| Loop id | Source Location | Source Function | Level | Max Thread Time / Walltime armclang_5 (%) | Exclusive Coverage armclang_5 (%) | Inclusive Coverage armclang_5 (%) | Max Exclusive Time Over Threads armclang_5 (s) | Max Inclusive Time Over Threads armclang_5 (s) | Exclusive Time w.r.t. Wall Time armclang_5 (s) | Inclusive Time w.r.t. Wall Time armclang_5 (s) | Nb Threads armclang_5 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing armclang_5 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect | Array Access Efficiency |
|---|
| 17679 | exec - pair_eam.cpp:272-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 47.26 | 46.92 | 46.92 | 203.28 | 203.28 | 200.93 | 200.93 | 64 | 13.51 | 27.03 | 2.31 | 1.67 | 4.46 | 1.01 | NA | NA | NA | NA | NA | 0.00 |
| 17682 | exec - pair_eam.cpp:197-217 | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 28.83 | 28.82 | 28.82 | 124.02 | 124.02 | 123.44 | 123.44 | 64 | 12.3 | 27.57 | 1.73 | 1.58 | 3.66 | 1.01 | 2.75 | 0 | 0 | 3 | 5 | 43.71 |
| 1167 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 12.77 | 12.67 | 12.67 | 54.94 | 54.94 | 54.25 | 54.25 | 64 | 5.56 | 22.92 | 3 | 1.93 | 5.54 | 1.01 | NA | NA | NA | NA | NA | 0.00 |
| 10352 | exec - fix_nve.cpp:98-106 | LAMMPS_NS::FixNVE::initial_integrate(int) | Single | 2.28 | 2.27 | 2.27 | 9.82 | 9.82 | 9.71 | 9.71 | 64 | 7.14 | 26.34 | 1.25 | 1.18 | 4.08 | 1.01 | NA | NA | NA | NA | NA | 0.00 |
| 1166 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | InBetween | 1.80 | 1.70 | 14.42 | 7.73 | 62.34 | 7.29 | 61.76 | 64 | 11.11 | 20.83 | 2.7 | 1 | 6.17 | 1.06 | NA | NA | NA | NA | NA | 0.00 |
| 10354 | exec - fix_nve.cpp:138-143 | LAMMPS_NS::FixNVE::final_integrate() | Single | 1.43 | 1.40 | 1.40 | 6.14 | 6.14 | 5.98 | 5.98 | 64 | 6.67 | 25.83 | 1.38 | 1.32 | 2.76 | 1.03 | NA | NA | NA | NA | NA | 0.00 |
| 17678 | exec - pair_eam.cpp:261-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.97 | 0.86 | 47.77 | 4.16 | 206.76 | 3.68 | 204.61 | 64 | 16.67 | 25 | 4.17 | 1 | 5.71 | 1.13 | NA | NA | NA | NA | NA | 0.00 |
| 6421 | exec - comm_brick.cpp:841-844 | LAMMPS_NS::CommBrick::borders() | Innermost | 0.52 | 0.49 | 0.49 | 2.24 | 2.24 | 2.10 | 2.10 | 64 | 0 | 17.5 | 3 | 1 | 7.38 | 1.07 | NA | NA | NA | NA | NA | 0.00 |
| 17681 | exec - pair_eam.cpp:188-217 | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.53 | 0.49 | 29.31 | 2.28 | 126.19 | 2.08 | 125.52 | 64 | 11.11 | 23.61 | 4 | 1 | 5.05 | 1.1 | NA | NA | NA | NA | NA | 0.00 |
| 17680 | exec - pair_eam.cpp:232-249 | LAMMPS_NS::PairEAM::compute(int, int) | Single | 0.37 | 0.34 | 0.34 | 1.60 | 1.60 | 1.47 | 1.47 | 64 | 9.09 | 26.14 | 1.52 | 1.31 | 4.14 | 1.09 | NA | NA | NA | NA | NA | 0.00 |
| 5665 | exec - atom_vec.cpp:735-739 | LAMMPS_NS::AtomVec::unpack_reverse(int, int*, double*) | Single | 0.26 | 0.23 | 0.23 | 1.13 | 1.13 | 0.97 | 0.97 | 64 | 7.69 | 26.92 | 1.24 | 1.24 | 3.65 | 1.17 | 2 | 0 | 0 | 1 | 1 | 62.50 |
| 938 | exec - neighbor.cpp:2430-2435 | LAMMPS_NS::Neighbor::check_distance() | Single | 0.23 | 0.21 | 0.21 | 0.99 | 0.99 | 0.88 | 0.88 | 64 | 18.18 | 29.55 | 1.69 | 1.5 | 3.37 | 1.13 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 6416 | exec - comm_brick.cpp:709-715 | LAMMPS_NS::CommBrick::exchange() | Innermost | 0.22 | 0.20 | 0.20 | 0.93 | 0.93 | 0.84 | 0.84 | 64 | 0 | 17.65 | 6.44 | 1 | 6.87 | 1.1 | NA | NA | NA | NA | NA | 0.00 |
| 5584 | exec - atom_vec.cpp:362-366 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.26 | 0.18 | 0.18 | 1.12 | 1.12 | 0.79 | 0.79 | 64 | 0 | 25 | 1.31 | 1 | 4 | 1.42 | 2 | 0 | 0 | 1 | 1 | 62.50 |
| 945 | exec - neighbor.cpp:2480-2483 | LAMMPS_NS::Neighbor::build(int) | Single | 0.18 | 0.16 | 0.16 | 0.76 | 0.76 | 0.69 | 0.69 | 64 | 0 | 25 | 1.31 | 1 | 4 | 1.12 | 2 | 0 | 0 | 2 | 0 | 75.00 |
| 1169 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | InBetween | 0.16 | 0.13 | 14.55 | 0.70 | 62.86 | 0.56 | 62.32 | 64 | 5.26 | 22.37 | 3.22 | 2 | 5.66 | 1.26 | NA | NA | NA | NA | NA | 0.00 |
| 13335 | exec - nbin_standard.cpp:254-258 | LAMMPS_NS::NBinStandard::bin_atoms() | Single | 0.12 | 0.10 | 0.10 | 0.50 | 0.50 | 0.41 | 0.41 | 64 | 0 | 14.06 | 1 | 1 | 7.06 | 1.2 | 1 | 0 | 0 | 0 | 1 | 50.00 |
| 8359 | exec - domain.cpp:806-871 | LAMMPS_NS::Domain::pbc() | Innermost | 0.09 | 0.08 | 0.08 | 0.38 | 0.38 | 0.33 | 0.33 | 64 | 3.26 | 23.23 | 1.73 | 1.33 | 4.86 | 1.15 | NA | NA | NA | NA | NA | 0.00 |
| 17689 | exec - pair_eam.cpp:939-941 | LAMMPS_NS::PairEAM::pack_forward_comm(int, int*, double*, int, int*) | Single | 0.09 | 0.07 | 0.07 | 0.37 | 0.37 | 0.29 | 0.29 | 64 | 0 | 25 | 1.25 | 1 | 4 | 1.26 | 1 | 1 | 0 | 0 | 1 | 66.67 |
| 5585 | exec - atom_vec.cpp:378-382 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.14 | 0.06 | 0.06 | 0.61 | 0.61 | 0.27 | 0.27 | 56 | 0 | 25 | 1.31 | 1.31 | 4 | 1.97 | 2 | 0 | 0 | 1 | 1 | 62.50 |
| 5684 | exec - atom_vec.cpp:804-811 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.09 | 0.06 | 0.06 | 0.37 | 0.37 | 0.24 | 0.24 | 64 | 0 | 26.14 | 2.08 | 1 | 4.7 | 1.54 | 1 | 0 | 0 | 1 | 4 | 25.00 |
| 1165 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 0.07 | 0.05 | 0.05 | 0.30 | 0.30 | 0.23 | 0.23 | 64 | 0 | 16.88 | 1 | 1 | 6.75 | 1.33 | NA | NA | NA | NA | NA | 0.00 |
| 17692 | exec - pair_eam.cpp:976-978 | LAMMPS_NS::PairEAM::unpack_reverse_comm(int, int*, double*) | Single | 0.07 | 0.05 | 0.05 | 0.29 | 0.29 | 0.22 | 0.22 | 64 | 0 | 25 | 1.33 | 1.19 | 4 | 1.34 | 1 | 0 | 0 | 0 | 1 | 50.00 |
| 5721 | exec - atom_vec.cpp:1035-1041 [...] | LAMMPS_NS::AtomVec::unpack_border(int, int, double*) | Single | 0.06 | 0.04 | 0.04 | 0.27 | 0.27 | 0.17 | 0.17 | 64 | 0 | 20 | 1.85 | 1 | 5.19 | 1.57 | 0 | 0 | 0 | 1 | 0 | 50.00 |
| 1947 | exec - pair.cpp:1761-1767 | LAMMPS_NS::Pair::virial_fdotr_compute() | Single | 0.03 | 0.03 | 0.03 | 0.14 | 0.14 | 0.13 | 0.13 | 64 | 0 | 25 | 1.11 | 1.05 | 4 | 1.1 | 3 | 0 | 0 | 2 | 0 | 80.00 |
| 5685 | exec - atom_vec.cpp:823-830 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.05 | 0.02 | 0.02 | 0.19 | 0.19 | 0.08 | 0.08 | 56 | 0 | 25.89 | 2.08 | 1.35 | 4.7 | 2.04 | 1 | 0 | 0 | 1 | 4 | 25.00 |
| 7939 | exec - compute_temp.cpp:90-92 | LAMMPS_NS::ComputeTemp::compute_scalar() | Single | 0.02 | 0.02 | 0.02 | 0.08 | 0.08 | 0.07 | 0.07 | 64 | 11.11 | 26.39 | 1.67 | 1.58 | 4.62 | 1.08 | NA | NA | NA | NA | NA | 0.00 |
| 17691 | exec - pair_eam.cpp:965-965 | LAMMPS_NS::PairEAM::pack_reverse_comm(int, int, double*) | Single | 0.02 | 0.01 | 0.01 | 0.10 | 0.10 | 0.05 | 0.05 | 64 | 0 | 25 | 1 | 1 | 4 | 2.14 | 0 | 0 | 0 | 0 | 0 | 0.00 |
| 17690 | exec - pair_eam.cpp:954-954 | LAMMPS_NS::PairEAM::unpack_forward_comm(int, int, double*) | Single | 0.02 | 0.01 | 0.01 | 0.06 | 0.06 | 0.04 | 0.04 | 64 | 0 | 25 | 1 | 1 | 4 | 1.76 | 1 | 0 | 0 | 0 | 0 | 100.00 |
| 1168 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Outermost | 0.01 | 0.01 | 14.56 | 0.06 | 62.88 | 0.02 | 62.35 | 63 | 0 | 25 | 1 | 1 | 4 | 2.19 | NA | NA | NA | NA | NA | 0.00 |
