| Loop id | Source Location | Source Function | Level | Max Thread Time / Walltime icx_0 (%) | Exclusive Coverage icx_0 (%) | Inclusive Coverage icx_0 (%) | Max Exclusive Time Over Threads icx_0 (s) | Max Inclusive Time Over Threads icx_0 (s) | Exclusive Time w.r.t. Wall Time icx_0 (s) | Inclusive Time w.r.t. Wall Time icx_0 (s) | Nb Threads icx_0 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing icx_0 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect | Array Access Efficiency |
|---|
| 19512 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 23.02 | 25.31 | 25.31 | 41.51 | 41.51 | 44.81 | 44.81 | 192 | 18.33 | 14.17 | 1.4 | 1.76 | 9.75 | 1.05 | NA | NA | NA | NA | NA | 0.00 |
| 19521 | exec - pair_eam.cpp:181-217 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 16.98 | 18.79 | 18.79 | 30.61 | 30.61 | 33.26 | 33.26 | 192 | 19.06 | 14.41 | 1 | 2 | 7.85 | 1.04 | 2.75 | 1 | 0 | 3 | 5 | 48.96 |
| 1062 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 7.55 | 8.23 | 8.23 | 13.62 | 13.62 | 14.58 | 14.58 | 192 | 0 | 10.23 | 2.5 | 1.63 | 11.43 | 1.06 | NA | NA | NA | NA | NA | 0.00 |
| 1061 | exec - npair_bin.cpp:112-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | InBetween | 1.58 | 1.63 | 9.93 | 2.85 | 16.17 | 2.88 | 17.58 | 192 | 0 | 10 | 1 | 1 | 14.22 | 1.12 | NA | NA | NA | NA | NA | 0.00 |
| 11232 | exec - fix_nve.cpp:98-106 | LAMMPS_NS::FixNVE::initial_integrate(int) | Single | 1.28 | 1.25 | 1.25 | 2.30 | 2.30 | 2.22 | 2.22 | 192 | 0 | 12.5 | 1.11 | 1.16 | 8 | 1.17 | 0.5 | 3 | 0 | 1.5 | 0.5 | 87.50 |
| 11234 | exec - fix_nve.cpp:138-143 | LAMMPS_NS::FixNVE::final_integrate() | Single | 0.89 | 0.82 | 0.82 | 1.60 | 1.60 | 1.45 | 1.45 | 192 | 0 | 12.5 | 1 | 1.29 | 8 | 1.24 | 0.5 | 2.5 | 0 | 1 | 0.5 | 87.50 |
| 19514 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 0.69 | 0.71 | 0.71 | 1.24 | 1.24 | 1.25 | 1.25 | 192 | 16.39 | 13.93 | 1.42 | 1.74 | 9.71 | 1.12 | NA | NA | NA | NA | NA | 0.00 |
| 7120 | exec - comm_brick.cpp:841-844 | LAMMPS_NS::CommBrick::borders() | Innermost | 0.24 | 0.22 | 0.22 | 0.44 | 0.44 | 0.38 | 0.38 | 192 | 0 | 10.94 | 1.8 | 1 | 11.17 | 1.3 | 1.5 | 1 | 0 | 1.75 | 0.75 | 72.02 |
| 19520 | exec - pair_eam.cpp:181-217 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.24 | 0.21 | 19.00 | 0.43 | 31.04 | 0.37 | 33.64 | 192 | 8.33 | 11.46 | 3.8 | 1 | 10.86 | 1.31 | NA | NA | NA | NA | NA | 0.00 |
| 19511 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.22 | 0.18 | 25.49 | 0.39 | 41.82 | 0.32 | 45.13 | 192 | 20 | 13.13 | 2.71 | 1 | 10.13 | 1.41 | NA | NA | NA | NA | NA | 0.00 |
| 829 | exec - neighbor.cpp:2430-2435 | LAMMPS_NS::Neighbor::check_distance() | Single | 0.21 | 0.18 | 0.18 | 0.39 | 0.39 | 0.32 | 0.32 | 192 | 44.44 | 18.06 | 1 | 1.88 | 6.4 | 1.38 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 19515 | exec - pair_eam.cpp:232-240 | LAMMPS_NS::PairEAM::compute(int, int) | Single | 0.23 | 0.16 | 0.16 | 0.41 | 0.41 | 0.29 | 0.29 | 192 | 0 | 10.94 | 1.44 | 1.93 | 11.5 | 1.61 | 2 | 1 | 0 | 1 | 6 | 35.00 |
| 6385 | exec - atom_vec.cpp:735-739 | LAMMPS_NS::AtomVec::unpack_reverse(int, int*, double*) | Single | 0.21 | 0.15 | 0.15 | 0.38 | 0.38 | 0.27 | 0.27 | 192 | 0 | 12.5 | 1.1 | 1.19 | 8 | 1.58 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 838 | exec - neighbor.cpp:2480-2483 | LAMMPS_NS::Neighbor::build(int) | Single | 0.16 | 0.14 | 0.14 | 0.28 | 0.28 | 0.26 | 0.26 | 192 | 0 | 12.5 | 1.33 | 1 | 8 | 1.26 | 0 | 2 | 0 | 8 | 0 | 60.00 |
| 6310 | exec - atom_vec.cpp:362-366 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.17 | 0.13 | 0.13 | 0.31 | 0.31 | 0.22 | 0.22 | 192 | 0 | 12.5 | 1.14 | 1 | 8 | 1.56 | 0 | 2 | 0 | 2 | 1 | 60.00 |
| 7116 | exec - comm_brick.cpp:709-715 | LAMMPS_NS::CommBrick::exchange() | Innermost | 0.12 | 0.09 | 0.09 | 0.21 | 0.21 | 0.16 | 0.16 | 192 | 0 | 9.38 | 2.89 | 1 | 13.96 | 1.5 | NA | NA | NA | NA | NA | 0.00 |
| 1063 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 0.09 | 0.07 | 0.07 | 0.17 | 0.17 | 0.13 | 0.13 | 192 | 0 | 10.69 | 1.72 | 1.62 | 11.65 | 1.51 | NA | NA | NA | NA | NA | 0.00 |
| 1060 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Outermost | 0.08 | 0.05 | 9.98 | 0.14 | 16.28 | 0.09 | 17.68 | 192 | 0 | 9.03 | 4.5 | 1 | 12.71 | 1.74 | NA | NA | NA | NA | NA | 0.00 |
| 14429 | exec - nbin_standard.cpp:254-258 | LAMMPS_NS::NBinStandard::bin_atoms() | Single | 0.07 | 0.04 | 0.04 | 0.12 | 0.12 | 0.08 | 0.08 | 192 | 0 | 8.59 | 1 | 1 | 14.4 | 1.79 | 1 | 0 | 0 | 1 | 3 | 30.00 |
| 5252 | exec - domain_omp.cpp:69-150 | LAMMPS_NS::DomainOMP::pbc() [clone .extracted] | Single | 0.06 | 0.04 | 0.04 | 0.11 | 0.11 | 0.07 | 0.07 | 192 | 13.64 | 11.93 | 1.33 | 1.17 | 8.71 | 1.83 | NA | NA | NA | NA | NA | 0.00 |
| 6400 | exec - atom_vec.cpp:804-811 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.06 | 0.04 | 0.04 | 0.11 | 0.11 | 0.07 | 0.07 | 192 | 0 | 12.5 | 1.4 | 1 | 8 | 1.84 | 0 | 2 | 0 | 1 | 4 | 35.71 |
| 19530 | exec - pair_eam.cpp:939-941 | LAMMPS_NS::PairEAM::pack_forward_comm(int, int*, double*, int, int*) | Single | 0.07 | 0.03 | 0.03 | 0.12 | 0.12 | 0.06 | 0.06 | 191 | 0 | 12.5 | 1 | 1 | 8 | 2.22 | 0 | 2 | 0 | 0 | 1 | 66.67 |
| 19538 | exec - pair_eam.cpp:976-978 | LAMMPS_NS::PairEAM::unpack_reverse_comm(int, int*, double*) | Single | 0.05 | 0.03 | 0.03 | 0.09 | 0.09 | 0.05 | 0.05 | 192 | 0 | 12.5 | 1 | 1.28 | 8 | 2.2 | 0 | 2 | 0 | 0 | 1 | 66.67 |
| 6432 | exec - atom_vec.cpp:1035-1041 [...] | LAMMPS_NS::AtomVec::unpack_border(int, int, double*) | Single | 0.06 | 0.03 | 0.03 | 0.12 | 0.12 | 0.05 | 0.05 | 192 | 0 | 10.42 | 2.17 | 1 | 10.95 | 2.82 | 0 | 4 | 1 | 1 | 0 | 87.50 |
| 6311 | exec - atom_vec.cpp:378-382 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.09 | 0.03 | 0.03 | 0.17 | 0.17 | 0.04 | 0.04 | 144 | 0 | 12.5 | 1.14 | 1.28 | 8 | 3.15 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 1838 | exec - pair.cpp:1761-1767 | LAMMPS_NS::Pair::virial_fdotr_compute() | Single | 0.03 | 0.02 | 0.02 | 0.05 | 0.05 | 0.04 | 0.04 | 192 | 0 | 12.5 | 1.11 | 1.1 | 8 | 1.61 | 1 | 2 | 0 | 2 | 0 | 80.00 |
| 8646 | exec - compute_temp.cpp:90-92 | LAMMPS_NS::ComputeTemp::compute_scalar() | Single | 0.02 | 0.01 | 0.01 | 0.04 | 0.04 | 0.02 | 0.02 | 192 | 100 | 75.76 | 1.02 | 1 | 1.05 | 2.04 | 0 | 3 | 0 | 0 | 4 | 42.86 |
| 6401 | exec - atom_vec.cpp:823-830 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.04 | 0.01 | 0.01 | 0.06 | 0.06 | 0.02 | 0.02 | 136 | 0 | 12.5 | 1.4 | 1.45 | 8 | 3.21 | 0 | 2 | 0 | 1 | 4 | 35.71 |
| 19518 | exec - pair_eam.cpp:232-248 | LAMMPS_NS::PairEAM::compute(int, int) | Single | 0.02 | 0.01 | 0.01 | 0.04 | 0.04 | 0.01 | 0.01 | 166 | 3.57 | 12.05 | 1.39 | 1.55 | 10.26 | 3.61 | 2 | 1 | 0 | 1 | 8 | 29.17 |
| 19513 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.01 | 0.00 | 0.71 | 0.02 | 1.25 | 0.01 | 1.26 | 127 | 22.22 | 13.89 | 2.71 | 1 | 10.13 | 2.63 | NA | NA | NA | NA | NA | 0.00 |
