sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
/bin/sh: module: line 1: syntax error: unexpected end of file
/bin/sh: error importing function definition for `module'
/bin/sh: ml: line 1: syntax error: unexpected end of file
/bin/sh: error importing function definition for `ml'
/bin/sh: _module_raw: line 1: syntax error: unexpected end of file
/bin/sh: error importing function definition for `_module_raw'
/bin/sh: which: line 1: syntax error: unexpected end of file
/bin/sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
* Info: Detected 2 Lprof instances in gmz16.benchmarkcenter.megware.com: processes-per-node/ppn set accordingly.
If this is incorrect, rerun with an explicit value for this setting
* Info: Selecting the 'perf-high-ppn' engine for node gmz16.benchmarkcenter.megware.com
* Info: "ref-cycles" not supported on gmz16.benchmarkcenter.megware.com: fallback to "cpu-clock"
* Warning: Found no event able to derive walltime: prepending cpu-clock
* Info: Process launched (host gmz16.benchmarkcenter.megware.com, process 265799)
* Info: Process launched (host gmz16.benchmarkcenter.megware.com, process 265800)miniqmc not built from git repository
number of ranks : 2, number of accelerators : 0
Number of orbitals/splines = 3072
Tile size = 3072
Number of tiles = 1
Number of electrons = 6144
Rmax = 1.7
AcceptanceRatio = 0.5
Iterations = 5
MPI processes = 2
OpenMP threads = 96
Number of walkers per rank = 96
SPO coefficients size = 1572864000 bytes (1500 MB)
delayed update rank = 32
Using the reference implementation for Jastrow,
determinant update, and distance table + einspline of the
reference implementation
==================================
Use --enable-timers= command line option to increase or decrease level of timing information
Stack timer profile
Timer Inclusive_time Exclusive_time Calls Time_per_call
Setup 0.0965 0.0965 1 0.096460945
ParticleSet:::update 0.0000 0.0000 1 0.000000690
Total 231.6712 16.9640 1 231.671187383
Diffusion 115.1741 0.0515 5 23.034829912
Complete Updates 2.0531 0.0001 5 0.410628793
DeterminantRef::update 2.0530 2.0530 10 0.205303907
Current Gradient 1.7126 0.0384 30720 0.000055750
DeterminantRef::ratio 1.6624 1.6624 30720 0.000054113
OneBodyJastrowRef 0.0069 0.0069 30720 0.000000224
TwoBodyJastrowRef 0.0050 0.0050 30720 0.000000162
Kinetic Energy 1.2231 1.2216 5 0.244615175
OneBodyJastrowRef 0.0009 0.0009 5 0.000172826
TwoBodyJastrowRef 0.0006 0.0006 5 0.000124930
New Gradient 10.4468 0.0482 30720 0.000340064
DeterminantRef::ratio 0.0844 0.0844 30720 0.000002746
DeterminantRef::spovgl 9.4132 0.5337 30720 0.000306418
Single-Particle Orbitals 8.8794 8.8794 30720 0.000289044
OneBodyJastrowRef 0.1087 0.1087 30720 0.000003539
TwoBodyJastrowRef 0.7923 0.7923 30720 0.000025792
ParticleSet:::acceptMove 2.7328 0.0153 15371 0.000177792
DTAAOMPTarget::update_e_e 2.6770 2.6770 15371 0.000174158
DTABOMPTarget::update_ion_e 0.0405 0.0405 15371 0.000002636
ParticleSet:::computeNewPosDT 0.9892 0.0165 30720 0.000032202
DTAAOMPTarget::move_e_e 0.8296 0.8296 30720 0.000027004
DTABOMPTarget::move_ion_e 0.1432 0.1432 30720 0.000004660
ParticleSet:::donePbyP 0.0000 0.0000 5 0.000007624
Update 95.9650 0.0215 15371 0.006243248
DeterminantRef::update 94.9194 94.9194 15371 0.006175224
OneBodyJastrowRef 0.0041 0.0041 15371 0.000000264
TwoBodyJastrowRef 1.0201 1.0201 15371 0.000066362
Initialization 36.8586 2.8649 1 36.858588981
DeterminantRef::inverse 30.2785 30.2785 2 15.139253723
DeterminantRef::spovgl 3.1822 0.2251 2 1.591082443
Single-Particle Orbitals 2.9570 2.9570 6144 0.000481285
OneBodyJastrowRef 0.0056 0.0056 1 0.005550553
ParticleSet:::update 0.4690 0.3258 2 0.234507658
DTAAOMPTarget::evaluate_e_e 0.1007 0.1007 1 0.100711538
DTABOMPTarget::evaluate_ion_e 0.0425 0.0015 1 0.042537269
DTABOMPTarget::offload_ion_e 0.0410 0.0410 1 0.041003518
TwoBodyJastrowRef 0.0584 0.0584 1 0.058437740
Pseudopotential 62.6745 0.3152 5 12.534897939
DeterminantRef::spoval 50.9986 1.9543 10215 0.004992519
Single-Particle Orbitals 49.0443 49.0443 122580 0.000400101
OneBodyJastrowRef 0.1963 0.1963 10215 0.000019216
ParticleSet:::update 8.4931 0.0676 10215 0.000831434
DTABOMPTarget::evaluate_e_virtual 7.6040 0.0348 10215 0.000744394
DTABOMPTarget::offload_e_virtual 7.5692 7.5692 10215 0.000740992
DTABOMPTarget::evaluate_ion_virtual 0.8215 0.0231 10215 0.000080418
DTABOMPTarget::offload_ion_virtual 0.7984 0.7984 10215 0.000078160
TwoBodyJastrowRef 2.6713 2.6713 10215 0.000261512
========== Throughput ============
Total throughput ( N_walkers * N_elec^3 / Total time ) = 1.92213e+11
Diffusion throughput ( N_walkers * N_elec^3 / Diffusion time ) = 3.86634e+11
Pseudopotential throughput ( N_walkers * N_elec^2 / Pseudopotential time ) = 1.15641e+08
* Info: Process finished (host gmz16.benchmarkcenter.megware.com, process 265800)
* Warning: (host gmz16.benchmarkcenter.megware.com, process 265800) Observed more threads (97) than expected (96): in case of high IO overhead or suspicious profile, rerun with maximum-threads-per-process=97.
* Info: Process finished (host gmz16.benchmarkcenter.megware.com, process 265799)
* Warning: (host gmz16.benchmarkcenter.megware.com, process 265799) Observed more threads (97) than expected (96): in case of high IO overhead or suspicious profile, rerun with maximum-threads-per-process=97.
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
sh: module: line 1: syntax error: unexpected end of file
sh: error importing function definition for `module'
sh: ml: line 1: syntax error: unexpected end of file
sh: error importing function definition for `ml'
sh: _module_raw: line 1: syntax error: unexpected end of file
sh: error importing function definition for `_module_raw'
sh: which: line 1: syntax error: unexpected end of file
sh: error importing function definition for `which'
Your experiment path is /beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/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/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Functions | Per-node | maqao lprof -df -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Functions | Per-process | maqao lprof -df -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Functions | Per-thread | maqao lprof -df -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Loops | Cluster-wide | maqao lprof -dl xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Loops | Per-node | maqao lprof -dl -dn xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Loops | Per-process | maqao lprof -dl -dp xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
# Loops | Per-thread | maqao lprof -dl -dt xp=/beegfs/hackathon/users/eoseret/qaas_runs/170-855-3059/intel/miniqmc/run/oneview_runs/defaults/orig/oneview_results_1708554408/tools/lprof_npsu_run_0 #
#################################################################################################################################################################################################################
