchmarkcenter.megware.com {15,271}
[0] MPI startup(): 16 311495 isix04.benchmarkcenter.megware.com {16,272}
[0] MPI startup(): 17 311590 isix04.benchmarkcenter.megware.com {17,273}
[0] MPI startup(): 18 311577 isix04.benchmarkcenter.megware.com {18,274}
[0] MPI startup(): 19 311490 isix04.benchmarkcenter.megware.com {19,275}
[0] MPI startup(): 20 311523 isix04.benchmarkcenter.megware.com {20,276}
[0] MPI startup(): 21 311507 isix04.benchmarkcenter.megware.com {21,277}
[0] MPI startup(): 22 311493 isix04.benchmarkcenter.megware.com {22,278}
[0] MPI startup(): 23 311475 isix04.benchmarkcenter.megware.com {23,279}
[0] MPI startup(): 24 311476 isix04.benchmarkcenter.megware.com {24,280}
[0] MPI startup(): 25 311644 isix04.benchmarkcenter.megware.com {25,281}
[0] MPI startup(): 26 311660 isix04.benchmarkcenter.megware.com {26,282}
[0] MPI startup(): 27 311665 isix04.benchmarkcenter.megware.com {27,283}
[0] MPI startup(): 28 311608 isix04.benchmarkcenter.megware.com {28,284}
[0] MPI startup(): 29 311477 isix04.benchmarkcenter.megware.com {29,285}
[0] MPI startup(): 30 311572 isix04.benchmarkcenter.megware.com {30,286}
[0] MPI startup(): 31 311635 isix04.benchmarkcenter.megware.com {31,287}
[0] MPI startup(): 32 311583 isix04.benchmarkcenter.megware.com {32,288}
[0] MPI startup(): 33 311510 isix04.benchmarkcenter.megware.com {33,289}
[0] MPI startup(): 34 311462 isix04.benchmarkcenter.megware.com {34,290}
[0] MPI startup(): 35 311604 isix04.benchmarkcenter.megware.com {35,291}
[0] MPI startup(): 36 311643 isix04.benchmarkcenter.megware.com {36,292}
[0] MPI startup(): 37 311509 isix04.benchmarkcenter.megware.com {37,293}
[0] MPI startup(): 38 311472 isix04.benchmarkcenter.megware.com {38,294}
[0] MPI startup(): 39 311568 isix04.benchmarkcenter.megware.com {39,295}
[0] MPI startup(): 40 311576 isix04.benchmarkcenter.megware.com {40,296}
[0] MPI startup(): 41 311563 isix04.benchmarkcenter.megware.com {41,297}
[0] MPI startup(): 42 311529 isix04.benchmarkcenter.megware.com {42,298}
[0] MPI startup(): 43 311565 isix04.benchmarkcenter.megware.com {43,299}
[0] MPI startup(): 44 311494 isix04.benchmarkcenter.megware.com {44,300}
[0] MPI startup(): 45 311596 isix04.benchmarkcenter.megware.com {45,301}
[0] MPI startup(): 46 311461 isix04.benchmarkcenter.megware.com {46,302}
[0] MPI startup(): 47 311584 isix04.benchmarkcenter.megware.com {47,303}
[0] MPI startup(): 48 311522 isix04.benchmarkcenter.megware.com {48,304}
[0] MPI startup(): 49 311552 isix04.benchmarkcenter.megware.com {49,305}
[0] MPI startup(): 50 311571 isix04.benchmarkcenter.megware.com {50,306}
[0] MPI startup(): 51 311641 isix04.benchmarkcenter.megware.com {51,307}
[0] MPI startup(): 52 311600 isix04.benchmarkcenter.megware.com {52,308}
[0] MPI startup(): 53 311620 isix04.benchmarkcenter.megware.com {53,309}
[0] MPI startup(): 54 311534 isix04.benchmarkcenter.megware.com {54,310}
[0] MPI startup(): 55 311451 isix04.benchmarkcenter.megware.com {55,311}
[0] MPI startup(): 56 311419 isix04.benchmarkcenter.megware.com {56,312}
[0] MPI startup(): 57 311573 isix04.benchmarkcenter.megware.com {57,313}
[0] MPI startup(): 58 311445 isix04.benchmarkcenter.megware.com {58,314}
[0] MPI startup(): 59 311416 isix04.benchmarkcenter.megware.com {59,315}
[0] MPI startup(): 60 311505 isix04.benchmarkcenter.megware.com {60,316}
[0] MPI startup(): 61 311622 isix04.benchmarkcenter.megware.com {61,317}
[0] MPI startup(): 62 311516 isix04.benchmarkcenter.megware.com {62,318}
[0] MPI startup(): 63 311518 isix04.benchmarkcenter.megware.com {63,319}
[0] MPI startup(): 64 311638 isix04.benchmarkcenter.megware.com {64,320}
[0] MPI startup(): 65 311517 isix04.benchmarkcenter.megware.com {65,321}
[0] MPI startup(): 66 311598 isix04.benchmarkcenter.megware.com {66,322}
[0] MPI startup(): 67 311662 isix04.benchmarkcenter.megware.com {67,323}
[0] MPI startup(): 68 311537 isix04.benchmarkcenter.megware.com {68,324}
[0] MPI startup(): 69 311488 isix04.benchmarkcenter.megware.com {69,325}
[0] MPI startup(): 70 311542 isix04.benchmarkcenter.megware.com {70,326}
[0] MPI startup(): 71 311579 isix04.benchmarkcenter.megware.com {71,327}
[0] MPI startup(): 72 311536 isix04.benchmarkcenter.megware.com {72,328}
[0] MPI startup(): 73 311521 isix04.benchmarkcenter.megware.com {73,329}
[0] MPI startup(): 74 311649 isix04.benchmarkcenter.megware.com {74,330}
[0] MPI startup(): 75 311497 isix04.benchmarkcenter.megware.com {75,331}
[0] MPI startup(): 76 311588 isix04.benchmarkcenter.megware.com {76,332}
[0] MPI startup(): 77 311515 isix04.benchmarkcenter.megware.com {77,333}
[0] MPI startup(): 78 311628 isix04.benchmarkcenter.megware.com {78,334}
[0] MPI startup(): 79 311519 isix04.benchmarkcenter.megware.com {79,335}
[0] MPI startup(): 80 311421 isix04.benchmarkcenter.megware.com {80,336}
[0] MPI startup(): 81 311603 isix04.benchmarkcenter.megware.com {81,337}
[0] MPI startup(): 82 311504 isix04.benchmarkcenter.megware.com {82,338}
[0] MPI startup(): 83 311528 isix04.benchmarkcenter.megware.com {83,339}
[0] MPI startup(): 84 311456 isix04.benchmarkcenter.megware.com {84,340}
[0] MPI startup(): 85 311570 isix04.benchmarkcenter.megware.com {85,341}
[0] MPI startup(): 86 311469 isix04.benchmarkcenter.megware.com {86,342}
[0] MPI startup(): 87 311532 isix04.benchmarkcenter.megware.com {87,343}
[0] MPI startup(): 88 311480 isix04.benchmarkcenter.megware.com {88,344}
[0] MPI startup(): 89 311612 isix04.benchmarkcenter.megware.com {89,345}
[0] MPI startup(): 90 311481 isix04.benchmarkcenter.megware.com {90,346}
[0] MPI startup(): 91 311485 isix04.benchmarkcenter.megware.com {91,347}
[0] MPI startup(): 92 311500 isix04.benchmarkcenter.megware.com {92,348}
[0] MPI startup(): 93 311484 isix04.benchmarkcenter.megware.com {93,349}
[0] MPI startup(): 94 311483 isix04.benchmarkcenter.megware.com {94,350}
[0] MPI startup(): 95 311619 isix04.benchmarkcenter.megware.com {95,351}
[0] MPI startup(): 96 311450 isix04.benchmarkcenter.megware.com {96,352}
[0] MPI startup(): 97 311423 isix04.benchmarkcenter.megware.com {97,353}
[0] MPI startup(): 98 311468 isix04.benchmarkcenter.megware.com {98,354}
[0] MPI startup(): 99 311664 isix04.benchmarkcenter.megware.com {99,355}
[0] MPI startup(): 100 311425 isix04.benchmarkcenter.megware.com {100,356}
[0] MPI startup(): 101 311474 isix04.benchmarkcenter.megware.com {101,357}
[0] MPI startup(): 102 311446 isix04.benchmarkcenter.megware.com {102,358}
[0] MPI startup(): 103 311634 isix04.benchmarkcenter.megware.com {103,359}
[0] MPI startup(): 104 311415 isix04.benchmarkcenter.megware.com {104,360}
[0] MPI startup(): 105 311609 isix04.benchmarkcenter.megware.com {105,361}
[0] MPI startup(): 106 311482 isix04.benchmarkcenter.megware.com {106,362}
[0] MPI startup(): 107 311556 isix04.benchmarkcenter.megware.com {107,363}
[0] MPI startup(): 108 311511 isix04.benchmarkcenter.megware.com {108,364}
[0] MPI startup(): 109 311560 isix04.benchmarkcenter.megware.com {109,365}
[0] MPI startup(): 110 311512 isix04.benchmarkcenter.megware.com {110,366}
[0] MPI startup(): 111 311473 isix04.benchmarkcenter.megware.com {111,367}
[0] MPI startup(): 112 311547 isix04.benchmarkcenter.megware.com {112,368}
[0] MPI startup(): 113 311527 isix04.benchmarkcenter.megware.com {113,369}
[0] MPI startup(): 114 311553 isix04.benchmarkcenter.megware.com {114,370}
[0] MPI startup(): 115 311428 isix04.benchmarkcenter.megware.com {115,371}
[0] MPI startup(): 116 311459 isix04.benchmarkcenter.megware.com {116,372}
[0] MPI startup(): 117 311467 isix04.benchmarkcenter.megware.com {117,373}
[0] MPI startup(): 118 311557 isix04.benchmarkcenter.megware.com {118,374}
[0] MPI startup(): 119 311558 isix04.benchmarkcenter.megware.com {119,375}
[0] MPI startup(): 120 311530 isix04.benchmarkcenter.megware.com {120,376}
[0] MPI startup(): 121 311539 isix04.benchmarkcenter.megware.com {121,377}
[0] MPI startup(): 122 311435 isix04.benchmarkcenter.megware.com {122,378}
[0] MPI startup(): 123 311486 isix04.benchmarkcenter.megware.com {123,379}
[0] MPI startup(): 124 311610 isix04.benchmarkcenter.megware.com {124,380}
[0] MPI startup(): 125 311487 isix04.benchmarkcenter.megware.com {125,381}
[0] MPI startup(): 126 311640 isix04.benchmarkcenter.megware.com {126,382}
[0] MPI startup(): 127 311442 isix04.benchmarkcenter.megware.com {127,383}
[0] MPI startup(): 128 311413 isix04.benchmarkcenter.megware.com {128,384}
[0] MPI startup(): 129 311533 isix04.benchmarkcenter.megware.com {129,385}
[0] MPI startup(): 130 311432 isix04.benchmarkcenter.megware.com {130,386}
[0] MPI startup(): 131 311508 isix04.benchmarkcenter.megware.com {131,387}
[0] MPI startup(): 132 311498 isix04.benchmarkcenter.megware.com {132,388}
[0] MPI startup(): 133 311548 isix04.benchmarkcenter.megware.com {133,389}
[0] MPI startup(): 134 311520 isix04.benchmarkcenter.megware.com {134,390}
[0] MPI startup(): 135 311657 isix04.benchmarkcenter.megware.com {135,391}
[0] MPI startup(): 136 311631 isix04.benchmarkcenter.megware.com {136,392}
[0] MPI startup(): 137 311585 isix04.benchmarkcenter.megware.com {137,393}
[0] MPI startup(): 138 311592 isix04.benchmarkcenter.megware.com {138,394}
[0] MPI startup(): 139 311669 isix04.benchmarkcenter.megware.com {139,395}
[0] MPI startup(): 140 311436 isix04.benchmarkcenter.megware.com {140,396}
[0] MPI startup(): 141 311545 isix04.benchmarkcenter.megware.com {141,397}
[0] MPI startup(): 142 311566 isix04.benchmarkcenter.megware.com {142,398}
[0] MPI startup(): 143 311591 isix04.benchmarkcenter.megware.com {143,399}
[0] MPI startup(): 144 311617 isix04.benchmarkcenter.megware.com {144,400}
[0] MPI startup(): 145 311594 isix04.benchmarkcenter.megware.com {145,401}
[0] MPI startup(): 146 311658 isix04.benchmarkcenter.megware.com {146,402}
[0] MPI startup(): 147 311587 isix04.benchmarkcenter.megware.com {147,403}
[0] MPI startup(): 148 311601 isix04.benchmarkcenter.megware.com {148,404}
[0] MPI startup(): 149 311656 isix04.benchmarkcenter.megware.com {149,405}
[0] MPI startup(): 150 311431 isix04.benchmarkcenter.megware.com {150,406}
[0] MPI startup(): 151 311602 isix04.benchmarkcenter.megware.com {151,407}
[0] MPI startup(): 152 311544 isix04.benchmarkcenter.megware.com {152,408}
[0] MPI startup(): 153 311543 isix04.benchmarkcenter.megware.com {153,409}
[0] MPI startup(): 154 311595 isix04.benchmarkcenter.megware.com {154,410}
[0] MPI startup(): 155 311666 isix04.benchmarkcenter.megware.com {155,411}
[0] MPI startup(): 156 311441 isix04.benchmarkcenter.megware.com {156,412}
[0] MPI startup(): 157 311639 isix04.benchmarkcenter.megware.com {157,413}
[0] MPI startup(): 158 311538 isix04.benchmarkcenter.megware.com {158,414}
[0] MPI startup(): 159 311555 isix04.benchmarkcenter.megware.com {159,415}
[0] MPI startup(): 160 311549 isix04.benchmarkcenter.megware.com {160,416}
[0] MPI startup(): 161 311550 isix04.benchmarkcenter.megware.com {161,417}
[0] MPI startup(): 162 311541 isix04.benchmarkcenter.megware.com {162,418}
[0] MPI startup(): 163 311424 isix04.benchmarkcenter.megware.com {163,419}
[0] MPI startup(): 164 311623 isix04.benchmarkcenter.megware.com {164,420}
[0] MPI startup(): 165 311615 isix04.benchmarkcenter.megware.com {165,421}
[0] MPI startup(): 166 311667 isix04.benchmarkcenter.megware.com {166,422}
[0] MPI startup(): 167 311637 isix04.benchmarkcenter.megware.com {167,423}
[0] MPI startup(): 168 311629 isix04.benchmarkcenter.megware.com {168,424}
[0] MPI startup(): 169 311414 isix04.benchmarkcenter.megware.com {169,425}
[0] MPI startup(): 170 311438 isix04.benchmarkcenter.megware.com {170,426}
[0] MPI startup(): 171 311652 isix04.benchmarkcenter.megware.com {171,427}
[0] MPI startup(): 172 311491 isix04.benchmarkcenter.megware.com {172,428}
[0] MPI startup(): 173 311578 isix04.benchmarkcenter.megware.com {173,429}
[0] MPI startup(): 174 311447 isix04.benchmarkcenter.megware.com {174,430}
[0] MPI startup(): 175 311621 isix04.benchmarkcenter.megware.com {175,431}
[0] MPI startup(): 176 311499 isix04.benchmarkcenter.megware.com {176,432}
[0] MPI startup(): 177 311624 isix04.benchmarkcenter.megware.com {177,433}
[0] MPI startup(): 178 311429 isix04.benchmarkcenter.megware.com {178,434}
[0] MPI startup(): 179 311593 isix04.benchmarkcenter.megware.com {179,435}
[0] MPI startup(): 180 311457 isix04.benchmarkcenter.megware.com {180,436}
[0] MPI startup(): 181 311589 isix04.benchmarkcenter.megware.com {181,437}
[0] MPI startup(): 182 311448 isix04.benchmarkcenter.megware.com {182,438}
[0] MPI startup(): 183 311564 isix04.benchmarkcenter.megware.com {183,439}
[0] MPI startup(): 184 311599 isix04.benchmarkcenter.megware.com {184,440}
[0] MPI startup(): 185 311465 isix04.benchmarkcenter.megware.com {185,441}
[0] MPI startup(): 186 311670 isix04.benchmarkcenter.megware.com {186,442}
[0] MPI startup(): 187 311460 isix04.benchmarkcenter.megware.com {187,443}
[0] MPI startup(): 188 311502 isix04.benchmarkcenter.megware.com {188,444}
[0] MPI startup(): 189 311648 isix04.benchmarkcenter.megware.com {189,445}
[0] MPI startup(): 190 311569 isix04.benchmarkcenter.megware.com {190,446}
[0] MPI startup(): 191 311458 isix04.benchmarkcenter.megware.com {191,447}
[0] MPI startup(): 192 311417 isix04.benchmarkcenter.megware.com {192,448}
[0] MPI startup(): 193 311663 isix04.benchmarkcenter.megware.com {193,449}
[0] MPI startup(): 194 311437 isix04.benchmarkcenter.megware.com {194,450}
[0] MPI startup(): 195 311636 isix04.benchmarkcenter.megware.com {195,451}
[0] MPI startup(): 196 311513 isix04.benchmarkcenter.megware.com {196,452}
[0] MPI startup(): 197 311439 isix04.benchmarkcenter.megware.com {197,453}
[0] MPI startup(): 198 311625 isix04.benchmarkcenter.megware.com {198,454}
[0] MPI startup(): 199 311427 isix04.benchmarkcenter.megware.com {199,455}
[0] MPI startup(): 200 311440 isix04.benchmarkcenter.megware.com {200,456}
[0] MPI startup(): 201 311551 isix04.benchmarkcenter.megware.com {201,457}
[0] MPI startup(): 202 311449 isix04.benchmarkcenter.megware.com {202,458}
[0] MPI startup(): 203 311418 isix04.benchmarkcenter.megware.com {203,459}
[0] MPI startup(): 204 311434 isix04.benchmarkcenter.megware.com {204,460}
[0] MPI startup(): 205 311632 isix04.benchmarkcenter.megware.com {205,461}
[0] MPI startup(): 206 311642 isix04.benchmarkcenter.megware.com {206,462}
[0] MPI startup(): 207 311559 isix04.benchmarkcenter.megware.com {207,463}
[0] MPI startup(): 208 311411 isix04.benchmarkcenter.megware.com {208,464}
[0] MPI startup(): 209 311466 isix04.benchmarkcenter.megware.com {209,465}
[0] MPI startup(): 210 311616 isix04.benchmarkcenter.megware.com {210,466}
[0] MPI startup(): 211 311540 isix04.benchmarkcenter.megware.com {211,467}
[0] MPI startup(): 212 311514 isix04.benchmarkcenter.megware.com {212,468}
[0] MPI startup(): 213 311524 isix04.benchmarkcenter.megware.com {213,469}
[0] MPI startup(): 214 311581 isix04.benchmarkcenter.megware.com {214,470}
[0] MPI startup(): 215 311463 isix04.benchmarkcenter.megware.com {215,471}
[0] MPI startup(): 216 311626 isix04.benchmarkcenter.megware.com {216,472}
[0] MPI startup(): 217 311443 isix04.benchmarkcenter.megware.com {217,473}
[0] MPI startup(): 218 311627 isix04.benchmarkcenter.megware.com {218,474}
[0] MPI startup(): 219 311525 isix04.benchmarkcenter.megware.com {219,475}
[0] MPI startup(): 220 311574 isix04.benchmarkcenter.megware.com {220,476}
[0] MPI startup(): 221 311479 isix04.benchmarkcenter.megware.com {221,477}
[0] MPI startup(): 222 311575 isix04.benchmarkcenter.megware.com {222,478}
[0] MPI startup(): 223 311582 isix04.benchmarkcenter.megware.com {223,479}
[0] MPI startup(): 224 311452 isix04.benchmarkcenter.megware.com {224,480}
[0] MPI startup(): 225 311471 isix04.benchmarkcenter.megware.com {225,481}
[0] MPI startup(): 226 311618 isix04.benchmarkcenter.megware.com {226,482}
[0] MPI startup(): 227 311607 isix04.benchmarkcenter.megware.com {227,483}
[0] MPI startup(): 228 311580 isix04.benchmarkcenter.megware.com {228,484}
[0] MPI startup(): 229 311614 isix04.benchmarkcenter.megware.com {229,485}
[0] MPI startup(): 230 311454 isix04.benchmarkcenter.megware.com {230,486}
[0] MPI startup(): 231 311611 isix04.benchmarkcenter.megware.com {231,487}
[0] MPI startup(): 232 311430 isix04.benchmarkcenter.megware.com {232,488}
[0] MPI startup(): 233 311651 isix04.benchmarkcenter.megware.com {233,489}
[0] MPI startup(): 234 311567 isix04.benchmarkcenter.megware.com {234,490}
[0] MPI startup(): 235 311501 isix04.benchmarkcenter.megware.com {235,491}
[0] MPI startup(): 236 311464 isix04.benchmarkcenter.megware.com {236,492}
[0] MPI startup(): 237 311426 isix04.benchmarkcenter.megware.com {237,493}
[0] MPI startup(): 238 311654 isix04.benchmarkcenter.megware.com {238,494}
[0] MPI startup(): 239 311554 isix04.benchmarkcenter.megware.com {239,495}
[0] MPI startup(): 240 311606 isix04.benchmarkcenter.megware.com {240,496}
[0] MPI startup(): 241 311668 isix04.benchmarkcenter.megware.com {241,497}
[0] MPI startup(): 242 311646 isix04.benchmarkcenter.megware.com {242,498}
[0] MPI startup(): 243 311496 isix04.benchmarkcenter.megware.com {243,499}
[0] MPI startup(): 244 311420 isix04.benchmarkcenter.megware.com {244,500}
[0] MPI startup(): 245 311453 isix04.benchmarkcenter.megware.com {245,501}
[0] MPI startup(): 246 311422 isix04.benchmarkcenter.megware.com {246,502}
[0] MPI startup(): 247 311650 isix04.benchmarkcenter.megware.com {247,503}
[0] MPI startup(): 248 311633 isix04.benchmarkcenter.megware.com {248,504}
[0] MPI startup(): 249 311647 isix04.benchmarkcenter.megware.com {249,505}
[0] MPI startup(): 250 311455 isix04.benchmarkcenter.megware.com {250,506}
[0] MPI startup(): 251 311546 isix04.benchmarkcenter.megware.com {251,507}
[0] MPI startup(): 252 311645 isix04.benchmarkcenter.megware.com {252,508}
[0] MPI startup(): 253 311653 isix04.benchmarkcenter.megware.com {253,509}
[0] MPI startup(): 254 311433 isix04.benchmarkcenter.megware.com {254,510}
[0] MPI startup(): 255 311586 isix04.benchmarkcenter.megware.com {255,511}
OMP: pid 311597 tid 311597 thread 0 bound to OS proc set {7}
OMP: pid 311412 tid 311412 thread 0 bound to OS proc set {1}
OMP: pid 311489 tid 311489 thread 0 bound to OS proc set {10}
OMP: pid 311643 tid 311643 thread 0 bound to OS proc set {36}
OMP: pid 311635 tid 311635 thread 0 bound to OS proc set {31}
OMP: pid 311572 tid 311572 thread 0 bound to OS proc set {30}
OMP: pid 311561 tid 311561 thread 0 bound to OS proc set {3}
OMP: pid 311661 tid 311661 thread 0 bound to OS proc set {15}
OMP: pid 311535 tid 311535 thread 0 bound to OS proc set {8}
OMP: pid 311492 tid 311492 thread 0 bound to OS proc set {13}
OMP: pid 311495 tid 311495 thread 0 bound to OS proc set {16}
OMP: pid 311604 tid 311604 thread 0 bound to OS proc set {35}
OMP: pid 311613 tid 311613 thread 0 bound to OS proc set {6}
OMP: pid 311659 tid 311659 thread 0 bound to OS proc set {12}
OMP: pid 311590 tid 311590 thread 0 bound to OS proc set {17}
OMP: pid 311655 tid 311655 thread 0 bound to OS proc set {9}
OMP: pid 311563 tid 311563 thread 0 bound to OS proc set {41}
OMP: pid 311599 tid 311599 thread 0 bound to OS proc set {184}
OMP: pid 311472 tid 311472 thread 0 bound to OS proc set {38}
OMP: pid 311477 tid 311477 thread 0 bound to OS proc set {29}
OMP: pid 311517 tid 311517 thread 0 bound to OS proc set {65}
OMP: pid 311608 tid 311608 thread 0 bound to OS proc set {28}
OMP: pid 311577 tid 311577 thread 0 bound to OS proc set {18}
OMP: pid 311516 tid 311516 thread 0 bound to OS proc set {62}
OMP: pid 311410 tid 311410 thread 0 bound to OS proc set {4}
OMP: pid 311523 tid 311523 thread 0 bound to OS proc set {20}
OMP: pid 311522 tid 311522 thread 0 bound to OS proc set {48}
OMP: pid 311507 tid 311507 thread 0 bound to OS proc set {21}
OMP: pid 311596 tid 311596 thread 0 bound to OS proc set {45}
OMP: pid 311573 tid 311573 thread 0 bound to OS proc set {57}
OMP: pid 311644 tid 311644 thread 0 bound to OS proc set {25}
OMP: pid 311473 tid 311473 thread 0 bound to OS proc set {111}
OMP: pid 311494 tid 311494 thread 0 bound to OS proc set {44}
OMP: pid 311509 tid 311509 thread 0 bound to OS proc set {37}
OMP: pid 311493 tid 311493 thread 0 bound to OS proc set {22}
OMP: pid 311660 tid 311660 thread 0 bound to OS proc set {26}
OMP: pid 311515 tid 311515 thread 0 bound to OS proc set {77}
OMP: pid 311568 tid 311568 thread 0 bound to OS proc set {39}
OMP: pid 311521 tid 311521 thread 0 bound to OS proc set {73}
OMP: pid 311419 tid 311419 thread 0 bound to OS proc set {56}
OMP: pid 311620 tid 311620 thread 0 bound to OS proc set {53}
OMP: pid 311488 tid 311488 thread 0 bound to OS proc set {69}
OMP: pid 311598 tid 311598 thread 0 bound to OS proc set {66}
OMP: pid 311445 tid 311445 thread 0 bound to OS proc set {58}
OMP: pid 311542 tid 311542 thread 0 bound to OS proc set {70}
OMP: pid 311461 tid 311461 thread 0 bound to OS proc set {46}
OMP: pid 311474 tid 311474 thread 0 bound to OS proc set {101}
OMP: pid 311503 tid 311503 thread 0 bound to OS proc set {11}
OMP: pid 311500 tid 311500 thread 0 bound to OS proc set {92}
OMP: pid 311462 tid 311462 thread 0 bound to OS proc set {34}
OMP: pid 311481 tid 311481 thread 0 bound to OS proc set {90}
OMP: pid 311443 tid 311443 thread 0 bound to OS proc set {217}
OMP: pid 311483 tid 311483 thread 0 bound to OS proc set {94}
OMP: pid 311576 tid 311576 thread 0 bound to OS proc set {40}
OMP: pid 311505 tid 311505 thread 0 bound to OS proc set {60}
OMP: pid 311524 tid 311524 thread 0 bound to OS proc set {213}
OMP: pid 311634 tid 311634 thread 0 bound to OS proc set {103}
OMP: pid 311581 tid 311581 thread 0 bound to OS proc set {214}
OMP: pid 311451 tid 311451 thread 0 bound to OS proc set {55}
OMP: pid 311537 tid 311537 thread 0 bound to OS proc set {68}
OMP: pid 311456 tid 311456 thread 0 bound to OS proc set {84}
OMP: pid 311570 tid 311570 thread 0 bound to OS proc set {85}
OMP: pid 311511 tid 311511 thread 0 bound to OS proc set {108}
OMP: pid 311490 tid 311490 thread 0 bound to OS proc set {19}
OMP: pid 311612 tid 311612 thread 0 bound to OS proc set {89}
OMP: pid 311649 tid 311649 thread 0 bound to OS proc set {74}
OMP: pid 311562 tid 311562 thread 0 bound to OS proc set {5}
OMP: pid 311475 tid 311475 thread 0 bound to OS proc set {23}
OMP: pid 311418 tid 311418 thread 0 bound to OS proc set {203}
OMP: pid 311584 tid 311584 thread 0 bound to OS proc set {47}
OMP: pid 311631 tid 311631 thread 0 bound to OS proc set {136}
OMP: pid 311665 tid 311665 thread 0 bound to OS proc set {27}
OMP: pid 311476 tid 311476 thread 0 bound to OS proc set {24}
OMP: pid 311442 tid 311442 thread 0 bound to OS proc set {127}
OMP: pid 311485 tid 311485 thread 0 bound to OS proc set {91}
OMP: pid 311641 tid 311641 thread 0 bound to OS proc set {51}
OMP: pid 311638 tid 311638 thread 0 bound to OS proc set {64}
OMP: pid 311529 tid 311529 thread 0 bound to OS proc set {42}
OMP: pid 311435 tid 311435 thread 0 bound to OS proc set {122}
OMP: pid 311610 tid 311610 thread 0 bound to OS proc set {124}
OMP: pid 311662 tid 311662 thread 0 bound to OS proc set {67}
OMP: pid 311486 tid 311486 thread 0 bound to OS proc set {123}
OMP: pid 311450 tid 311450 thread 0 bound to OS proc set {96}
OMP: pid 311469 tid 311469 thread 0 bound to OS proc set {86}
OMP: pid 311532 tid 311532 thread 0 bound to OS proc set {87}
OMP: pid 311628 tid 311628 thread 0 bound to OS proc set {78}
OMP: pid 311579 tid 311579 thread 0 bound to OS proc set {71}
OMP: pid 311602 tid 311602 thread 0 bound to OS proc set {151}
OMP: pid 311565 tid 311565 thread 0 bound to OS proc set {43}
OMP: pid 311619 tid 311619 thread 0 bound to OS proc set {95}
OMP: pid 311423 tid 311423 thread 0 bound to OS proc set {97}
OMP: pid 311622 tid 311622 thread 0 bound to OS proc set {61}
OMP: pid 311571 tid 311571 thread 0 bound to OS proc set {50}
OMP: pid 311497 tid 311497 thread 0 bound to OS proc set {75}
OMP: pid 311528 tid 311528 thread 0 bound to OS proc set {83}
OMP: pid 311487 tid 311487 thread 0 bound to OS proc set {125}
OMP: pid 311623 tid 311623 thread 0 bound to OS proc set {164}
OMP: pid 311416 tid 311416 thread 0 bound to OS proc set {59}
OMP: pid 311539 tid 311539 thread 0 bound to OS proc set {121}
OMP: pid 311460 tid 311460 thread 0 bound to OS proc set {187}
OMP: pid 311446 tid 311446 thread 0 bound to OS proc set {102}
OMP: pid 311514 tid 311514 thread 0 bound to OS proc set {212}
OMP: pid 311558 tid 311558 thread 0 bound to OS proc set {119}
OMP: pid 311645 tid 311645 thread 0 bound to OS proc set {252}
OMP: pid 311595 tid 311595 thread 0 bound to OS proc set {154}
OMP: pid 311549 tid 311549 thread 0 bound to OS proc set {160}
OMP: pid 311587 tid 311587 thread 0 bound to OS proc set {147}
OMP: pid 311415 tid 311415 thread 0 bound to OS proc set {104}
OMP: pid 311536 tid 311536 thread 0 bound to OS proc set {72}
OMP: pid 311482 tid 311482 thread 0 bound to OS proc set {106}
OMP: pid 311593 tid 311593 thread 0 bound to OS proc set {179}
OMP: pid 311428 tid 311428 thread 0 bound to OS proc set {115}
OMP: pid 311480 tid 311480 thread 0 bound to OS proc set {88}
OMP: pid 311510 tid 311510 thread 0 bound to OS proc set {33}
OMP: pid 311484 tid 311484 thread 0 bound to OS proc set {93}
OMP: pid 311526 tid 311526 thread 0 bound to OS proc set {14}
OMP: pid 311567 tid 311567 thread 0 bound to OS proc set {234}
OMP: pid 311625 tid 311625 thread 0 bound to OS proc set {198}
OMP: pid 311438 tid 311438 thread 0 bound to OS proc set {170}
OMP: pid 311547 tid 311547 thread 0 bound to OS proc set {112}
OMP: pid 311527 tid 311527 thread 0 bound to OS proc set {113}
OMP: pid 311639 tid 311639 thread 0 bound to OS proc set {157}
OMP: pid 311657 tid 311657 thread 0 bound to OS proc set {135}
OMP: pid 311426 tid 311426 thread 0 bound to OS proc set {237}
OMP: pid 311534 tid 311534 thread 0 bound to OS proc set {54}
OMP: pid 311429 tid 311429 thread 0 bound to OS proc set {178}
OMP: pid 311478 tid 311478 thread 0 bound to OS proc set {2}
OMP: pid 311607 tid 311607 thread 0 bound to OS proc set {227}
OMP: pid 311543 tid 311543 thread 0 bound to OS proc set {153}
OMP: pid 311624 tid 311624 thread 0 bound to OS proc set {177}
OMP: pid 311420 tid 311420 thread 0 bound to OS proc set {244}
OMP: pid 311651 tid 311651 thread 0 bound to OS proc set {233}
OMP: pid 311609 tid 311609 thread 0 bound to OS proc set {105}
OMP: pid 311551 tid 311551 thread 0 bound to OS proc set {201}
OMP: pid 311556 tid 311556 thread 0 bound to OS proc set {107}
OMP: pid 311467 tid 311467 thread 0 bound to OS proc set {117}
OMP: pid 311552 tid 311552 thread 0 bound to OS proc set {49}
OMP: pid 311583 tid 311583 thread 0 bound to OS proc set {32}
OMP: pid 311458 tid 311458 thread 0 bound to OS proc set {191}
OMP: pid 311654 tid 311654 thread 0 bound to OS proc set {238}
OMP: pid 311427 tid 311427 thread 0 bound to OS proc set {199}
OMP: pid 311512 tid 311512 thread 0 bound to OS proc set {110}
OMP: pid 311498 tid 311498 thread 0 bound to OS proc set {132}
OMP: pid 311437 tid 311437 thread 0 bound to OS proc set {194}
OMP: pid 311557 tid 311557 thread 0 bound to OS proc set {118}
OMP: pid 311459 tid 311459 thread 0 bound to OS proc set {116}
OMP: pid 311441 tid 311441 thread 0 bound to OS proc set {156}
OMP: pid 311538 tid 311538 thread 0 bound to OS proc set {158}
OMP: pid 311550 tid 311550 thread 0 bound to OS proc set {161}
OMP: pid 311667 tid 311667 thread 0 bound to OS proc set {166}
OMP: pid 311468 tid 311468 thread 0 bound to OS proc set {98}
OMP: pid 311633 tid 311633 thread 0 bound to OS proc set {248}
OMP: pid 311648 tid 311648 thread 0 bound to OS proc set {189}
OMP: pid 311466 tid 311466 thread 0 bound to OS proc set {209}
OMP: pid 311615 tid 311615 thread 0 bound to OS proc set {165}
OMP: pid 311580 tid 311580 thread 0 bound to OS proc set {228}
OMP: pid 311546 tid 311546 thread 0 bound to OS proc set {251}
OMP: pid 311455 tid 311455 thread 0 bound to OS proc set {250}
OMP: pid 311601 tid 311601 thread 0 bound to OS proc set {148}
OMP: pid 311569 tid 311569 thread 0 bound to OS proc set {190}
OMP: pid 311453 tid 311453 thread 0 bound to OS proc set {245}
OMP: pid 311617 tid 311617 thread 0 bound to OS proc set {144}
OMP: pid 311594 tid 311594 thread 0 bound to OS proc set {145}
OMP: pid 311603 tid 311603 thread 0 bound to OS proc set {81}
OMP: pid 311647 tid 311647 thread 0 bound to OS proc set {249}
OMP: pid 311658 tid 311658 thread 0 bound to OS proc set {146}
OMP: pid 311637 tid 311637 thread 0 bound to OS proc set {167}
OMP: pid 311518 tid 311518 thread 0 bound to OS proc set {63}
OMP: pid 311592 tid 311592 thread 0 bound to OS proc set {138}
OMP: pid 311616 tid 311616 thread 0 bound to OS proc set {210}
OMP: pid 311519 tid 311519 thread 0 bound to OS proc set {79}
OMP: pid 311541 tid 311541 thread 0 bound to OS proc set {162}
OMP: pid 311425 tid 311425 thread 0 bound to OS proc set {100}
OMP: pid 311560 tid 311560 thread 0 bound to OS proc set {109}
OMP: pid 311506 tid 311506 thread 0 bound to OS proc set {0}
OMP: pid 311432 tid 311432 thread 0 bound to OS proc set {130}
OMP: pid 311585 tid 311585 thread 0 bound to OS proc set {137}
OMP: pid 311600 tid 311600 thread 0 bound to OS proc set {52}
OMP: pid 311434 tid 311434 thread 0 bound to OS proc set {204}
OMP: pid 311618 tid 311618 thread 0 bound to OS proc set {226}
LAMMPS (22 Jul 2025)
using 1 OpenMP thread(s) per MPI task
OMP: pid 311533 tid 311533 thread 0 bound to OS proc set {129}
OMP: pid 311626 tid 311626 thread 0 bound to OS proc set {216}
OMP: pid 311545 tid 311545 thread 0 bound to OS proc set {141}
OMP: pid 311417 tid 311417 thread 0 bound to OS proc set {192}
OMP: pid 311499 tid 311499 thread 0 bound to OS proc set {176}
OMP: pid 311564 tid 311564 thread 0 bound to OS proc set {183}
OMP: pid 311513 tid 311513 thread 0 bound to OS proc set {196}
OMP: pid 311578 tid 311578 thread 0 bound to OS proc set {173}
OMP: pid 311421 tid 311421 thread 0 bound to OS proc set {80}
OMP: pid 311653 tid 311653 thread 0 bound to OS proc set {253}
OMP: pid 311656 tid 311656 thread 0 bound to OS proc set {149}
OMP: pid 311433 tid 311433 thread 0 bound to OS proc set {254}
OMP: pid 311642 tid 311642 thread 0 bound to OS proc set {206}
OMP: pid 311411 tid 311411 thread 0 bound to OS proc set {208}
OMP: pid 311491 tid 311491 thread 0 bound to OS proc set {172}
OMP: pid 311640 tid 311640 thread 0 bound to OS proc set {126}
OMP: pid 311589 tid 311589 thread 0 bound to OS proc set {181}
OMP: pid 311632 tid 311632 thread 0 bound to OS proc set {205}
OMP: pid 311664 tid 311664 thread 0 bound to OS proc set {99}
OMP: pid 311554 tid 311554 thread 0 bound to OS proc set {239}
OMP: pid 311452 tid 311452 thread 0 bound to OS proc set {224}
OMP: pid 311436 tid 311436 thread 0 bound to OS proc set {140}
OMP: pid 311588 tid 311588 thread 0 bound to OS proc set {76}
OMP: pid 311591 tid 311591 thread 0 bound to OS proc set {143}
OMP: pid 311611 tid 311611 thread 0 bound to OS proc set {231}
OMP: pid 311544 tid 311544 thread 0 bound to OS proc set {152}
OMP: pid 311479 tid 311479 thread 0 bound to OS proc set {221}
OMP: pid 311636 tid 311636 thread 0 bound to OS proc set {195}
OMP: pid 311502 tid 311502 thread 0 bound to OS proc set {188}
OMP: pid 311496 tid 311496 thread 0 bound to OS proc set {243}
OMP: pid 311669 tid 311669 thread 0 bound to OS proc set {139}
OMP: pid 311508 tid 311508 thread 0 bound to OS proc set {131}
OMP: pid 311582 tid 311582 thread 0 bound to OS proc set {223}
OMP: pid 311424 tid 311424 thread 0 bound to OS proc set {163}
OMP: pid 311457 tid 311457 thread 0 bound to OS proc set {180}
OMP: pid 311449 tid 311449 thread 0 bound to OS proc set {202}
OMP: pid 311463 tid 311463 thread 0 bound to OS proc set {215}
OMP: pid 311553 tid 311553 thread 0 bound to OS proc set {114}
OMP: pid 311439 tid 311439 thread 0 bound to OS proc set {197}
OMP: pid 311586 tid 311586 thread 0 bound to OS proc set {255}
OMP: pid 311668 tid 311668 thread 0 bound to OS proc set {241}
OMP: pid 311471 tid 311471 thread 0 bound to OS proc set {225}
OMP: pid 311422 tid 311422 thread 0 bound to OS proc set {246}
OMP: pid 311525 tid 311525 thread 0 bound to OS proc set {219}
OMP: pid 311548 tid 311548 thread 0 bound to OS proc set {133}
OMP: pid 311540 tid 311540 thread 0 bound to OS proc set {211}
OMP: pid 311447 tid 311447 thread 0 bound to OS proc set {174}
OMP: pid 311430 tid 311430 thread 0 bound to OS proc set {232}
OMP: pid 311520 tid 311520 thread 0 bound to OS proc set {134}
OMP: pid 311650 tid 311650 thread 0 bound to OS proc set {247}
OMP: pid 311574 tid 311574 thread 0 bound to OS proc set {220}
OMP: pid 311621 tid 311621 thread 0 bound to OS proc set {175}
OMP: pid 311652 tid 311652 thread 0 bound to OS proc set {171}
OMP: pid 311504 tid 311504 thread 0 bound to OS proc set {82}
OMP: pid 311413 tid 311413 thread 0 bound to OS proc set {128}
OMP: pid 311555 tid 311555 thread 0 bound to OS proc set {159}
OMP: pid 311663 tid 311663 thread 0 bound to OS proc set {193}
OMP: pid 311465 tid 311465 thread 0 bound to OS proc set {185}
OMP: pid 311454 tid 311454 thread 0 bound to OS proc set {230}
OMP: pid 311566 tid 311566 thread 0 bound to OS proc set {142}
OMP: pid 311666 tid 311666 thread 0 bound to OS proc set {155}
OMP: pid 311559 tid 311559 thread 0 bound to OS proc set {207}
OMP: pid 311530 tid 311530 thread 0 bound to OS proc set {120}
OMP: pid 311414 tid 311414 thread 0 bound to OS proc set {169}
OMP: pid 311440 tid 311440 thread 0 bound to OS proc set {200}
OMP: pid 311627 tid 311627 thread 0 bound to OS proc set {218}
OMP: pid 311670 tid 311670 thread 0 bound to OS proc set {186}
OMP: pid 311646 tid 311646 thread 0 bound to OS proc set {242}
OMP: pid 311629 tid 311629 thread 0 bound to OS proc set {168}
OMP: pid 311614 tid 311614 thread 0 bound to OS proc set {229}
OMP: pid 311501 tid 311501 thread 0 bound to OS proc set {235}
OMP: pid 311431 tid 311431 thread 0 bound to OS proc set {150}
OMP: pid 311464 tid 311464 thread 0 bound to OS proc set {236}
OMP: pid 311575 tid 311575 thread 0 bound to OS proc set {222}
OMP: pid 311606 tid 311606 thread 0 bound to OS proc set {240}
OMP: pid 311448 tid 311448 thread 0 bound to OS proc set {182}
Lattice spacing in x,y,z = 3.615 3.615 3.615
Created orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
8 by 4 by 8 MPI processor grid
Created 32768000 atoms
using lattice units in orthogonal box = (0 0 0) to (1156.8 578.4 578.4)
create_atoms CPU = 0.018 seconds
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Neighbor list info ...
update: every = 1 steps, delay = 5 steps, check = yes
max neighbors/atom: 2000, page size: 100000
master list distance cutoff = 5.95
ghost atom cutoff = 5.95
binsize = 2.975, bins = 389 195 195
1 neighbor lists, perpetual/occasional/extra = 1 0 0
(1) pair eam/intel, perpetual
attributes: half, newton on, intel
pair build: half/bin/newton/intel
stencil: half/bin/3d/intel
bin: intel
Setting up Verlet run ...
Unit style : metal
Current step : 0
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1067 | 1120 | 1175 Mbytes
Step Temp E_pair E_mol TotEng Press
0 1600 -1.1599871e+08 0 -1.0922176e+08 18703.984
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
Loop time of 0.63421 on 256 procs for 10 steps with 32768000 atoms
Performance: 6.812 ns/day, 3.523 hours/ns, 15.768 timesteps/s, 516.674 Matom-step/s
97.9% CPU use with 256 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 0.42032 | 0.43574 | 0.46368 | 0.8 | 68.71
Neigh | 0.02651 | 0.028216 | 0.031369 | 0.5 | 4.45
Comm | 0.064647 | 0.080879 | 0.11111 | 3.5 | 12.75
Output | 0.0012624 | 0.0025902 | 0.0043812 | 1.3 | 0.41
Modify | 0.047713 | 0.066232 | 0.080613 | 3.1 | 10.44
Other | | 0.02056 | | | 3.24
Nlocal: 128000 ave 128127 max 127867 min
Histogram: 4 14 23 26 63 44 35 24 16 7
Nghost: 49871 ave 50004 max 49744 min
Histogram: 7 16 22 36 43 63 27 24 13 5
Neighs: 4.81815e+06 ave 4.84289e+06 max 4.79425e+06 min
Histogram: 26 42 51 9 0 0 18 49 44 17
Total # of neighbors = 1.2334455e+09
Ave neighs/atom = 37.641769
Neighbor list builds = 1
Dangerous builds = 0
----------------------------------------------------------
Using INTEL Package without Coprocessor.
Compiler: Intel LLVM C++ 202501.0 / Intel(R) oneAPI DPC++/C++ Compiler 2025.1.0 (2025.1.0.20250317)
SIMD compiler directives: Enabled
Precision: mixed
----------------------------------------------------------
Setting up Verlet run ...
Unit style : metal
Current step : 10
Time step : 0.005
Per MPI rank memory allocation (min/avg/max) = 1067 | 1120 | 1175 Mbytes
Step Temp E_pair E_mol TotEng Press
10 475.7934 -1.1121047e+08 0 -1.091952e+08 64942.604
50 780.89876 -1.1250693e+08 0 -1.0919936e+08 52278.945
100 798.34169 -1.1258126e+08 0 -1.0919981e+08 51472.984
150 797.64371 -1.1257832e+08 0 -1.0919982e+08 51525.287
200 797.61738 -1.1257821e+08 0 -1.0919982e+08 51537.352
250 797.85512 -1.1257922e+08 0 -1.0919983e+08 51529.071
300 797.68646 -1.125785e+08 0 -1.0919982e+08 51538.823
350 797.80492 -1.12579e+08 0 -1.0919982e+08 51537.47
400 797.74785 -1.1257875e+08 0 -1.0919981e+08 51540.399
450 797.84598 -1.1257917e+08 0 -1.0919981e+08 51536.933
500 797.72449 -1.1257864e+08 0 -1.091998e+08 51543.024
510 797.68253 -1.1257846e+08 0 -1.091998e+08 51545.152
Loop time of 33.1318 on 256 procs for 500 steps with 32768000 atoms
Performance: 6.519 ns/day, 3.681 hours/ns, 15.091 timesteps/s, 494.510 Matom-step/s
99.1% CPU use with 256 MPI tasks x 1 OpenMP threads
MPI task timing breakdown:
Section | min time | avg time | max time |%varavg| %total
---------------------------------------------------------------
Pair | 21.695 | 22.046 | 23.409 | 4.7 | 66.54
Neigh | 2.4443 | 2.4968 | 2.7282 | 1.8 | 7.54
Comm | 3.555 | 4.4286 | 5.8443 | 27.3 | 13.37
Output | 0.014159 | 0.033269 | 0.056213 | 5.2 | 0.10
Modify | 1.9265 | 3.255 | 4.1497 | 31.3 | 9.82
Other | | 0.8722 | | | 2.63
Nlocal: 128000 ave 128318 max 127678 min
Histogram: 5 17 25 37 42 39 44 25 17 5
Nghost: 49867.6 ave 50189 max 49551 min
Histogram: 7 16 24 42 41 41 38 25 16 6
Neighs: 4.83163e+06 ave 4.86165e+06 max 4.79904e+06 min
Histogram: 6 18 38 38 21 18 39 39 33 6
Total # of neighbors = 1.2368967e+09
Ave neighs/atom = 37.747091
Neighbor list builds = 85
Dangerous builds = 15
Total wall time: 0:00:34
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9
To display your profiling results:
#######################################################################################################################################################################################################################
# LEVEL | REPORT | COMMAND #
#######################################################################################################################################################################################################################
# Functions | Cluster-wide | maqao lprof -df xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs_ZEN5/175-813-3591/intel/LAMMPS/run/oneview_runs/multicore/icx_2/oneview_results_1758148263/tools/lprof_npsu_run_9 #
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