| Loop id | Source Location | Source Function | Level | Max Thread Time / Walltime icx_8 (%) | Exclusive Coverage icx_8 (%) | Inclusive Coverage icx_8 (%) | Max Exclusive Time Over Threads icx_8 (s) | Max Inclusive Time Over Threads icx_8 (s) | Exclusive Time w.r.t. Wall Time icx_8 (s) | Inclusive Time w.r.t. Wall Time icx_8 (s) | Nb Threads icx_8 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing icx_8 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect | Array Access Efficiency |
|---|
| 33829 | exec - pair_eam.cpp:181-326 [...] | _ZN9LAMMPS_NS7PairEAM7computeEii.A | Innermost | 25.93 | 29.10 | 29.10 | 45.54 | 45.54 | 50.30 | 50.30 | 192 | 34.65 | 16.4 | 1.41 | 1.87 | 9 | 1.05 | NA | NA | NA | NA | NA | 0.00 |
| 33836 | exec - pair_eam.cpp:181-217 [...] | _ZN9LAMMPS_NS7PairEAM7computeEii.A | Innermost | 17.28 | 19.60 | 19.60 | 30.35 | 30.35 | 33.87 | 33.87 | 192 | 24.52 | 15.23 | 1.01 | 2.22 | 7.55 | 1.04 | 2.75 | 1 | 0 | 3 | 5 | 48.96 |
| 1678 | exec - npair_bin.cpp:115-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 7.75 | 8.86 | 8.86 | 13.61 | 13.61 | 15.31 | 15.31 | 192 | 16.67 | 13.02 | 1.67 | 1.9 | 10.51 | 1.03 | NA | NA | NA | NA | NA | 0.00 |
| 1677 | exec - npair_bin.cpp:112-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | InBetween | 1.45 | 1.54 | 10.40 | 2.55 | 16.07 | 2.66 | 17.97 | 192 | 0 | 10.42 | 1 | 1 | 14 | 1.11 | NA | NA | NA | NA | NA | 0.00 |
| 18427 | exec - fix_nve.cpp:98-106 | _ZN9LAMMPS_NS6FixNVE17initial_integrateEi.A | Single | 1.31 | 1.32 | 1.32 | 2.30 | 2.30 | 2.28 | 2.28 | 192 | 0 | 12.5 | 1.11 | 1.16 | 8 | 1.17 | 0.5 | 3 | 0 | 1.5 | 0.5 | 87.50 |
| 18429 | exec - fix_nve.cpp:138-143 | _ZN9LAMMPS_NS6FixNVE15final_integrateEv.A | Single | 0.89 | 0.86 | 0.86 | 1.56 | 1.56 | 1.48 | 1.48 | 192 | 0 | 12.5 | 1 | 1.29 | 8 | 1.22 | 0.5 | 2.5 | 0 | 1 | 0.5 | 87.50 |
| 10588 | exec - comm_brick.cpp:841-844 | _ZN9LAMMPS_NS9CommBrick7bordersEv.A | Innermost | 0.27 | 0.24 | 0.24 | 0.48 | 0.48 | 0.41 | 0.41 | 192 | 0 | 10.94 | 1.78 | 1 | 11.23 | 1.35 | 1.5 | 1 | 0 | 1.75 | 0.75 | 72.02 |
| 33835 | exec - pair_eam.cpp:181-217 [...] | _ZN9LAMMPS_NS7PairEAM7computeEii.A | Outermost | 0.24 | 0.22 | 19.82 | 0.42 | 30.66 | 0.38 | 34.26 | 192 | 8.33 | 11.46 | 3.8 | 1 | 10.86 | 1.27 | NA | NA | NA | NA | NA | 0.00 |
| 1338 | exec - neighbor.cpp:2430-2435 | _ZN9LAMMPS_NS8Neighbor14check_distanceEv.A | Single | 0.23 | 0.19 | 0.19 | 0.41 | 0.41 | 0.33 | 0.33 | 192 | 36.36 | 17.05 | 1 | 2.35 | 6.67 | 1.42 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 33830 | exec - pair_eam.cpp:232-240 | _ZN9LAMMPS_NS7PairEAM7computeEii.A | Single | 0.23 | 0.17 | 0.17 | 0.40 | 0.40 | 0.30 | 0.30 | 192 | 6.25 | 12.11 | 1.07 | 2.14 | 9.23 | 1.55 | 1 | 1 | 0 | 1 | 6 | 27.78 |
| 33828 | exec - pair_eam.cpp:181-326 [...] | _ZN9LAMMPS_NS7PairEAM7computeEii.A | Outermost | 0.20 | 0.17 | 29.26 | 0.34 | 45.79 | 0.29 | 50.58 | 192 | 20 | 13.75 | 2.71 | 1 | 9.81 | 1.4 | NA | NA | NA | NA | NA | 0.00 |
| 9240 | exec - atom_vec.cpp:735-739 | _ZN9LAMMPS_NS7AtomVec14unpack_reverseEiPiPd.A | Single | 0.20 | 0.16 | 0.16 | 0.35 | 0.35 | 0.28 | 0.28 | 192 | 0 | 12.5 | 1.1 | 1.19 | 8 | 1.45 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 1346 | exec - neighbor.cpp:2480-2483 | _ZN9LAMMPS_NS8Neighbor5buildEi.A | Single | 0.16 | 0.15 | 0.15 | 0.28 | 0.28 | 0.26 | 0.26 | 192 | 0 | 12.5 | 1.33 | 1 | 8 | 1.24 | 0 | 2 | 0 | 8 | 0 | 60.00 |
| 9150 | exec - atom_vec.cpp:362-366 | _ZN9LAMMPS_NS7AtomVec9pack_commEiPiPdiS1_.A | Single | 0.18 | 0.14 | 0.14 | 0.31 | 0.31 | 0.24 | 0.24 | 192 | 0 | 12.5 | 1.14 | 1 | 8 | 1.52 | 0 | 2 | 0 | 2 | 1 | 60.00 |
| 10585 | exec - comm_brick.cpp:709-715 | _ZN9LAMMPS_NS9CommBrick8exchangeEv.A | Innermost | 0.10 | 0.08 | 0.08 | 0.18 | 0.18 | 0.14 | 0.14 | 192 | 0 | 9.38 | 2.89 | 1 | 13.96 | 1.5 | NA | NA | NA | NA | NA | 0.00 |
| 1676 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Outermost | 0.07 | 0.05 | 10.45 | 0.13 | 16.13 | 0.09 | 18.06 | 192 | 11.43 | 10.71 | 4.5 | 1 | 11.68 | 1.62 | NA | NA | NA | NA | NA | 0.00 |
| 23909 | exec - nbin_standard.cpp:254-258 | _ZN9LAMMPS_NS12NBinStandard9bin_atomsEv.A | Single | 0.06 | 0.05 | 0.05 | 0.11 | 0.11 | 0.08 | 0.08 | 192 | 0 | 8.59 | 1 | 1 | 14.4 | 1.61 | 1 | 0 | 0 | 1 | 3 | 30.00 |
| 8092 | exec - domain_omp.cpp:69-150 | LAMMPS_NS::DomainOMP::pbc() [clone .extracted] | Single | 0.06 | 0.04 | 0.04 | 0.11 | 0.11 | 0.08 | 0.08 | 192 | 13.79 | 11.21 | 1.7 | 1.22 | 9.26 | 1.67 | NA | NA | NA | NA | NA | 0.00 |
| 9255 | exec - atom_vec.cpp:804-811 [...] | _ZN9LAMMPS_NS7AtomVec11pack_borderEiPiPdiS1_.A | Single | 0.07 | 0.04 | 0.04 | 0.13 | 0.13 | 0.08 | 0.08 | 192 | 0 | 12.5 | 1.4 | 1 | 8 | 2.01 | 0 | 2 | 0 | 1 | 4 | 35.71 |
| 8094 | exec - domain_omp.cpp:54-57 [...] | LAMMPS_NS::DomainOMP::pbc() [clone .extracted.19] | Single | 0.06 | 0.04 | 0.04 | 0.11 | 0.11 | 0.07 | 0.07 | 192 | 93.33 | 23.75 | 1 | 1 | 4.75 | 1.74 | 0 | 1 | 0 | 0 | 0 | 100.00 |
| 33843 | exec - pair_eam.cpp:939-941 | _ZN9LAMMPS_NS7PairEAM17pack_forward_commEiPiPdiS1_.A | Single | 0.05 | 0.04 | 0.04 | 0.09 | 0.09 | 0.06 | 0.06 | 192 | 0 | 12.5 | 1 | 1 | 8 | 1.77 | 0 | 2 | 0 | 0 | 1 | 66.67 |
| 9290 | exec - atom_vec.cpp:1035-1041 [...] | _ZN9LAMMPS_NS7AtomVec13unpack_borderEiiPd.A | Single | 0.05 | 0.03 | 0.03 | 0.10 | 0.10 | 0.05 | 0.05 | 192 | 0 | 10.42 | 2.17 | 1 | 10.95 | 2.02 | 0 | 4 | 1 | 1 | 0 | 87.50 |
| 9151 | exec - atom_vec.cpp:378-382 | _ZN9LAMMPS_NS7AtomVec9pack_commEiPiPdiS1_.A | Single | 0.11 | 0.03 | 0.03 | 0.19 | 0.19 | 0.05 | 0.05 | 144 | 0 | 12.5 | 1.14 | 1.28 | 8 | 3.23 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 33849 | exec - pair_eam.cpp:976-978 | _ZN9LAMMPS_NS7PairEAM19unpack_reverse_commEiPiPd.A | Single | 0.05 | 0.03 | 0.03 | 0.09 | 0.09 | 0.05 | 0.05 | 192 | 0 | 12.5 | 1 | 1.28 | 8 | 2.28 | 0 | 2 | 0 | 0 | 1 | 66.67 |
| 2377 | exec - pair.cpp:1761-1767 | _ZN9LAMMPS_NS4Pair20virial_fdotr_computeEv.A | Single | 0.03 | 0.02 | 0.02 | 0.06 | 0.06 | 0.04 | 0.04 | 192 | 0 | 12.5 | 1.11 | 1.1 | 8 | 1.68 | 1 | 2 | 0 | 2 | 0 | 80.00 |
| 13433 | exec - compute_temp.cpp:90-92 | _ZN9LAMMPS_NS11ComputeTemp14compute_scalarEv.A | Single | 0.02 | 0.01 | 0.01 | 0.04 | 0.04 | 0.02 | 0.02 | 190 | 14.09 | 13.38 | 1 | 1.79 | 9.57 | 2.26 | 0 | 1.5 | 1 | 1 | 0.75 | 71.67 |
| 9256 | exec - atom_vec.cpp:823-830 [...] | _ZN9LAMMPS_NS7AtomVec11pack_borderEiPiPdiS1_.A | Single | 0.05 | 0.01 | 0.01 | 0.09 | 0.09 | 0.02 | 0.02 | 136 | 0 | 12.5 | 1.4 | 1.45 | 8 | 4.23 | 0 | 2 | 0 | 1 | 4 | 35.71 |
| 33833 | exec - pair_eam.cpp:232-248 | _ZN9LAMMPS_NS7PairEAM7computeEii.A | Single | 0.02 | 0.01 | 0.01 | 0.03 | 0.03 | 0.01 | 0.01 | 167 | 4.64 | 12.5 | 1.01 | 1.69 | 8.38 | 2.69 | 2 | 1 | 0 | 1 | 8 | 29.17 |
