Loop id | Source Location | Source Function | Level | Max Thread Time / Walltime 8x1 (%) | Max Thread Time / Walltime 64x1 (%) | Max Thread Time / Walltime 96x1 (%) | Max Thread Time / Walltime 128x1 (%) | Max Thread Time / Walltime 160x1 (%) | Max Thread Time / Walltime 192x1 (%) | Exclusive Coverage 8x1 (%) | Exclusive Coverage 64x1 (%) | Exclusive Coverage 96x1 (%) | Exclusive Coverage 128x1 (%) | Exclusive Coverage 160x1 (%) | Exclusive Coverage 192x1 (%) | Inclusive Coverage 8x1 (%) | Inclusive Coverage 64x1 (%) | Inclusive Coverage 96x1 (%) | Inclusive Coverage 128x1 (%) | Inclusive Coverage 160x1 (%) | Inclusive Coverage 192x1 (%) | Max Exclusive Time Over Threads 8x1 (s) | Max Exclusive Time Over Threads 64x1 (s) | Max Exclusive Time Over Threads 96x1 (s) | Max Exclusive Time Over Threads 128x1 (s) | Max Exclusive Time Over Threads 160x1 (s) | Max Exclusive Time Over Threads 192x1 (s) | Max Inclusive Time Over Threads 8x1 (s) | Max Inclusive Time Over Threads 64x1 (s) | Max Inclusive Time Over Threads 96x1 (s) | Max Inclusive Time Over Threads 128x1 (s) | Max Inclusive Time Over Threads 160x1 (s) | Max Inclusive Time Over Threads 192x1 (s) | Exclusive Time w.r.t. Wall Time 8x1 (s) | Exclusive Time w.r.t. Wall Time 64x1 (s) | Exclusive Time w.r.t. Wall Time 96x1 (s) | Exclusive Time w.r.t. Wall Time 128x1 (s) | Exclusive Time w.r.t. Wall Time 160x1 (s) | Exclusive Time w.r.t. Wall Time 192x1 (s) | Inclusive Time w.r.t. Wall Time 8x1 (s) | Inclusive Time w.r.t. Wall Time 64x1 (s) | Inclusive Time w.r.t. Wall Time 96x1 (s) | Inclusive Time w.r.t. Wall Time 128x1 (s) | Inclusive Time w.r.t. Wall Time 160x1 (s) | Inclusive Time w.r.t. Wall Time 192x1 (s) | Nb Threads 8x1 | Nb Threads 64x1 | Nb Threads 96x1 | Nb Threads 128x1 | Nb Threads 160x1 | Nb Threads 192x1 | GFLOPS 8x1 | GFLOPS 64x1 | GFLOPS 96x1 | GFLOPS 128x1 | GFLOPS 160x1 | GFLOPS 192x1 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing 8x1 | Speedup If Perfect Load Balancing 64x1 | Speedup If Perfect Load Balancing 96x1 | Speedup If Perfect Load Balancing 128x1 | Speedup If Perfect Load Balancing 160x1 | Speedup If Perfect Load Balancing 192x1 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect | Array Access Efficiency | (8x1) Efficiency | (8x1) Potential Speed-Up (%) | (64x1) Efficiency | (64x1) Potential Speed-Up (%) | (96x1) Efficiency | (96x1) Potential Speed-Up (%) | (128x1) Efficiency | (128x1) Potential Speed-Up (%) | (160x1) Efficiency | (160x1) Potential Speed-Up (%) | (192x1) Efficiency | (192x1) Potential Speed-Up (%) |
---|
16401 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 47.56 | 46.16 | 44.96 | 44.30 | 44.59 | 43.51 | 47.41 | 45.77 | 44.48 | 43.66 | 42.95 | 42.22 | 47.41 | 45.77 | 44.48 | 43.66 | 42.95 | 42.22 | 761.51 | 101.58 | 70.64 | 59.14 | 51.73 | 44.73 | 761.51 | 101.58 | 70.64 | 59.14 | 51.73 | 44.73 | 758.48 | 100.32 | 69.42 | 57.78 | 49.30 | 42.74 | 758.48 | 100.32 | 69.42 | 57.78 | 49.30 | 42.74 | 8 | 64 | 96 | 128 | 160 | 192 | 31.21 | 235.89 | 340.86 | 409.54 | 480.02 | 553.83 | 20.78 | 14.53 | 1.14 | 1.69 | 8.59 | 1 | 1.01 | 1.02 | 1.03 | 1.05 | 1.05 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.95 | 2.51 | 0.91 | 3.98 | 0.82 | 7.84 | 0.77 | 9.91 | 0.74 | 11 |
16407 | exec - pair_eam.cpp:197-217 | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 31.87 | 30.84 | 30.23 | 29.51 | 28.81 | 28.70 | 31.80 | 30.64 | 29.95 | 29.14 | 28.42 | 28.39 | 31.80 | 30.64 | 29.95 | 29.14 | 28.42 | 28.39 | 510.25 | 67.86 | 47.49 | 39.40 | 33.42 | 29.51 | 510.25 | 67.86 | 47.49 | 39.40 | 33.42 | 29.51 | 508.73 | 67.15 | 46.74 | 38.57 | 32.62 | 28.75 | 508.73 | 67.15 | 46.74 | 38.57 | 32.62 | 28.75 | 8 | 64 | 96 | 128 | 160 | 192 | 22.81 | 172.71 | 248.14 | 300.44 | 355.58 | 403.44 | 26.98 | 15.76 | 1 | 1.92 | 7.62 | 1 | 1.01 | 1.02 | 1.02 | 1.03 | 1.03 | 2 | 1 | 0 | 2.5 | 4 | 51.25 | 1 | 0 | 0.95 | 1.62 | 0.91 | 2.78 | 0.82 | 5.12 | 0.78 | 6.26 | 0.74 | 7.46 |
8247 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 14.79 | 14.18 | 14.29 | 13.87 | 13.93 | 13.85 | 14.74 | 14.00 | 14.01 | 13.54 | 13.28 | 13.50 | 14.74 | 14.00 | 14.01 | 13.54 | 13.28 | 13.50 | 236.75 | 31.21 | 22.46 | 18.52 | 16.16 | 14.23 | 236.75 | 31.21 | 22.46 | 18.52 | 16.16 | 14.23 | 235.77 | 30.69 | 21.86 | 17.93 | 15.24 | 13.67 | 235.77 | 30.69 | 21.86 | 17.93 | 15.24 | 13.67 | 8 | 64 | 96 | 128 | 160 | 192 | 10.82 | 83.67 | 117.00 | 143.10 | 168.06 | 187.43 | 20 | 12.81 | 2.71 | 1.84 | 10.51 | 1 | 1.02 | 1.03 | 1.04 | 1.06 | 1.05 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.96 | 0.56 | 0.9 | 1.42 | 0.82 | 2.41 | 0.77 | 3.01 | 0.72 | 3.79 |
8246 | exec - npair_bin.cpp:112-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | InBetween | 3.07 | 3.06 | 3.07 | 3.12 | 2.97 | 3.04 | 2.99 | 2.79 | 2.84 | 2.69 | 2.63 | 2.71 | 17.86 | 16.92 | 16.97 | 16.35 | 16.04 | 16.32 | 49.22 | 6.73 | 4.83 | 4.16 | 3.44 | 3.12 | 286.76 | 37.48 | 26.89 | 22.11 | 18.78 | 16.82 | 47.83 | 6.12 | 4.44 | 3.56 | 3.02 | 2.74 | 285.71 | 37.08 | 26.49 | 21.63 | 18.41 | 16.53 | 8 | 64 | 96 | 128 | 160 | 192 | 11.21 | 84.66 | 117.67 | 145.58 | 171.75 | 188.59 | 0 | 10 | 1 | 1 | 14.32 | 1.03 | 1.1 | 1.09 | 1.17 | 1.14 | 1.14 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.98 | 0.06 | 0.9 | 0.29 | 0.84 | 0.43 | 0.79 | 0.55 | 0.73 | 0.74 |
16400 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.40 | 0.50 | 0.46 | 0.52 | 0.58 | 0.59 | 0.38 | 0.40 | 0.37 | 0.39 | 0.39 | 0.38 | 47.80 | 46.17 | 44.85 | 44.05 | 43.34 | 42.59 | 6.48 | 1.10 | 0.72 | 0.70 | 0.67 | 0.61 | 767.66 | 102.31 | 71.16 | 59.70 | 52.36 | 45.33 | 6.16 | 0.87 | 0.57 | 0.52 | 0.45 | 0.38 | 764.63 | 101.18 | 69.99 | 58.30 | 49.75 | 43.12 | 8 | 64 | 96 | 128 | 160 | 192 | 16.80 | 143.95 | 229.76 | 265.69 | 301.58 | 341.79 | 18.18 | 13.07 | 2.57 | 1 | 9.6 | 1.05 | 1.27 | 1.26 | 1.36 | 1.51 | 1.61 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.89 | 0.05 | 0.9 | 0.04 | 0.75 | 0.1 | 0.69 | 0.12 | 0.68 | 0.12 |
5444 | exec - fix_nve.cpp:98-106 | LAMMPS_NS::FixNVE::initial_integrate(int) | Single | 0.38 | 0.99 | 1.49 | 1.80 | 2.07 | 2.43 | 0.37 | 0.84 | 1.26 | 1.44 | 1.53 | 1.81 | 0.37 | 0.84 | 1.26 | 1.44 | 1.53 | 1.81 | 6.10 | 2.17 | 2.34 | 2.40 | 2.40 | 2.50 | 6.10 | 2.17 | 2.34 | 2.40 | 2.40 | 2.50 | 5.94 | 1.84 | 1.96 | 1.90 | 1.76 | 1.83 | 5.94 | 1.84 | 1.96 | 1.90 | 1.76 | 1.83 | 8 | 64 | 96 | 128 | 160 | 192 | 36.13 | 117.29 | 110.59 | 114.08 | 122.79 | 118.63 | 0 | 12.5 | 1.11 | 1.16 | 8 | 1.03 | 1.18 | 1.2 | 1.26 | 1.37 | 1.37 | 0.5 | 3 | 0 | 1.5 | 0.5 | 87.50 | 1 | 0 | 0.4 | 0.5 | 0.25 | 0.94 | 0.2 | 1.16 | 0.17 | 1.28 | 0.14 | 1.56 |
16405 | exec - pair_eam.cpp:181-217 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.30 | 0.34 | 0.36 | 0.42 | 0.42 | 0.38 | 0.28 | 0.27 | 0.27 | 0.28 | 0.24 | 0.25 | 32.08 | 30.91 | 30.22 | 29.42 | 28.66 | 28.64 | 4.86 | 0.74 | 0.57 | 0.56 | 0.49 | 0.39 | 514.52 | 68.38 | 47.90 | 39.81 | 33.68 | 29.77 | 4.46 | 0.58 | 0.42 | 0.37 | 0.28 | 0.25 | 513.20 | 67.74 | 47.16 | 38.93 | 32.90 | 29.00 | 8 | 64 | 96 | 128 | 160 | 192 | 18.87 | 155.84 | 214.75 | 277.19 | 325.17 | 359.75 | 9.09 | 11.93 | 3.8 | 1 | 10.86 | 1.09 | 1.27 | 1.36 | 1.53 | 1.77 | 1.54 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.95 | 0.01 | 0.88 | 0.03 | 0.76 | 0.07 | 0.8 | 0.05 | 0.73 | 0.07 |
5446 | exec - fix_nve.cpp:138-143 | LAMMPS_NS::FixNVE::final_integrate() | Single | 0.24 | 0.74 | 1.13 | 1.45 | 1.69 | 1.78 | 0.23 | 0.56 | 0.82 | 1.00 | 1.18 | 1.20 | 0.23 | 0.56 | 0.82 | 1.00 | 1.18 | 1.20 | 3.86 | 1.62 | 1.77 | 1.93 | 1.96 | 1.83 | 3.86 | 1.62 | 1.77 | 1.93 | 1.96 | 1.83 | 3.60 | 1.24 | 1.28 | 1.32 | 1.35 | 1.22 | 3.60 | 1.24 | 1.28 | 1.32 | 1.35 | 1.22 | 8 | 64 | 96 | 128 | 160 | 192 | 32.16 | 94.06 | 90.68 | 87.86 | 86.61 | 95.99 | 0 | 12.5 | 1 | 1.29 | 8 | 1.07 | 1.31 | 1.38 | 1.46 | 1.46 | 1.51 | 0.5 | 2.5 | 0 | 1 | 0.5 | 87.50 | 1 | 0 | 0.36 | 0.36 | 0.23 | 0.63 | 0.17 | 0.83 | 0.13 | 1.02 | 0.12 | 1.05 |
16402 | exec - pair_eam.cpp:232-240 | LAMMPS_NS::PairEAM::compute(int, int) | Single | 0.19 | 0.26 | 0.34 | 0.40 | 0.37 | 0.39 | 0.17 | 0.20 | 0.24 | 0.23 | 0.26 | 0.27 | 0.17 | 0.20 | 0.24 | 0.23 | 0.26 | 0.27 | 3.01 | 0.58 | 0.53 | 0.53 | 0.43 | 0.40 | 3.01 | 0.58 | 0.53 | 0.53 | 0.43 | 0.40 | 2.74 | 0.44 | 0.37 | 0.31 | 0.30 | 0.27 | 2.74 | 0.44 | 0.37 | 0.31 | 0.30 | 0.27 | 8 | 64 | 96 | 128 | 160 | 192 | 41.34 | 259.45 | 303.91 | 365.53 | 384.15 | 422.87 | 0 | 10.94 | 1.5 | 2 | 11.64 | 1.1 | 1.33 | 1.43 | 1.71 | 1.46 | 1.49 | 1 | 1 | 0 | 1 | 6 | 27.78 | 1 | 0 | 0.78 | 0.04 | 0.61 | 0.09 | 0.55 | 0.1 | 0.46 | 0.14 | 0.42 | 0.15 |
8248 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 0.14 | 0.17 | 0.20 | 0.19 | 0.22 | 0.20 | 0.13 | 0.12 | 0.12 | 0.11 | 0.12 | 0.11 | 0.13 | 0.12 | 0.12 | 0.11 | 0.12 | 0.11 | 2.27 | 0.38 | 0.32 | 0.25 | 0.25 | 0.21 | 2.27 | 0.38 | 0.32 | 0.25 | 0.25 | 0.21 | 2.10 | 0.27 | 0.19 | 0.15 | 0.14 | 0.12 | 2.10 | 0.27 | 0.19 | 0.15 | 0.14 | 0.12 | 8 | 64 | 96 | 128 | 160 | 192 | 14.66 | 106.98 | 161.27 | 195.47 | 217.83 | 243.38 | 19.35 | 13.31 | 1.76 | 1.7 | 9.93 | 1.08 | 1.4 | 1.67 | 1.66 | 1.78 | 1.81 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.96 | 0 | 0.91 | 0.01 | 0.87 | 0.01 | 0.75 | 0.03 | 0.75 | 0.03 |
2670 | exec - comm_brick.cpp:841-844 | LAMMPS_NS::CommBrick::borders() | Innermost | 0.11 | 0.23 | 0.33 | 0.43 | 0.53 | 0.50 | 0.10 | 0.17 | 0.24 | 0.26 | 0.34 | 0.34 | 0.10 | 0.17 | 0.24 | 0.26 | 0.34 | 0.34 | 1.76 | 0.50 | 0.52 | 0.57 | 0.61 | 0.51 | 1.76 | 0.50 | 0.52 | 0.57 | 0.61 | 0.51 | 1.66 | 0.37 | 0.38 | 0.35 | 0.39 | 0.35 | 1.66 | 0.37 | 0.38 | 0.35 | 0.39 | 0.35 | 8 | 64 | 96 | 128 | 160 | 192 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 10.94 | 1.76 | 1 | 11.09 | 1.06 | 1.35 | 1.38 | 1.63 | 1.58 | 1.48 | 1.5 | 1 | 0 | 2 | 0.5 | 73.81 | 1 | 0 | 0.56 | 0.07 | 0.37 | 0.15 | 0.3 | 0.19 | 0.21 | 0.26 | 0.2 | 0.27 |
8245 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Outermost | 0.11 | 0.13 | 0.15 | 0.15 | 0.14 | 0.17 | 0.10 | 0.09 | 0.09 | 0.09 | 0.09 | 0.09 | 17.96 | 17.01 | 17.07 | 16.44 | 16.12 | 16.41 | 1.69 | 0.29 | 0.24 | 0.20 | 0.16 | 0.17 | 288.18 | 37.76 | 27.05 | 22.24 | 18.87 | 16.90 | 1.56 | 0.19 | 0.14 | 0.12 | 0.10 | 0.09 | 287.27 | 37.27 | 26.63 | 21.75 | 18.51 | 16.62 | 8 | 64 | 96 | 128 | 160 | 192 | 14.73 | 114.04 | 156.09 | 182.66 | 223.75 | 234.65 | 11.76 | 10.66 | 4.25 | 1 | 11.49 | 1.08 | 1.5 | 1.68 | 1.67 | 1.64 | 1.86 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 1.01 | -0 | 0.91 | 0.01 | 0.81 | 0.02 | 0.8 | 0.02 | 0.71 | 0.03 |
8177 | exec - nbin_standard.cpp:254-258 | LAMMPS_NS::NBinStandard::bin_atoms() | Single | 0.06 | 0.11 | 0.11 | 0.13 | 0.13 | 0.18 | 0.05 | 0.06 | 0.07 | 0.07 | 0.07 | 0.08 | 0.05 | 0.06 | 0.07 | 0.07 | 0.07 | 0.08 | 0.96 | 0.25 | 0.18 | 0.17 | 0.15 | 0.18 | 0.96 | 0.25 | 0.18 | 0.17 | 0.15 | 0.18 | 0.86 | 0.14 | 0.10 | 0.09 | 0.07 | 0.08 | 0.86 | 0.14 | 0.10 | 0.09 | 0.07 | 0.08 | 8 | 64 | 96 | 128 | 160 | 192 | 9.48 | 66.92 | 95.49 | 107.48 | 134.69 | 122.04 | 0 | 9.38 | 1 | 1 | 14.55 | 1.11 | 1.79 | 1.77 | 1.82 | 2.01 | 2.29 | 2 | 0 | 0 | 0 | 4 | 33.33 | 1 | 0 | 0.77 | 0.01 | 0.7 | 0.02 | 0.57 | 0.03 | 0.58 | 0.03 | 0.46 | 0.04 |
2666 | exec - comm_brick.cpp:709-715 | LAMMPS_NS::CommBrick::exchange() | Innermost | 0.06 | 0.11 | 0.17 | 0.19 | 0.26 | 0.28 | 0.05 | 0.07 | 0.10 | 0.12 | 0.14 | 0.14 | 0.05 | 0.07 | 0.10 | 0.12 | 0.14 | 0.14 | 0.90 | 0.24 | 0.27 | 0.26 | 0.30 | 0.29 | 0.90 | 0.24 | 0.27 | 0.26 | 0.30 | 0.29 | 0.79 | 0.16 | 0.16 | 0.15 | 0.16 | 0.14 | 0.79 | 0.16 | 0.16 | 0.15 | 0.16 | 0.14 | 8 | 64 | 96 | 128 | 160 | 192 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 9.62 | 2.72 | 1 | 14.48 | 1.14 | 1.52 | 1.73 | 1.7 | 1.9 | 2.01 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.63 | 0.03 | 0.42 | 0.06 | 0.32 | 0.08 | 0.25 | 0.1 | 0.23 | 0.11 |
1231 | exec - atom_vec.cpp:735-739 | LAMMPS_NS::AtomVec::unpack_reverse(int, int*, double*) | Single | 0.05 | 0.18 | 0.27 | 0.35 | 0.42 | 0.39 | 0.04 | 0.12 | 0.18 | 0.23 | 0.25 | 0.26 | 0.04 | 0.12 | 0.18 | 0.23 | 0.25 | 0.26 | 0.80 | 0.39 | 0.42 | 0.47 | 0.49 | 0.40 | 0.80 | 0.39 | 0.42 | 0.47 | 0.49 | 0.40 | 0.71 | 0.27 | 0.28 | 0.30 | 0.28 | 0.26 | 0.71 | 0.27 | 0.28 | 0.30 | 0.28 | 0.26 | 8 | 64 | 96 | 128 | 160 | 192 | 8.24 | 43.28 | 45.48 | 47.47 | 54.97 | 62.99 | 0 | 12.5 | 1.1 | 1.19 | 8 | 1.12 | 1.45 | 1.5 | 1.57 | 1.73 | 1.56 | 0 | 2 | 0 | 1 | 1 | 62.50 | 1 | 0 | 0.33 | 0.08 | 0.21 | 0.14 | 0.15 | 0.19 | 0.13 | 0.22 | 0.11 | 0.23 |
8008 | exec - neighbor.cpp:2430-2435 | LAMMPS_NS::Neighbor::check_distance() | Single | 0.04 | 0.15 | 0.24 | 0.31 | 0.40 | 0.39 | 0.04 | 0.10 | 0.16 | 0.20 | 0.21 | 0.27 | 0.04 | 0.10 | 0.16 | 0.20 | 0.21 | 0.27 | 0.65 | 0.32 | 0.37 | 0.41 | 0.46 | 0.40 | 0.65 | 0.32 | 0.37 | 0.41 | 0.46 | 0.40 | 0.61 | 0.22 | 0.25 | 0.26 | 0.25 | 0.27 | 0.61 | 0.22 | 0.25 | 0.26 | 0.25 | 0.27 | 8 | 64 | 96 | 128 | 160 | 192 | 41.84 | 153.45 | 145.41 | 142.93 | 157.07 | 141.48 | 44.44 | 18.06 | 1 | 1.88 | 6.4 | 1.07 | 1.44 | 1.49 | 1.57 | 1.88 | 1.48 | 0 | 2 | 0 | 2 | 0 | 75.00 | 1 | 0 | 0.34 | 0.07 | 0.2 | 0.13 | 0.15 | 0.17 | 0.12 | 0.19 | 0.09 | 0.24 |
8015 | exec - neighbor.cpp:2480-2483 | LAMMPS_NS::Neighbor::build(int) | Single | 0.04 | 0.15 | 0.22 | 0.22 | 0.28 | 0.34 | 0.03 | 0.10 | 0.14 | 0.16 | 0.17 | 0.23 | 0.03 | 0.10 | 0.14 | 0.16 | 0.17 | 0.23 | 0.60 | 0.33 | 0.34 | 0.30 | 0.33 | 0.35 | 0.60 | 0.33 | 0.34 | 0.30 | 0.33 | 0.35 | 0.53 | 0.22 | 0.22 | 0.21 | 0.20 | 0.24 | 0.53 | 0.22 | 0.22 | 0.21 | 0.20 | 0.24 | 8 | 64 | 96 | 128 | 160 | 192 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1.33 | 1 | 8 | 1.13 | 1.53 | 1.56 | 1.45 | 1.67 | 1.49 | 0 | 2 | 0 | 2 | 0 | 75.00 | 1 | 0 | 0.31 | 0.07 | 0.2 | 0.11 | 0.16 | 0.13 | 0.13 | 0.15 | 0.09 | 0.21 |
19747 | exec - domain_omp.cpp:71-150 | LAMMPS_NS::DomainOMP::pbc() [clone .omp_outlined.3] | Single | 0.04 | 0.11 | 0.09 | 0.11 | 0.12 | 0.15 | 0.03 | 0.03 | 0.04 | 0.05 | 0.06 | 0.07 | 0.03 | 0.03 | 0.04 | 0.05 | 0.06 | 0.07 | 0.69 | 0.24 | 0.14 | 0.15 | 0.14 | 0.15 | 0.69 | 0.24 | 0.14 | 0.15 | 0.14 | 0.15 | 0.51 | 0.07 | 0.06 | 0.07 | 0.07 | 0.07 | 0.51 | 0.07 | 0.06 | 0.07 | 0.07 | 0.07 | 8 | 62 | 96 | 128 | 160 | 192 | 0.01 | 0.11 | 0.04 | 0.04 | 0.10 | 0.07 | 0 | 10.48 | 1.25 | 1.14 | 9.64 | 1.36 | 3.4 | 2.39 | 2.14 | 1.94 | 2.08 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.93 | 0 | 0.72 | 0.01 | 0.45 | 0.03 | 0.35 | 0.04 | 0.29 | 0.05 |
1147 | exec - atom_vec.cpp:362-366 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.03 | 0.17 | 0.31 | 0.30 | 0.33 | 0.38 | 0.02 | 0.10 | 0.16 | 0.16 | 0.18 | 0.20 | 0.02 | 0.10 | 0.16 | 0.16 | 0.18 | 0.20 | 0.51 | 0.38 | 0.49 | 0.40 | 0.38 | 0.39 | 0.51 | 0.38 | 0.49 | 0.40 | 0.38 | 0.39 | 0.36 | 0.22 | 0.25 | 0.22 | 0.20 | 0.20 | 0.36 | 0.22 | 0.25 | 0.22 | 0.20 | 0.20 | 8 | 64 | 96 | 128 | 160 | 192 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1.14 | 1 | 8 | 1.44 | 1.71 | 1.99 | 1.86 | 1.86 | 1.93 | 0 | 2 | 0 | 1 | 1 | 62.50 | 1 | 0 | 0.2 | 0.08 | 0.12 | 0.14 | 0.1 | 0.15 | 0.09 | 0.16 | 0.07 | 0.19 |
1148 | exec - atom_vec.cpp:378-382 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.03 | 0.12 | 0.15 | 0.14 | 0.16 | 0.18 | 0.02 | 0.03 | 0.04 | 0.04 | 0.04 | 0.04 | 0.02 | 0.03 | 0.04 | 0.04 | 0.04 | 0.04 | 0.45 | 0.26 | 0.24 | 0.19 | 0.19 | 0.19 | 0.45 | 0.26 | 0.24 | 0.19 | 0.19 | 0.19 | 0.35 | 0.08 | 0.07 | 0.05 | 0.05 | 0.04 | 0.35 | 0.08 | 0.07 | 0.05 | 0.05 | 0.04 | 8 | 56 | 80 | 104 | 124 | 144 | 6.63 | 30.40 | 36.31 | 50.45 | 54.64 | 59.19 | 0 | 12.5 | 1.14 | 1.28 | 8 | 1.29 | 3 | 2.85 | 3.1 | 3.27 | 3.48 | 0 | 2 | 0 | 1 | 1 | 62.50 | 1 | 0 | 0.58 | 0.01 | 0.42 | 0.03 | 0.44 | 0.02 | 0.39 | 0.02 | 0.35 | 0.03 |
19746 | exec - domain_omp.cpp:56-56 | LAMMPS_NS::DomainOMP::pbc() [clone .omp_outlined] | Single | 0.02 | 0.03 | 0.04 | 0.04 | 0.03 | 0.04 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.32 | 0.06 | 0.06 | 0.05 | 0.04 | 0.04 | 0.32 | 0.06 | 0.06 | 0.05 | 0.04 | 0.04 | 0.24 | 0.03 | 0.02 | 0.02 | 0.01 | 0.01 | 0.24 | 0.03 | 0.02 | 0.02 | 0.01 | 0.01 | 8 | 59 | 88 | 95 | 116 | 129 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | NA | NA | 1 | NA | NA | 1.36 | 2.01 | 2.82 | 2.34 | 2.44 | 2.59 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 1.07 | -0 | 1 | -0 | 0.92 | 0 | 0.99 | 0 | 0.94 | 0 |
16416 | exec - pair_eam.cpp:939-941 | LAMMPS_NS::PairEAM::pack_forward_comm(int, int*, double*, int, int*) | Single | 0.02 | 0.08 | 0.11 | 0.12 | 0.12 | 0.13 | 0.01 | 0.04 | 0.06 | 0.06 | 0.06 | 0.06 | 0.01 | 0.04 | 0.06 | 0.06 | 0.06 | 0.06 | 0.30 | 0.17 | 0.18 | 0.16 | 0.14 | 0.13 | 0.30 | 0.17 | 0.18 | 0.16 | 0.14 | 0.13 | 0.21 | 0.10 | 0.09 | 0.08 | 0.07 | 0.06 | 0.21 | 0.10 | 0.09 | 0.08 | 0.07 | 0.06 | 8 | 64 | 96 | 128 | 160 | 192 | 0.00 | 0.00 | 0.03 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.44 | 1.76 | 2.03 | 1.89 | 1.95 | 2.04 | 0 | 2 | 0 | 0 | 1 | 66.67 | 1 | 0 | 0.27 | 0.03 | 0.2 | 0.05 | 0.15 | 0.05 | 0.15 | 0.05 | 0.14 | 0.05 |
16422 | exec - pair_eam.cpp:976-978 | LAMMPS_NS::PairEAM::unpack_reverse_comm(int, int*, double*) | Single | 0.02 | 0.06 | 0.10 | 0.11 | 0.09 | 0.14 | 0.01 | 0.03 | 0.04 | 0.05 | 0.05 | 0.05 | 0.01 | 0.03 | 0.04 | 0.05 | 0.05 | 0.05 | 0.30 | 0.13 | 0.16 | 0.15 | 0.11 | 0.14 | 0.30 | 0.13 | 0.16 | 0.15 | 0.11 | 0.14 | 0.19 | 0.06 | 0.07 | 0.06 | 0.06 | 0.05 | 0.19 | 0.06 | 0.07 | 0.06 | 0.06 | 0.05 | 8 | 64 | 96 | 128 | 160 | 192 | 10.39 | 66.01 | 65.36 | 76.50 | 92.72 | 110.26 | 0 | 12.5 | 1 | 1.28 | 8 | 1.58 | 2.23 | 2.38 | 2.47 | 1.95 | 2.8 | 0 | 2 | 0 | 0 | 1 | 66.67 | 1 | 0 | 0.41 | 0.02 | 0.24 | 0.03 | 0.2 | 0.04 | 0.17 | 0.04 | 0.16 | 0.04 |
16404 | exec - pair_eam.cpp:232-249 | LAMMPS_NS::PairEAM::compute(int, int) | Single | 0.01 | 0.03 | 0.03 | 0.04 | 0.04 | 0.04 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.21 | 0.06 | 0.05 | 0.06 | 0.05 | 0.04 | 0.21 | 0.06 | 0.05 | 0.06 | 0.05 | 0.04 | 0.19 | 0.03 | 0.02 | 0.01 | 0.01 | 0.01 | 0.19 | 0.03 | 0.02 | 0.01 | 0.01 | 0.01 | 8 | 64 | 96 | 128 | 160 | 192 | 44.17 | 302.97 | 405.02 | 580.42 | 704.13 | 732.50 | 3.34 | 12.08 | 1.5 | 1.64 | 10.6 | 1.13 | 2.23 | 2.47 | 4.22 | 4.35 | 3.61 | 2 | 1 | 0 | 1 | 8.5 | 28.04 | 1 | 0 | 0.87 | 0 | 0.77 | 0 | 0.82 | 0 | 0.81 | 0 | 0.7 | 0 |
1248 | exec - atom_vec.cpp:804-811 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.01 | 0.05 | 0.09 | 0.10 | 0.14 | 0.16 | 0.01 | 0.03 | 0.04 | 0.05 | 0.06 | 0.07 | 0.01 | 0.03 | 0.04 | 0.05 | 0.06 | 0.07 | 0.18 | 0.10 | 0.14 | 0.14 | 0.16 | 0.16 | 0.18 | 0.10 | 0.14 | 0.14 | 0.16 | 0.16 | 0.12 | 0.06 | 0.06 | 0.07 | 0.07 | 0.07 | 0.12 | 0.06 | 0.06 | 0.07 | 0.07 | 0.07 | 8 | 64 | 96 | 128 | 159 | 192 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1.4 | 1 | 8 | 1.48 | 1.65 | 2.21 | 2.08 | 2.26 | 2.41 | 0 | 2 | 0 | 1 | 4 | 35.71 | 1 | 0 | 0.25 | 0.02 | 0.16 | 0.03 | 0.11 | 0.05 | 0.09 | 0.06 | 0.08 | 0.06 |