| Loop id | Source Location | Source Function | Level | Max Thread Time / Walltime gcc_0 (%) | Exclusive Coverage gcc_0 (%) | Inclusive Coverage gcc_0 (%) | Max Exclusive Time Over Threads gcc_0 (s) | Max Inclusive Time Over Threads gcc_0 (s) | Exclusive Time w.r.t. Wall Time gcc_0 (s) | Inclusive Time w.r.t. Wall Time gcc_0 (s) | Nb Threads gcc_0 | GFLOPS gcc_0 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing gcc_0 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect | Array Access Efficiency |
|---|
| 28814 | exec - pair_eam_intel.cpp:541-588 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 19.85 | 20.72 | 20.72 | 17.74 | 17.74 | 16.04 | 16.04 | 256 | 854.12 | 22.81 | 10.53 | 1 | 2.71 | 10.33 | 1.11 | 1 | 5 | 0 | 3 | 1 | 75.00 |
| 28824 | exec - pair_eam_intel.cpp:312-323 | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 18.36 | 20.22 | 20.22 | 16.42 | 16.42 | 15.65 | 15.65 | 256 | 321.15 | 20.91 | 10.17 | 1 | 3 | 16 | 1.06 | 0 | 1 | 0 | 1 | 1 | 56.25 |
| 28813 | exec - pair_eam_intel.cpp:513-527 | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 18.20 | 19.73 | 19.73 | 16.27 | 16.27 | 15.27 | 15.27 | 256 | 332.34 | 32.39 | 12.32 | 1.13 | 2.35 | 16 | 1.07 | 0 | 1 | 0 | 1 | 2.5 | 48.21 |
| 28825 | exec - pair_eam_intel.cpp:335-359 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 8.32 | 8.87 | 8.87 | 7.44 | 7.44 | 6.87 | 6.87 | 256 | 654.05 | 4.55 | 8.24 | 1.08 | 2.29 | 9.33 | 1.09 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 26036 | exec - npair_intel.cpp:474-558 [...] | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Innermost | 6.50 | 7.05 | 7.05 | 5.82 | 5.82 | 5.46 | 5.46 | 256 | 553.78 | 22.5 | 10.47 | 1.08 | 2.83 | 16 | 1.07 | 0.5 | 4.5 | 0 | 0 | 1.5 | 77.50 |
| 26045 | exec - npair_intel.cpp:364-369 | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Innermost | 1.67 | 1.61 | 1.61 | 1.50 | 1.50 | 1.25 | 1.25 | 256 | 0.00 | 0 | 6.25 | 1.44 | 1 | 16 | 1.21 | 0 | 5 | 0 | 1 | 0 | 91.67 |
| 7069 | exec - fix_nve_intel.cpp:78-80 | LAMMPS_NS::FixNVEIntel::initial_integrate(int) | Single | 1.81 | 1.47 | 1.47 | 1.62 | 1.62 | 1.14 | 1.14 | 256 | 175.50 | 100 | 25 | 1 | 1.94 | 4 | 1.42 | 0 | 3 | 0 | 0 | 0 | 100.00 |
| 26044 | exec - npair_intel.cpp:343-381 [...] | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | InBetween | 1.42 | 1.34 | 1.73 | 1.27 | 1.56 | 1.04 | 1.34 | 256 | 4.64 | 0 | 8.75 | 1 | 1 | 15.02 | 1.23 | NA | NA | NA | NA | NA | 0.00 |
| 29004 | exec - intel_buffers.h:228-231 | void LAMMPS_NS::PairEAMIntel::compute<float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&) [clone ._omp_fn.0] | Single | 1.40 | 1.23 | 1.23 | 1.25 | 1.25 | 0.95 | 0.95 | 256 | 0.00 | 66.67 | 17.71 | 1 | 1 | 5.33 | 1.32 | 0 | 1 | 1 | 1 | 0 | 75.00 |
| 6891 | exec - fix_intel.cpp:884-885 | void LAMMPS_NS::FixIntel::add_oresults<LAMMPS_NS::IntelBuffers<float, double>::vec3_acc_t, double>(LAMMPS_NS::IntelBuffers<float, double>::vec3_acc_t const*, double const*, int, int, int, int) [clone ._omp_fn.0] | Single | 1.26 | 1.08 | 1.08 | 1.13 | 1.13 | 0.83 | 0.83 | 256 | 83.82 | 86.67 | 23.33 | 1.06 | 1.29 | 4.75 | 1.36 | 0 | 1 | 2 | 0 | 0 | 83.33 |
| 7075 | exec - fix_nve_intel.cpp:134-135 | LAMMPS_NS::FixNVEIntel::final_integrate() | Single | 1.20 | 0.91 | 0.91 | 1.07 | 1.07 | 0.70 | 0.70 | 256 | 143.01 | 100 | 25 | 1 | 1.75 | 4 | 1.53 | 0 | 2 | 0 | 0 | 0 | 100.00 |
| 28789 | exec - pair_eam_intel.cpp:541-592 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 0.66 | 0.66 | 0.66 | 0.59 | 0.59 | 0.51 | 0.51 | 256 | 822.92 | 21.21 | 10.61 | 1 | 2.57 | 11.52 | 1.16 | 1 | 5 | 0 | 3 | 1 | 75.00 |
| 28800 | exec - pair_eam_intel.cpp:312-323 | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 0.53 | 0.54 | 0.54 | 0.47 | 0.47 | 0.41 | 0.41 | 256 | 339.01 | 20.91 | 10.17 | 1 | 3 | 16 | 1.14 | 0 | 1 | 0 | 1 | 1 | 56.25 |
| 28787 | exec - pair_eam_intel.cpp:513-527 | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 0.55 | 0.53 | 0.53 | 0.50 | 0.50 | 0.41 | 0.41 | 256 | 342.09 | 32.39 | 12.32 | 1.13 | 2.35 | 16 | 1.22 | 0 | 1 | 0 | 1 | 2.5 | 48.21 |
| 7693 | exec - atom_vec.cpp:735-739 | LAMMPS_NS::AtomVec::unpack_reverse(int, int*, double*) | Single | 0.56 | 0.45 | 0.45 | 0.51 | 0.51 | 0.35 | 0.35 | 256 | 55.62 | 0 | 12.5 | 1.14 | 1.28 | 8 | 1.45 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 28812 | exec - pair_eam_intel.cpp:253-606 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Outermost | 0.50 | 0.42 | 40.88 | 0.45 | 34.32 | 0.33 | 31.64 | 256 | 591.85 | 30.43 | 13.86 | 2.41 | 2.49 | 12.24 | 1.37 | NA | NA | NA | NA | NA | 0.00 |
| 28811 | exec - pair_eam_intel.cpp:439-450 | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Single | 0.46 | 0.40 | 0.40 | 0.41 | 0.41 | 0.31 | 0.31 | 256 | 426.07 | 5.26 | 8.88 | 1 | 1.67 | 11.43 | 1.35 | 0 | 1 | 0 | 1 | 2 | 37.50 |
| 28823 | exec - pair_eam_intel.cpp:291-363 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 0, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Outermost | 0.44 | 0.38 | 29.48 | 0.40 | 23.90 | 0.30 | 22.81 | 256 | 305.90 | 22.22 | 11.81 | 2.5 | 3.48 | 15.14 | 1.34 | NA | NA | NA | NA | NA | 0.00 |
| 26047 | exec - npair_intel.cpp:353-354 | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Innermost | 0.44 | 0.38 | 0.38 | 0.39 | 0.39 | 0.29 | 0.29 | 256 | 0.05 | 100 | 25 | 1 | 1 | 4 | 1.34 | 0 | 2 | 0 | 0 | 0 | 100.00 |
| 7859 | exec - atom_vec.cpp:362-366 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.50 | 0.33 | 0.33 | 0.44 | 0.44 | 0.26 | 0.26 | 256 | 0.00 | 0 | 12.5 | 1.22 | 1 | 8 | 1.73 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 8812 | exec - memory.h:53-80 [...] | LAMMPS_NS::CommBrick::borders() | Innermost | 0.35 | 0.32 | 0.32 | 0.31 | 0.31 | 0.25 | 0.25 | 256 | 0.00 | 3.57 | 11.61 | 2.74 | 2.17 | 12.36 | 1.27 | NA | NA | NA | NA | NA | 0.00 |
| 1788 | exec - neighbor.cpp:2430-2435 | LAMMPS_NS::Neighbor::check_distance() | Single | 0.49 | 0.31 | 0.31 | 0.44 | 0.44 | 0.24 | 0.24 | 256 | 186.87 | 28.57 | 16.07 | 1 | 1.33 | 7.11 | 1.86 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 26037 | exec - npair_intel.cpp:330-762 [...] | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Outermost | 0.37 | 0.30 | 10.94 | 0.34 | 8.97 | 0.23 | 8.46 | 256 | 547.13 | 3.06 | 9.76 | 4.78 | 1 | 13.4 | 1.46 | NA | NA | NA | NA | NA | 0.00 |
| 28801 | exec - pair_eam_intel.cpp:335-359 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Innermost | 0.31 | 0.25 | 0.25 | 0.28 | 0.28 | 0.19 | 0.19 | 256 | 666.01 | 4.55 | 8.24 | 1.08 | 2.29 | 9.33 | 1.45 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 7038 | exec - intel_buffers.h:210-214 | void LAMMPS_NS::NBinIntel::bin_atoms<float, double>(LAMMPS_NS::IntelBuffers<float, double>*) [clone ._omp_fn.0] | Single | 0.27 | 0.23 | 0.23 | 0.24 | 0.24 | 0.18 | 0.18 | 256 | 0.00 | 57.14 | 16.07 | 1.17 | 1 | 6.22 | 1.34 | 0 | 3 | 0 | 1 | 0 | 87.50 |
| 26043 | exec - npair_intel.cpp:414-457 [...] | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Innermost | 0.23 | 0.18 | 0.18 | 0.20 | 0.20 | 0.14 | 0.14 | 256 | 160.19 | 13.04 | 8.97 | 1.06 | 2.25 | 15.7 | 1.47 | NA | NA | NA | NA | NA | 0.00 |
| 1884 | exec - neighbor.cpp:2480-2483 | LAMMPS_NS::Neighbor::build(int) | Single | 0.22 | 0.18 | 0.18 | 0.20 | 0.20 | 0.14 | 0.14 | 256 | 0.00 | 0 | 12.5 | 1.11 | 1 | 8 | 1.43 | 0 | 2 | 0 | 2 | 0 | 75.00 |
| 8765 | exec - comm_brick.cpp:709-1517 [...] | LAMMPS_NS::CommBrick::exchange() | Innermost | 0.17 | 0.12 | 0.12 | 0.15 | 0.15 | 0.09 | 0.09 | 256 | 0.00 | 4.76 | 11.61 | 2.6 | 2.94 | 13.57 | 1.74 | NA | NA | NA | NA | NA | 0.00 |
| 6067 | exec - domain_omp.cpp:74-150 | LAMMPS_NS::DomainOMP::pbc() [clone ._omp_fn.1] | Single | 0.15 | 0.09 | 0.09 | 0.13 | 0.13 | 0.07 | 0.07 | 256 | 0.09 | 14.63 | 12.8 | 1.97 | 1.86 | 10.73 | 1.91 | NA | NA | NA | NA | NA | 0.00 |
| 7819 | exec - atom_vec.cpp:804-811 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.13 | 0.09 | 0.09 | 0.12 | 0.12 | 0.07 | 0.07 | 256 | 0.00 | 35.71 | 14.29 | 1.18 | 1 | 8.89 | 1.83 | 0 | 2 | 0 | 1 | 4 | 35.71 |
| 7047 | exec - nbin_intel.cpp:220-225 | void LAMMPS_NS::NBinIntel::bin_atoms<float, double>(LAMMPS_NS::IntelBuffers<float, double>*) | Single | 0.11 | 0.07 | 0.07 | 0.10 | 0.10 | 0.06 | 0.06 | 256 | 208.76 | 0 | 8.93 | 1 | 1 | 14.32 | 1.78 | 1 | 0 | 0 | 3 | 0 | 62.50 |
| 19581 | exec - pair_eam.cpp:976-978 | LAMMPS_NS::PairEAM::unpack_reverse_comm(int, int*, double*) | Single | 0.11 | 0.07 | 0.07 | 0.10 | 0.10 | 0.05 | 0.05 | 256 | 122.40 | 0 | 12.5 | 1.17 | 1.65 | 8 | 1.87 | 0 | 2 | 0 | 1 | 0 | 83.33 |
| 7796 | exec - atom_vec.cpp:1035-1041 | LAMMPS_NS::AtomVec::unpack_border(int, int, double*) | Single | 0.11 | 0.07 | 0.07 | 0.10 | 0.10 | 0.05 | 0.05 | 256 | 0.00 | 0 | 10.42 | 2 | 1 | 10.67 | 1.96 | 0 | 4 | 2 | 1 | 0 | 85.71 |
| 26042 | exec - npair_intel.cpp:392-398 | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Innermost | 0.11 | 0.06 | 0.06 | 0.10 | 0.10 | 0.05 | 0.05 | 256 | 0.00 | 0 | 6.25 | 1.67 | 1 | 16 | 2.01 | 0 | 6 | 0 | 1 | 0 | 92.86 |
| 7839 | exec - atom_vec.cpp:378-382 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.21 | 0.05 | 0.05 | 0.19 | 0.19 | 0.04 | 0.04 | 184 | 60.37 | 0 | 12.5 | 1.17 | 1.56 | 8 | 3.15 | 0 | 2 | 0 | 1 | 1 | 62.50 |
| 28678 | exec - pair_eam_intel.cpp:830-832 | LAMMPS_NS::PairEAMIntel::pack_forward_comm(int, int*, double*, int, int*) | Single | 0.08 | 0.04 | 0.04 | 0.07 | 0.07 | 0.03 | 0.03 | 254 | 0.00 | 33.33 | 14.58 | 1 | 1 | 14 | 2.12 | 0 | 2 | 0 | 0 | 1 | 66.67 |
| 7046 | exec - nbin_intel.cpp:232-233 | void LAMMPS_NS::NBinIntel::bin_atoms<float, double>(LAMMPS_NS::IntelBuffers<float, double>*) | Innermost | 0.08 | 0.04 | 0.04 | 0.07 | 0.07 | 0.03 | 0.03 | 256 | 0.00 | 0 | 9.38 | 1 | 1 | 16 | 2.17 | 0 | 1 | 0 | 0 | 1 | 50.00 |
| 6981 | exec - intel_buffers.cpp:624-624 | LAMMPS_NS::IntelBuffers<float, double>::fdotr_reduce_l5(int, int, int, int, double&, double&, double&, double&, double&, double&) | Single | 0.05 | 0.03 | 0.03 | 0.05 | 0.05 | 0.02 | 0.02 | 256 | 336.07 | 16.67 | 13.8 | 1 | 1.64 | 8 | 1.99 | 3 | 0 | 3 | 0 | 0 | 87.50 |
| 19580 | exec - pair_eam.cpp:965-965 | LAMMPS_NS::PairEAM::pack_reverse_comm(int, int, double*) | Single | 0.07 | 0.03 | 0.03 | 0.06 | 0.06 | 0.02 | 0.02 | 254 | 0.42 | 100 | 25 | 1 | 1 | 4 | 2.67 | 0 | 2 | 0 | 0 | 0 | 100.00 |
| 7045 | exec - nbin_intel.cpp:229-233 | void LAMMPS_NS::NBinIntel::bin_atoms<float, double>(LAMMPS_NS::IntelBuffers<float, double>*) | Outermost | 0.06 | 0.03 | 0.07 | 0.05 | 0.10 | 0.02 | 0.05 | 253 | 0.00 | 0 | 6.88 | 1 | 1 | 15.45 | 2.25 | 0 | 0 | 0 | 2 | 0 | 50.00 |
| 28786 | exec - pair_eam_intel.cpp:465-614 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Outermost | 0.05 | 0.02 | 1.21 | 0.05 | 1.01 | 0.02 | 0.93 | 256 | 264.07 | 39.02 | 15.55 | 2.06 | 2.34 | 11.34 | 2.7 | NA | NA | NA | NA | NA | 0.00 |
| 10241 | exec - compute_temp.cpp:90-92 | LAMMPS_NS::ComputeTemp::compute_scalar() | Single | 0.05 | 0.02 | 0.02 | 0.05 | 0.05 | 0.02 | 0.02 | 256 | 256.93 | 12.5 | 10.94 | 1.04 | 1.39 | 7.41 | 2.84 | 0.5 | 2 | 0 | 0.5 | 0.5 | 87.50 |
| 28676 | exec - pair_eam_intel.cpp:847-847 | LAMMPS_NS::PairEAMIntel::unpack_forward_comm(int, int, double*) | Single | 0.06 | 0.02 | 0.02 | 0.05 | 0.05 | 0.02 | 0.02 | 241 | 0.00 | 100 | 22.92 | 1 | 1 | 4.8 | 3.11 | 0 | 2 | 0 | 0 | 0 | 100.00 |
| 28790 | exec - pair_eam_intel.cpp:439-461 | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Single | 0.04 | 0.01 | 0.01 | 0.04 | 0.04 | 0.01 | 0.01 | 256 | 653.19 | 7.61 | 9.19 | 1 | 2.08 | 12.62 | 3.13 | 1 | 1 | 0 | 2 | 2 | 50.00 |
| 7818 | exec - atom_vec.cpp:823-830 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.07 | 0.01 | 0.01 | 0.07 | 0.07 | 0.01 | 0.01 | 180 | 46.59 | 29.41 | 13.97 | 1.15 | 1.53 | 9.14 | 4.17 | 0 | 2 | 0 | 1 | 4 | 35.71 |
| 28799 | exec - pair_eam_intel.cpp:291-363 [...] | void LAMMPS_NS::PairEAMIntel::eval<1, 1, 1, float, double>(int, int, LAMMPS_NS::IntelBuffers<float, double>*, LAMMPS_NS::PairEAMIntel::ForceConst<float> const&, int, int) [clone ._omp_fn.0] | Outermost | 0.03 | 0.01 | 0.79 | 0.03 | 0.64 | 0.01 | 0.61 | 256 | 320.70 | 22.22 | 11.81 | 2.5 | 3.48 | 15.14 | 3.18 | NA | NA | NA | NA | NA | 0.00 |
| 26046 | exec - npair_intel.cpp:353-354 | void LAMMPS_NS::NPairIntel::bin_newton<float, double, 0, 0, 0, 0, 0>(int, LAMMPS_NS::NeighList*, LAMMPS_NS::IntelBuffers<float, double>*, int, int, int) [clone ._omp_fn.0] | Innermost | 0.03 | 0.01 | 0.01 | 0.03 | 0.03 | 0.01 | 0.01 | 204 | 1.30 | 0 | 6.25 | 1 | 1 | 16 | 3.13 | 0 | 2 | 0 | 0 | 0 | 100.00 |
| 4509 | exec - verlet.cpp:246-380 [...] | LAMMPS_NS::Verlet::run(int) | Single | 0.03 | 0.01 | 0.01 | 0.03 | 0.03 | 0.00 | 0.00 | 142 | 2.12 | 0.96 | 7.15 | 3.06 | 1 | 15.74 | 3.94 | NA | NA | NA | NA | NA | 0.00 |
| 7050 | exec - nbin_intel.cpp:198-198 | void LAMMPS_NS::NBinIntel::bin_atoms<float, double>(LAMMPS_NS::IntelBuffers<float, double>*) | Single | 0.02 | 0.00 | 0.00 | 0.02 | 0.02 | 0.00 | 0.00 | 118 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 2.28 | 1 | 1 | 0 | 0 | 0 | 100.00 |
| 10424 | exec - create_atoms.cpp:1470-1539 [...] | LAMMPS_NS::CreateAtoms::loop_lattice(int) | Innermost | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 256 | 755.52 | 0 | 9.8 | 1.67 | 2.22 | 13.44 | 7.01 | NA | NA | NA | NA | NA | 0.00 |
| 8740 | exec - comm_brick.cpp:552-589 | LAMMPS_NS::CommBrick::forward_comm(int) | Single | 0.02 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 52 | 0.45 | 0 | 7.26 | 1 | 1 | 15.41 | 2.74 | NA | NA | NA | NA | NA | 0.00 |
| 16043 | exec - random_park.cpp:108-111 | LAMMPS_NS::RanPark::reset(int, double*) | Single | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 135 | 59.55 | 0 | 5.66 | 1 | 1 | 30.61 | 5.09 | 0 | 1 | 0 | 0 | 0 | 100.00 |
| 8764 | exec - comm_brick.cpp:755-758 | LAMMPS_NS::CommBrick::exchange() | Innermost | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 48 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.92 | 1.67 | 0 | 0 | 0.67 | 1 | 58.33 |
| 13864 | exec - group.cpp:822-823 | LAMMPS_NS::Group::count(int) | Single | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 23 | 0.00 | 100 | 25 | 1 | 1 | 4 | 1.92 | 0 | 1 | 0 | 0 | 0 | 100.00 |
| 8049 | exec - memory.h:190-191 | LAMMPS_NS::AtomVec::grow(int) | Single | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 23 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.92 | 0 | 1 | 0 | 0 | 0 | 100.00 |
| 8051 | exec - memory.h:190-191 | LAMMPS_NS::AtomVec::grow(int) | Single | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 16 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.88 | 0 | 1 | 0 | 0 | 0 | 100.00 |
| 1592 | exec - modify.cpp:401-402 | LAMMPS_NS::Modify::initial_integrate(int) | Single | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 16 | 0.00 | 0 | 6.25 | 1 | 1 | 16 | 1.88 | 1 | 1 | 0 | 1 | 1 | 62.50 |
| 8743 | exec - comm_brick.cpp:1003-1023 | LAMMPS_NS::CommBrick::forward_comm(LAMMPS_NS::Pair*, int) | Single | 0.01 | 0.00 | 0.00 | 0.01 | 0.01 | 0.00 | 0.00 | 14 | 0.00 | 0 | 8.24 | 1 | 1 | 14.85 | 1.87 | NA | NA | NA | NA | NA | 0.00 |
