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vmc.mov1 - 2023-11-14 15:06:12 - MAQAO 2.18.0

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Global Metrics

Total Time (s)72.61
Profiled Time (s)71.18
Time in analyzed loops (%)12.3
Time in analyzed innermost loops (%)11.9
Time in user code (%)12.8
Compilation Options Score (%)100
Array Access Efficiency (%)91.5
Potential Speedups
Perfect Flow Complexity1.00
Perfect OpenMP + MPI + Pthread1.00
Perfect OpenMP + MPI + Pthread + Perfect Load Distribution19.3
No Scalar IntegerPotential Speedup1.01
Nb Loops to get 80%6
FP VectorisedPotential Speedup1.03
Nb Loops to get 80%9
Fully VectorisedPotential Speedup1.11
Nb Loops to get 80%11
FP Arithmetic OnlyPotential Speedup1.03
Nb Loops to get 80%6

CQA Potential Speedups Summary

Loop Based Profile

Innermost Loop Based Profile

Application Categorization

Compilation Options

Source ObjectIssue
vmc.mov1
jastrow4e.f
optci.f
multideterminante.f
determinant.f
optorb.f
optjas.f
determinant_psit.f
determinante.f
scale_dist.f
orbitals.f
multiply_slmi_mderiv.f
determinante_psit.f
nonlpsi.f
deriv_nonlpsi.f
metrop_mov1_slat.f
basis_fns.f
deriv_jastrow4.f90
optwf_sr.f90
set_input_data.f90
splfit.f
deriv_nonloc.f
get_norbterm.f90
detsav.f
distances.f
nonloc.f
slm.f90
multideterminant.f

Loop Path Count Profile

Cumulated Speedup If No Scalar Integer

Cumulated Speedup If FP Vectorized

Cumulated Speedup If Fully Vectorized

Cumulated Speedup If FP Arithmetic Only

Experiment Summary

Application/home/kcamus/trex/champ/champ/bin/vmc.mov1
Timestamp2023-11-14 15:06:12 Universal Timestamp1699974372
Number of processes observed1 Number of threads observed129
Experiment TypeOpenMP;
Machineip-172-31-68-94
Model NameAMD EPYC 9R14 96-Core Processor
Architecturex86_64 Micro ArchitectureZEN_V4
Cache Size1024 KB Number of Cores96
OS VersionLinux 6.2.0-1015-aws #15~22.04.1-Ubuntu SMP Fri Oct 6 21:37:24 UTC 2023
Architecture used during static analysisx86_64 Micro Architecture used during static analysisZEN_V4
Frequency Driveracpi-cpufreq Frequency Governorperformance
Huge Pagesmadvise Hyperthreadingoff
Number of sockets2 Number of cores per socket96
Compilation Optionsvmc.mov1: F90 Flang - 1.5 2017-05-01 '+flang -DTARGET_ARCHITECTURE=\"avx512\" -DVECTORIZATION=\"avx512\" -I/home/kcamus/trex/champ/champ/buildflang/src/module -I/home/kcamus/trex/champ/champ/buildflang/src/parser -march=native -O2 -cpp -mcmodel=large -ffree-line-length-none -g -fno-omit-frame-pointer -fPIC -D_MPI_ -DCLUSTER -ffixed-form -ffixed-line-length-132 -c -o -I/home/kcamus/openmpi/openmpi-5.0.0/_install/include -I/home/kcamus/openmpi/openmpi-5.0.0/_install/lib'

Configuration Summary

Dataset
Run Command<executable> -i vmc_optimization_15000.inp
Number Processes1
Number Nodes1
Filter{type = number ; value = 10 ; }
Profile Start{unit = none ; value = 0 ; }
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