Loop id | Source Location | Source Function | Level | Max Thread Time / Walltime 6x1 (%) | Max Thread Time / Walltime 96x1 (%) | Max Thread Time / Walltime 120x1 (%) | Max Thread Time / Walltime 126x1 (%) | Max Thread Time / Walltime 144x1 (%) | Max Thread Time / Walltime 168x1 (%) | Max Thread Time / Walltime 192x1 (%) | Max Thread Time / Walltime 216x1 (%) | Max Thread Time / Walltime 240x1 (%) | Max Thread Time / Walltime 256x1 (%) | Exclusive Coverage 6x1 (%) | Exclusive Coverage 96x1 (%) | Exclusive Coverage 120x1 (%) | Exclusive Coverage 126x1 (%) | Exclusive Coverage 144x1 (%) | Exclusive Coverage 168x1 (%) | Exclusive Coverage 192x1 (%) | Exclusive Coverage 216x1 (%) | Exclusive Coverage 240x1 (%) | Exclusive Coverage 256x1 (%) | Inclusive Coverage 6x1 (%) | Inclusive Coverage 96x1 (%) | Inclusive Coverage 120x1 (%) | Inclusive Coverage 126x1 (%) | Inclusive Coverage 144x1 (%) | Inclusive Coverage 168x1 (%) | Inclusive Coverage 192x1 (%) | Inclusive Coverage 216x1 (%) | Inclusive Coverage 240x1 (%) | Inclusive Coverage 256x1 (%) | Max Exclusive Time Over Threads 6x1 (s) | Max Exclusive Time Over Threads 96x1 (s) | Max Exclusive Time Over Threads 120x1 (s) | Max Exclusive Time Over Threads 126x1 (s) | Max Exclusive Time Over Threads 144x1 (s) | Max Exclusive Time Over Threads 168x1 (s) | Max Exclusive Time Over Threads 192x1 (s) | Max Exclusive Time Over Threads 216x1 (s) | Max Exclusive Time Over Threads 240x1 (s) | Max Exclusive Time Over Threads 256x1 (s) | Max Inclusive Time Over Threads 6x1 (s) | Max Inclusive Time Over Threads 96x1 (s) | Max Inclusive Time Over Threads 120x1 (s) | Max Inclusive Time Over Threads 126x1 (s) | Max Inclusive Time Over Threads 144x1 (s) | Max Inclusive Time Over Threads 168x1 (s) | Max Inclusive Time Over Threads 192x1 (s) | Max Inclusive Time Over Threads 216x1 (s) | Max Inclusive Time Over Threads 240x1 (s) | Max Inclusive Time Over Threads 256x1 (s) | Exclusive Time w.r.t. Wall Time 6x1 (s) | Exclusive Time w.r.t. Wall Time 96x1 (s) | Exclusive Time w.r.t. Wall Time 120x1 (s) | Exclusive Time w.r.t. Wall Time 126x1 (s) | Exclusive Time w.r.t. Wall Time 144x1 (s) | Exclusive Time w.r.t. Wall Time 168x1 (s) | Exclusive Time w.r.t. Wall Time 192x1 (s) | Exclusive Time w.r.t. Wall Time 216x1 (s) | Exclusive Time w.r.t. Wall Time 240x1 (s) | Exclusive Time w.r.t. Wall Time 256x1 (s) | Inclusive Time w.r.t. Wall Time 6x1 (s) | Inclusive Time w.r.t. Wall Time 96x1 (s) | Inclusive Time w.r.t. Wall Time 120x1 (s) | Inclusive Time w.r.t. Wall Time 126x1 (s) | Inclusive Time w.r.t. Wall Time 144x1 (s) | Inclusive Time w.r.t. Wall Time 168x1 (s) | Inclusive Time w.r.t. Wall Time 192x1 (s) | Inclusive Time w.r.t. Wall Time 216x1 (s) | Inclusive Time w.r.t. Wall Time 240x1 (s) | Inclusive Time w.r.t. Wall Time 256x1 (s) | Nb Threads 6x1 | Nb Threads 96x1 | Nb Threads 120x1 | Nb Threads 126x1 | Nb Threads 144x1 | Nb Threads 168x1 | Nb Threads 192x1 | Nb Threads 216x1 | Nb Threads 240x1 | Nb Threads 256x1 | GFLOPS 6x1 | GFLOPS 96x1 | GFLOPS 120x1 | GFLOPS 126x1 | GFLOPS 144x1 | GFLOPS 168x1 | GFLOPS 192x1 | GFLOPS 216x1 | GFLOPS 240x1 | GFLOPS 256x1 | Vectorization Ratio (%) | Vector Length Use (%) | Speedup If No Scalar Integer | Speedup If FP Vectorized | Speedup If Fully Vectorized | Speedup If Perfect Load Balancing 6x1 | Speedup If Perfect Load Balancing 96x1 | Speedup If Perfect Load Balancing 120x1 | Speedup If Perfect Load Balancing 126x1 | Speedup If Perfect Load Balancing 144x1 | Speedup If Perfect Load Balancing 168x1 | Speedup If Perfect Load Balancing 192x1 | Speedup If Perfect Load Balancing 216x1 | Speedup If Perfect Load Balancing 240x1 | Speedup If Perfect Load Balancing 256x1 | Stride 0 | Stride 1 | Stride n | Stride Unknown | Stride Indirect | Array Access Efficiency | (6x1) Efficiency | (6x1) Potential Speed-Up (%) | (96x1) Efficiency | (96x1) Potential Speed-Up (%) | (120x1) Efficiency | (120x1) Potential Speed-Up (%) | (126x1) Efficiency | (126x1) Potential Speed-Up (%) | (144x1) Efficiency | (144x1) Potential Speed-Up (%) | (168x1) Efficiency | (168x1) Potential Speed-Up (%) | (192x1) Efficiency | (192x1) Potential Speed-Up (%) | (216x1) Efficiency | (216x1) Potential Speed-Up (%) | (240x1) Efficiency | (240x1) Potential Speed-Up (%) | (256x1) Efficiency | (256x1) Potential Speed-Up (%) |
---|
21727 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 44.64 | 44.32 | 43.35 | 42.44 | 43.94 | 43.18 | 40.00 | 38.35 | 36.88 | 39.43 | 43.52 | 44.09 | 43.22 | 41.61 | 38.44 | 39.51 | 41.86 | 39.51 | 40.44 | 38.58 | 43.52 | 44.09 | 43.22 | 41.61 | 38.44 | 39.51 | 41.86 | 39.51 | 40.44 | 38.58 | 1095.34 | 84.48 | 68.88 | 62.65 | 70.04 | 57.59 | 53.75 | 46.94 | 41.65 | 45.19 | 1095.34 | 84.48 | 68.88 | 62.65 | 70.04 | 57.59 | 53.75 | 46.94 | 41.65 | 45.19 | 1067.22 | 82.18 | 66.05 | 58.76 | 58.19 | 49.16 | 51.44 | 42.89 | 39.30 | 38.21 | 1067.22 | 82.18 | 66.05 | 58.76 | 58.19 | 49.16 | 51.44 | 42.89 | 39.30 | 38.21 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 18.59 | 241.41 | 300.32 | 337.25 | 340.36 | 402.27 | 383.44 | 458.86 | 502.59 | 516.68 | 18.03 | 14.14 | 1.4 | 1.8 | 4.94 | 1.03 | 1.03 | 1.05 | 1.07 | 1.21 | 1.18 | 1.05 | 1.11 | 1.08 | 1.2 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.81 | 8.31 | 0.81 | 8.3 | 0.86 | 5.62 | 0.76 | 9.07 | 0.78 | 8.88 | 0.65 | 14.72 | 0.69 | 12.2 | 0.68 | 12.99 | 0.65 | 13.32 |
21745 | exec - pair_eam.cpp:181-217 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 31.17 | 29.33 | 28.55 | 28.74 | 28.10 | 27.53 | 27.03 | 26.36 | 24.92 | 25.30 | 30.31 | 29.43 | 28.61 | 28.40 | 25.42 | 26.29 | 28.06 | 27.13 | 27.20 | 26.07 | 30.31 | 29.43 | 28.61 | 28.40 | 25.42 | 26.29 | 28.06 | 27.13 | 27.20 | 26.07 | 764.64 | 55.91 | 45.37 | 42.42 | 44.80 | 36.73 | 36.32 | 32.27 | 28.15 | 28.99 | 764.64 | 55.91 | 45.37 | 42.42 | 44.80 | 36.73 | 36.32 | 32.27 | 28.15 | 28.99 | 743.23 | 54.86 | 43.72 | 40.11 | 38.48 | 32.71 | 34.48 | 29.45 | 26.42 | 25.82 | 743.23 | 54.86 | 43.72 | 40.11 | 38.48 | 32.71 | 34.48 | 29.45 | 26.42 | 25.82 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 16.10 | 218.15 | 273.73 | 298.15 | 310.50 | 364.82 | 345.20 | 403.26 | 450.66 | 460.50 | 19.06 | 14.41 | 1.09 | 1.85 | 4.03 | 1.03 | 1.02 | 1.04 | 1.06 | 1.17 | 1.13 | 1.06 | 1.11 | 1.08 | 1.14 | 2.75 | 1 | 0 | 3 | 5 | 48.96 | 1 | 0 | 0.85 | 4.51 | 0.85 | 4.29 | 0.88 | 3.34 | 0.8 | 4.96 | 0.81 | 4.96 | 0.67 | 9.16 | 0.7 | 8.11 | 0.7 | 8.07 | 0.67 | 8.48 |
1086 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 15.74 | 14.05 | 13.72 | 13.88 | 13.18 | 12.89 | 13.01 | 12.70 | 12.25 | 12.29 | 15.52 | 14.07 | 13.82 | 13.77 | 12.40 | 12.78 | 13.52 | 13.28 | 13.30 | 12.78 | 15.52 | 14.07 | 13.82 | 13.77 | 12.40 | 12.78 | 13.52 | 13.28 | 13.30 | 12.78 | 386.29 | 26.77 | 21.80 | 20.49 | 21.00 | 17.19 | 17.49 | 15.54 | 13.84 | 14.09 | 386.29 | 26.77 | 21.80 | 20.49 | 21.00 | 17.19 | 17.49 | 15.54 | 13.84 | 14.09 | 380.70 | 26.23 | 21.12 | 19.44 | 18.77 | 15.91 | 16.61 | 14.42 | 12.93 | 12.65 | 380.70 | 26.23 | 21.12 | 19.44 | 18.77 | 15.91 | 16.61 | 14.42 | 12.93 | 12.65 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 6.68 | 98.02 | 121.90 | 131.51 | 136.86 | 161.06 | 154.70 | 177.14 | 198.26 | 202.60 | 0 | 10.23 | 2.1 | 1.8 | 11.73 | 1.01 | 1.02 | 1.04 | 1.06 | 1.12 | 1.09 | 1.06 | 1.09 | 1.09 | 1.13 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.91 | 1.31 | 0.9 | 1.36 | 0.93 | 0.93 | 0.85 | 1.92 | 0.85 | 1.86 | 0.72 | 3.84 | 0.73 | 3.54 | 0.74 | 3.51 | 0.71 | 3.77 |
1085 | exec - npair_bin.cpp:112-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | InBetween | 3.35 | 2.80 | 2.75 | 2.89 | 2.51 | 2.55 | 2.65 | 2.67 | 2.65 | 2.36 | 3.30 | 2.70 | 2.64 | 2.78 | 2.40 | 2.51 | 2.58 | 2.65 | 2.62 | 2.41 | 18.96 | 16.90 | 16.58 | 16.67 | 14.91 | 15.40 | 16.21 | 16.05 | 16.05 | 15.30 | 82.17 | 5.34 | 4.36 | 4.26 | 4.01 | 3.39 | 3.55 | 3.27 | 2.99 | 2.70 | 471.33 | 31.79 | 25.98 | 24.56 | 24.97 | 20.64 | 20.80 | 18.54 | 16.57 | 16.68 | 80.88 | 5.04 | 4.03 | 3.93 | 3.64 | 3.13 | 3.17 | 2.88 | 2.55 | 2.39 | 464.97 | 31.50 | 25.34 | 23.54 | 22.57 | 19.17 | 19.93 | 17.42 | 15.59 | 15.15 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 6.84 | 103.86 | 128.79 | 134.55 | 143.84 | 167.91 | 163.62 | 182.31 | 203.83 | 213.06 | 0 | 10 | 1 | 1 | 14 | 1.02 | 1.06 | 1.09 | 1.09 | 1.11 | 1.09 | 1.13 | 1.15 | 1.19 | 1.15 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 1 | 0 | 1 | 0 | 0.98 | 0.05 | 0.93 | 0.18 | 0.92 | 0.19 | 0.8 | 0.52 | 0.78 | 0.58 | 0.79 | 0.54 | 0.79 | 0.5 |
21729 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 1.34 | 1.33 | 1.31 | 1.28 | 1.39 | 1.39 | 1.21 | 1.20 | 1.15 | 1.23 | 1.30 | 1.30 | 1.28 | 1.24 | 1.14 | 1.17 | 1.24 | 1.19 | 1.20 | 1.13 | 1.30 | 1.30 | 1.28 | 1.24 | 1.14 | 1.17 | 1.24 | 1.19 | 1.20 | 1.13 | 32.81 | 2.53 | 2.08 | 1.88 | 2.21 | 1.85 | 1.62 | 1.47 | 1.30 | 1.41 | 32.81 | 2.53 | 2.08 | 1.88 | 2.21 | 1.85 | 1.62 | 1.47 | 1.30 | 1.41 | 32.00 | 2.43 | 1.96 | 1.75 | 1.73 | 1.46 | 1.52 | 1.29 | 1.16 | 1.12 | 32.00 | 2.43 | 1.96 | 1.75 | 1.73 | 1.46 | 1.52 | 1.29 | 1.16 | 1.12 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 15.88 | 209.17 | 259.79 | 290.57 | 293.10 | 346.59 | 331.90 | 391.24 | 428.73 | 433.66 | 16.39 | 13.93 | 1.35 | 1.8 | 4.94 | 1.03 | 1.04 | 1.06 | 1.08 | 1.29 | 1.28 | 1.07 | 1.15 | 1.13 | 1.28 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.82 | 0.23 | 0.82 | 0.23 | 0.87 | 0.16 | 0.77 | 0.26 | 0.78 | 0.26 | 0.66 | 0.43 | 0.69 | 0.37 | 0.69 | 0.37 | 0.67 | 0.37 |
11683 | exec - fix_nve.cpp:98-106 | LAMMPS_NS::FixNVE::initial_integrate(int) | Single | 0.59 | 1.17 | 1.28 | 1.32 | 0.94 | 1.39 | 1.77 | 1.58 | 1.71 | 1.29 | 0.55 | 1.06 | 1.08 | 1.15 | 0.79 | 1.06 | 1.62 | 1.14 | 1.50 | 1.02 | 0.55 | 1.06 | 1.08 | 1.15 | 0.79 | 1.06 | 1.62 | 1.14 | 1.50 | 1.02 | 14.52 | 2.23 | 2.04 | 1.96 | 1.49 | 1.85 | 2.37 | 1.94 | 1.93 | 1.48 | 14.52 | 2.23 | 2.04 | 1.96 | 1.49 | 1.85 | 2.37 | 1.94 | 1.93 | 1.48 | 13.45 | 1.97 | 1.66 | 1.62 | 1.20 | 1.32 | 1.99 | 1.24 | 1.46 | 1.01 | 13.45 | 1.97 | 1.66 | 1.62 | 1.20 | 1.32 | 1.99 | 1.24 | 1.46 | 1.01 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 16.15 | 110.19 | 131.03 | 133.80 | 181.12 | 164.00 | 108.69 | 174.13 | 148.47 | 213.90 | 0 | 12.5 | 1.14 | 1.22 | 3.76 | 1.08 | 1.14 | 1.23 | 1.21 | 1.25 | 1.41 | 1.2 | 1.59 | 1.34 | 1.48 | 0.5 | 3 | 0 | 1.5 | 0.5 | 87.50 | 1 | 0 | 0.43 | 0.61 | 0.41 | 0.64 | 0.39 | 0.7 | 0.47 | 0.42 | 0.36 | 0.68 | 0.21 | 1.28 | 0.3 | 0.8 | 0.23 | 1.15 | 0.31 | 0.7 |
21726 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.48 | 0.48 | 0.51 | 0.50 | 0.43 | 0.50 | 0.52 | 0.47 | 0.46 | 0.45 | 0.46 | 0.42 | 0.42 | 0.43 | 0.39 | 0.41 | 0.42 | 0.41 | 0.41 | 0.40 | 43.98 | 44.50 | 43.63 | 42.04 | 38.83 | 39.93 | 42.29 | 39.92 | 40.85 | 38.98 | 11.69 | 0.91 | 0.81 | 0.74 | 0.69 | 0.67 | 0.70 | 0.57 | 0.52 | 0.51 | 1106.56 | 85.22 | 69.52 | 63.26 | 70.70 | 58.08 | 54.31 | 47.38 | 42.09 | 45.59 | 11.16 | 0.78 | 0.64 | 0.61 | 0.59 | 0.51 | 0.52 | 0.45 | 0.40 | 0.40 | 1078.38 | 82.96 | 66.69 | 59.37 | 58.78 | 49.68 | 51.97 | 43.33 | 39.69 | 38.61 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 13.98 | 200.73 | 251.03 | 262.82 | 271.63 | 316.73 | 306.37 | 359.95 | 396.42 | 402.36 | 16.67 | 13.02 | 2.8 | 1 | 10.93 | 1.05 | 1.18 | 1.28 | 1.22 | 1.18 | 1.31 | 1.36 | 1.31 | 1.35 | 1.3 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.9 | 0.04 | 0.88 | 0.05 | 0.87 | 0.06 | 0.79 | 0.08 | 0.77 | 0.09 | 0.67 | 0.14 | 0.7 | 0.12 | 0.71 | 0.12 | 0.65 | 0.14 |
21744 | exec - pair_eam.cpp:181-217 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.39 | 0.42 | 0.40 | 0.43 | 0.37 | 0.41 | 0.42 | 0.43 | 0.39 | 0.40 | 0.37 | 0.35 | 0.34 | 0.36 | 0.31 | 0.32 | 0.34 | 0.34 | 0.33 | 0.33 | 30.68 | 29.78 | 28.95 | 28.75 | 25.73 | 26.61 | 28.40 | 27.47 | 27.53 | 26.40 | 9.55 | 0.79 | 0.63 | 0.63 | 0.60 | 0.55 | 0.56 | 0.53 | 0.44 | 0.46 | 773.99 | 56.60 | 45.86 | 42.88 | 45.24 | 37.15 | 36.71 | 32.61 | 28.41 | 29.33 | 9.14 | 0.65 | 0.53 | 0.50 | 0.47 | 0.40 | 0.42 | 0.37 | 0.33 | 0.33 | 752.37 | 55.51 | 44.25 | 40.61 | 38.95 | 33.12 | 34.90 | 29.82 | 26.75 | 26.15 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 11.56 | 161.53 | 200.92 | 211.20 | 223.19 | 261.09 | 249.02 | 283.36 | 324.40 | 321.29 | 8.33 | 11.46 | 3.6 | 1 | 11.08 | 1.05 | 1.23 | 1.2 | 1.25 | 1.27 | 1.37 | 1.35 | 1.43 | 1.39 | 1.42 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.88 | 0.04 | 0.87 | 0.04 | 0.86 | 0.05 | 0.81 | 0.06 | 0.81 | 0.06 | 0.68 | 0.11 | 0.68 | 0.11 | 0.7 | 0.1 | 0.65 | 0.12 |
11685 | exec - fix_nve.cpp:138-143 | LAMMPS_NS::FixNVE::final_integrate() | Single | 0.41 | 0.86 | 0.98 | 0.93 | 0.73 | 0.96 | 1.30 | 1.20 | 1.20 | 0.95 | 0.37 | 0.73 | 0.76 | 0.80 | 0.56 | 0.70 | 1.02 | 0.76 | 0.98 | 0.67 | 0.37 | 0.73 | 0.76 | 0.80 | 0.56 | 0.70 | 1.02 | 0.76 | 0.98 | 0.67 | 9.97 | 1.63 | 1.55 | 1.38 | 1.16 | 1.27 | 1.75 | 1.46 | 1.36 | 1.08 | 9.97 | 1.63 | 1.55 | 1.38 | 1.16 | 1.27 | 1.75 | 1.46 | 1.36 | 1.08 | 9.12 | 1.37 | 1.16 | 1.12 | 0.85 | 0.88 | 1.25 | 0.83 | 0.95 | 0.66 | 9.12 | 1.37 | 1.16 | 1.12 | 0.85 | 0.88 | 1.25 | 0.83 | 0.95 | 0.66 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 12.83 | 85.51 | 100.93 | 103.96 | 137.64 | 133.07 | 93.13 | 139.93 | 122.49 | 176.67 | 0 | 11.41 | 1.04 | 1.32 | 2.24 | 1.09 | 1.19 | 1.34 | 1.23 | 1.37 | 1.47 | 1.41 | 1.79 | 1.45 | 1.67 | 0.75 | 1.75 | 1.5 | 2 | 0.75 | 75.31 | 1 | 0 | 0.42 | 0.43 | 0.39 | 0.46 | 0.39 | 0.49 | 0.45 | 0.31 | 0.37 | 0.44 | 0.23 | 0.79 | 0.31 | 0.53 | 0.24 | 0.74 | 0.32 | 0.45 |
21730 | exec - pair_eam.cpp:232-240 | LAMMPS_NS::PairEAM::compute(int, int) | Single | 0.18 | 0.36 | 0.33 | 0.37 | 0.30 | 0.32 | 0.28 | 0.27 | 0.29 | 0.27 | 0.18 | 0.25 | 0.25 | 0.28 | 0.23 | 0.25 | 0.22 | 0.23 | 0.24 | 0.20 | 0.18 | 0.25 | 0.25 | 0.28 | 0.23 | 0.25 | 0.22 | 0.23 | 0.24 | 0.20 | 4.45 | 0.69 | 0.53 | 0.55 | 0.48 | 0.43 | 0.38 | 0.34 | 0.32 | 0.31 | 4.45 | 0.69 | 0.53 | 0.55 | 0.48 | 0.43 | 0.38 | 0.34 | 0.32 | 0.31 | 4.41 | 0.47 | 0.38 | 0.40 | 0.35 | 0.31 | 0.27 | 0.25 | 0.23 | 0.20 | 4.41 | 0.47 | 0.38 | 0.40 | 0.35 | 0.31 | 0.27 | 0.25 | 0.23 | 0.20 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 29.58 | 276.18 | 339.34 | 325.32 | 377.30 | 422.14 | 488.72 | 523.20 | 563.97 | 663.64 | 0 | 10.94 | 1.11 | 1.9 | 10.26 | 1.01 | 1.46 | 1.37 | 1.38 | 1.4 | 1.41 | 1.44 | 1.37 | 1.43 | 1.63 | 2 | 1 | 0 | 2 | 7 | 33.33 | 1 | 0 | 0.58 | 0.11 | 0.57 | 0.11 | 0.52 | 0.14 | 0.53 | 0.11 | 0.51 | 0.12 | 0.52 | 0.1 | 0.5 | 0.11 | 0.48 | 0.12 | 0.53 | 0.09 |
7329 | exec - comm_brick.cpp:841-844 | LAMMPS_NS::CommBrick::borders() | Innermost | 0.18 | 0.25 | 0.26 | 0.29 | 0.27 | 0.25 | 0.32 | 0.29 | 0.31 | 0.24 | 0.18 | 0.20 | 0.22 | 0.22 | 0.23 | 0.21 | 0.28 | 0.27 | 0.26 | 0.20 | 0.18 | 0.20 | 0.22 | 0.22 | 0.23 | 0.21 | 0.28 | 0.27 | 0.26 | 0.20 | 4.52 | 0.48 | 0.41 | 0.43 | 0.44 | 0.33 | 0.44 | 0.36 | 0.34 | 0.28 | 4.52 | 0.48 | 0.41 | 0.43 | 0.44 | 0.33 | 0.44 | 0.36 | 0.34 | 0.28 | 4.32 | 0.37 | 0.34 | 0.30 | 0.35 | 0.26 | 0.34 | 0.29 | 0.25 | 0.20 | 4.32 | 0.37 | 0.34 | 0.30 | 0.35 | 0.26 | 0.34 | 0.29 | 0.25 | 0.20 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 10.94 | 1.3 | 1 | 11.27 | 1.05 | 1.29 | 1.22 | 1.42 | 1.24 | 1.3 | 1.28 | 1.25 | 1.39 | 1.4 | 1.5 | 1 | 0 | 1.75 | 0.75 | 72.02 | 1 | 0 | 0.72 | 0.06 | 0.64 | 0.08 | 0.68 | 0.07 | 0.51 | 0.11 | 0.6 | 0.08 | 0.39 | 0.17 | 0.41 | 0.16 | 0.43 | 0.15 | 0.51 | 0.1 |
1087 | exec - npair_bin.cpp:122-219 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Innermost | 0.14 | 0.17 | 0.17 | 0.18 | 0.16 | 0.15 | 0.17 | 0.16 | 0.17 | 0.16 | 0.14 | 0.12 | 0.13 | 0.12 | 0.11 | 0.11 | 0.12 | 0.12 | 0.12 | 0.11 | 0.14 | 0.12 | 0.13 | 0.12 | 0.11 | 0.11 | 0.12 | 0.12 | 0.12 | 0.11 | 3.55 | 0.31 | 0.26 | 0.26 | 0.26 | 0.19 | 0.23 | 0.20 | 0.19 | 0.18 | 3.55 | 0.31 | 0.26 | 0.26 | 0.26 | 0.19 | 0.23 | 0.20 | 0.19 | 0.18 | 3.38 | 0.23 | 0.19 | 0.17 | 0.17 | 0.13 | 0.14 | 0.13 | 0.12 | 0.11 | 3.38 | 0.23 | 0.19 | 0.17 | 0.17 | 0.13 | 0.14 | 0.13 | 0.12 | 0.11 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 4.00 | 51.78 | 60.96 | 71.10 | 71.81 | 90.62 | 83.43 | 97.71 | 104.49 | 109.05 | 0 | 10.69 | 1.31 | 1.75 | 11.85 | 1.05 | 1.36 | 1.38 | 1.52 | 1.54 | 1.46 | 1.66 | 1.6 | 1.64 | 1.67 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.91 | 0.01 | 0.88 | 0.02 | 0.94 | 0.01 | 0.83 | 0.02 | 0.9 | 0.01 | 0.74 | 0.03 | 0.74 | 0.03 | 0.72 | 0.03 | 0.72 | 0.03 |
1084 | exec - npair_bin.cpp:93-248 [...] | LAMMPS_NS::NPairBin<1, 1, 0, 0, 1>::build(LAMMPS_NS::NeighList*) | Outermost | 0.11 | 0.12 | 0.14 | 0.16 | 0.14 | 0.13 | 0.13 | 0.12 | 0.14 | 0.14 | 0.10 | 0.09 | 0.09 | 0.10 | 0.08 | 0.09 | 0.09 | 0.09 | 0.09 | 0.08 | 19.06 | 16.99 | 16.68 | 16.76 | 14.99 | 15.49 | 16.30 | 16.14 | 16.14 | 15.38 | 2.65 | 0.23 | 0.22 | 0.23 | 0.22 | 0.18 | 0.17 | 0.15 | 0.16 | 0.15 | 473.74 | 31.99 | 26.10 | 24.66 | 25.13 | 20.79 | 20.93 | 18.63 | 16.66 | 16.76 | 2.52 | 0.17 | 0.15 | 0.13 | 0.12 | 0.11 | 0.11 | 0.10 | 0.09 | 0.08 | 467.49 | 31.68 | 25.49 | 23.68 | 22.70 | 19.28 | 20.03 | 17.52 | 15.68 | 15.24 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 11.75 | 153.97 | 187.70 | 201.15 | 216.80 | 243.18 | 245.59 | 279.56 | 306.61 | 328.15 | 0 | 8.85 | 3.19 | 1 | 13.69 | 1.05 | 1.35 | 1.49 | 1.75 | 1.79 | 1.65 | 1.59 | 1.58 | 1.85 | 1.91 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.9 | 0.01 | 0.87 | 0.01 | 0.89 | 0.01 | 0.85 | 0.01 | 0.82 | 0.02 | 0.73 | 0.02 | 0.73 | 0.02 | 0.72 | 0.03 | 0.72 | 0.02 |
7325 | exec - comm_brick.cpp:709-715 | LAMMPS_NS::CommBrick::exchange() | Innermost | 0.10 | 0.13 | 0.13 | 0.14 | 0.13 | 0.13 | 0.15 | 0.14 | 0.15 | 0.12 | 0.09 | 0.10 | 0.10 | 0.10 | 0.09 | 0.09 | 0.10 | 0.10 | 0.10 | 0.08 | 0.09 | 0.10 | 0.10 | 0.10 | 0.09 | 0.09 | 0.10 | 0.10 | 0.10 | 0.08 | 2.40 | 0.24 | 0.21 | 0.20 | 0.22 | 0.17 | 0.20 | 0.17 | 0.17 | 0.14 | 2.40 | 0.24 | 0.21 | 0.20 | 0.22 | 0.17 | 0.20 | 0.17 | 0.17 | 0.14 | 2.15 | 0.19 | 0.16 | 0.15 | 0.14 | 0.11 | 0.13 | 0.11 | 0.10 | 0.08 | 2.15 | 0.19 | 0.16 | 0.15 | 0.14 | 0.11 | 0.13 | 0.11 | 0.10 | 0.08 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 9.38 | 2.33 | 1 | 13.96 | 1.12 | 1.29 | 1.34 | 1.37 | 1.56 | 1.54 | 1.61 | 1.56 | 1.75 | 1.66 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.72 | 0.03 | 0.68 | 0.03 | 0.7 | 0.03 | 0.65 | 0.03 | 0.69 | 0.03 | 0.54 | 0.05 | 0.54 | 0.05 | 0.56 | 0.04 | 0.61 | 0.03 |
5424 | exec - domain_omp.cpp:69-150 | LAMMPS_NS::DomainOMP::pbc() [clone .extracted] | Single | 0.09 | 0.09 | 0.10 | 0.11 | 0.11 | 0.08 | 0.10 | 0.09 | 0.10 | 0.08 | 0.08 | 0.07 | 0.07 | 0.07 | 0.06 | 0.06 | 0.07 | 0.06 | 0.06 | 0.05 | 0.08 | 0.07 | 0.07 | 0.07 | 0.06 | 0.06 | 0.07 | 0.06 | 0.06 | 0.05 | 2.16 | 0.16 | 0.16 | 0.17 | 0.17 | 0.11 | 0.13 | 0.12 | 0.12 | 0.09 | 2.16 | 0.16 | 0.16 | 0.17 | 0.17 | 0.11 | 0.13 | 0.12 | 0.12 | 0.09 | 1.97 | 0.14 | 0.11 | 0.10 | 0.10 | 0.08 | 0.08 | 0.07 | 0.06 | 0.05 | 1.97 | 0.14 | 0.11 | 0.10 | 0.10 | 0.08 | 0.08 | 0.07 | 0.06 | 0.05 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.05 | 0.04 | 0.08 | 0.04 | 0.07 | 0.09 | 0.07 | 0.14 | 0.15 | 13.64 | 11.93 | 1.35 | 1.61 | 10.29 | 1.1 | 1.21 | 1.44 | 1.6 | 1.74 | 1.38 | 1.58 | 1.73 | 1.98 | 1.8 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.9 | 0.01 | 0.88 | 0.01 | 0.9 | 0.01 | 0.84 | 0.01 | 0.88 | 0.01 | 0.74 | 0.02 | 0.81 | 0.01 | 0.83 | 0.01 | 0.86 | 0.01 |
6570 | exec - atom_vec.cpp:735-739 | LAMMPS_NS::AtomVec::unpack_reverse(int, int*, double*) | Single | 0.08 | 0.23 | 0.26 | 0.26 | 0.24 | 0.25 | 0.34 | 0.29 | 0.33 | 0.28 | 0.07 | 0.18 | 0.18 | 0.18 | 0.18 | 0.17 | 0.20 | 0.20 | 0.24 | 0.18 | 0.07 | 0.18 | 0.18 | 0.18 | 0.18 | 0.17 | 0.20 | 0.20 | 0.24 | 0.18 | 2.03 | 0.43 | 0.42 | 0.38 | 0.38 | 0.33 | 0.45 | 0.36 | 0.38 | 0.33 | 2.03 | 0.43 | 0.42 | 0.38 | 0.38 | 0.33 | 0.45 | 0.36 | 0.38 | 0.33 | 1.79 | 0.33 | 0.27 | 0.26 | 0.27 | 0.22 | 0.25 | 0.21 | 0.23 | 0.18 | 1.79 | 0.33 | 0.27 | 0.26 | 0.27 | 0.22 | 0.25 | 0.21 | 0.23 | 0.18 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 2.78 | 39.17 | 52.10 | 54.61 | 53.49 | 71.25 | 65.73 | 77.90 | 75.67 | 107.96 | 0 | 12.5 | 1.14 | 1.28 | 8 | 1.13 | 1.32 | 1.56 | 1.48 | 1.39 | 1.53 | 1.85 | 1.71 | 1.63 | 1.83 | 0 | 2 | 0 | 2 | 1 | 60.00 | 1 | 0 | 0.34 | 0.12 | 0.33 | 0.12 | 0.33 | 0.12 | 0.27 | 0.13 | 0.29 | 0.12 | 0.23 | 0.16 | 0.23 | 0.15 | 0.19 | 0.19 | 0.23 | 0.14 |
846 | exec - neighbor.cpp:2430-2435 | LAMMPS_NS::Neighbor::check_distance() | Single | 0.06 | 0.17 | 0.22 | 0.20 | 0.18 | 0.24 | 0.32 | 0.26 | 0.30 | 0.27 | 0.06 | 0.13 | 0.15 | 0.15 | 0.11 | 0.14 | 0.20 | 0.17 | 0.20 | 0.15 | 0.06 | 0.13 | 0.15 | 0.15 | 0.11 | 0.14 | 0.20 | 0.17 | 0.20 | 0.15 | 1.54 | 0.31 | 0.35 | 0.29 | 0.28 | 0.33 | 0.44 | 0.32 | 0.34 | 0.31 | 1.54 | 0.31 | 0.35 | 0.29 | 0.28 | 0.33 | 0.44 | 0.32 | 0.34 | 0.31 | 1.46 | 0.24 | 0.22 | 0.21 | 0.17 | 0.18 | 0.24 | 0.19 | 0.19 | 0.15 | 1.46 | 0.24 | 0.22 | 0.21 | 0.17 | 0.18 | 0.24 | 0.19 | 0.19 | 0.15 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 16.95 | 151.22 | 167.42 | 174.46 | 227.36 | 218.09 | 157.03 | 207.36 | 201.37 | 266.27 | 44.44 | 18.06 | 1 | 1.76 | 5.71 | 1.05 | 1.32 | 1.58 | 1.39 | 1.69 | 1.87 | 1.79 | 1.75 | 1.75 | 2.18 | 0 | 2 | 0 | 2 | 0 | 75.00 | 1 | 0 | 0.38 | 0.08 | 0.33 | 0.1 | 0.33 | 0.1 | 0.37 | 0.07 | 0.3 | 0.1 | 0.19 | 0.16 | 0.22 | 0.13 | 0.19 | 0.16 | 0.23 | 0.11 |
855 | exec - neighbor.cpp:2480-2483 | LAMMPS_NS::Neighbor::build(int) | Single | 0.06 | 0.12 | 0.13 | 0.15 | 0.13 | 0.13 | 0.17 | 0.15 | 0.14 | 0.13 | 0.06 | 0.09 | 0.09 | 0.10 | 0.09 | 0.09 | 0.13 | 0.12 | 0.10 | 0.10 | 0.06 | 0.09 | 0.09 | 0.10 | 0.09 | 0.09 | 0.13 | 0.12 | 0.10 | 0.10 | 1.51 | 0.22 | 0.20 | 0.22 | 0.20 | 0.17 | 0.23 | 0.18 | 0.16 | 0.15 | 1.51 | 0.22 | 0.20 | 0.22 | 0.20 | 0.17 | 0.23 | 0.18 | 0.16 | 0.15 | 1.38 | 0.17 | 0.14 | 0.14 | 0.14 | 0.11 | 0.16 | 0.13 | 0.09 | 0.10 | 1.38 | 0.17 | 0.14 | 0.14 | 0.14 | 0.11 | 0.16 | 0.13 | 0.09 | 0.10 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1.11 | 1 | 8 | 1.09 | 1.29 | 1.41 | 1.61 | 1.48 | 1.5 | 1.51 | 1.42 | 1.69 | 1.57 | 0 | 2 | 0 | 8 | 0 | 60.00 | 1 | 0 | 0.51 | 0.05 | 0.48 | 0.05 | 0.48 | 0.05 | 0.41 | 0.05 | 0.43 | 0.05 | 0.27 | 0.09 | 0.29 | 0.09 | 0.37 | 0.06 | 0.33 | 0.07 |
14892 | exec - nbin_standard.cpp:254-258 | LAMMPS_NS::NBinStandard::bin_atoms() | Single | 0.05 | 0.07 | 0.08 | 0.08 | 0.08 | 0.07 | 0.10 | 0.08 | 0.08 | 0.08 | 0.04 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.04 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 1.13 | 0.14 | 0.12 | 0.12 | 0.12 | 0.10 | 0.14 | 0.10 | 0.10 | 0.09 | 1.13 | 0.14 | 0.12 | 0.12 | 0.12 | 0.10 | 0.14 | 0.10 | 0.10 | 0.09 | 1.09 | 0.09 | 0.08 | 0.07 | 0.07 | 0.06 | 0.07 | 0.06 | 0.05 | 0.05 | 1.09 | 0.09 | 0.08 | 0.07 | 0.07 | 0.06 | 0.07 | 0.06 | 0.05 | 0.05 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 5.71 | 83.68 | 101.51 | 105.23 | 105.64 | 128.54 | 120.20 | 142.14 | 165.30 | 161.62 | 0 | 8.59 | 1 | 1 | 14.22 | 1.03 | 1.56 | 1.6 | 1.69 | 1.64 | 1.67 | 2.05 | 1.82 | 1.96 | 1.91 | 1 | 0 | 0 | 1 | 3 | 30.00 | 1 | 0 | 0.76 | 0.01 | 0.73 | 0.01 | 0.73 | 0.01 | 0.62 | 0.02 | 0.65 | 0.02 | 0.51 | 0.03 | 0.55 | 0.02 | 0.56 | 0.02 | 0.51 | 0.03 |
6496 | exec - atom_vec.cpp:378-382 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.04 | 0.09 | 0.12 | 0.11 | 0.11 | 0.13 | 0.16 | 0.15 | 0.15 | 0.09 | 0.03 | 0.03 | 0.03 | 0.03 | 0.03 | 0.03 | 0.04 | 0.03 | 0.03 | 0.02 | 0.03 | 0.03 | 0.03 | 0.03 | 0.03 | 0.03 | 0.04 | 0.03 | 0.03 | 0.02 | 0.87 | 0.18 | 0.20 | 0.17 | 0.18 | 0.17 | 0.22 | 0.19 | 0.17 | 0.11 | 0.87 | 0.18 | 0.20 | 0.17 | 0.18 | 0.17 | 0.22 | 0.19 | 0.17 | 0.11 | 0.65 | 0.05 | 0.04 | 0.04 | 0.04 | 0.03 | 0.04 | 0.03 | 0.03 | 0.02 | 0.65 | 0.05 | 0.04 | 0.04 | 0.04 | 0.03 | 0.04 | 0.03 | 0.03 | 0.02 | 6 | 80 | 96 | 106 | 116 | 128 | 144 | 160 | 180 | 184 | 3.61 | 51.19 | 57.90 | 66.47 | 62.16 | 81.26 | 56.25 | 74.58 | 81.65 | 109.95 | 0 | 12.5 | 1.11 | 1.11 | 8 | 1.33 | 3.18 | 3.57 | 3.7 | 3.45 | 4.19 | 3.73 | 4.18 | 4.07 | 3.36 | 0 | 2 | 0 | 2 | 1 | 60.00 | 1 | 0 | 0.86 | 0 | 0.75 | 0.01 | 0.83 | 0 | 0.66 | 0.01 | 0.75 | 0.01 | 0.47 | 0.02 | 0.55 | 0.01 | 0.51 | 0.02 | 0.67 | 0.01 |
6495 | exec - atom_vec.cpp:362-366 | LAMMPS_NS::AtomVec::pack_comm(int, int*, double*, int, int*) | Single | 0.03 | 0.16 | 0.23 | 0.22 | 0.21 | 0.20 | 0.30 | 0.31 | 0.29 | 0.27 | 0.03 | 0.10 | 0.12 | 0.12 | 0.12 | 0.11 | 0.19 | 0.15 | 0.19 | 0.15 | 0.03 | 0.10 | 0.12 | 0.12 | 0.12 | 0.11 | 0.19 | 0.15 | 0.19 | 0.15 | 0.84 | 0.31 | 0.37 | 0.32 | 0.34 | 0.27 | 0.40 | 0.38 | 0.33 | 0.31 | 0.84 | 0.31 | 0.37 | 0.32 | 0.34 | 0.27 | 0.40 | 0.38 | 0.33 | 0.31 | 0.63 | 0.19 | 0.18 | 0.17 | 0.18 | 0.14 | 0.23 | 0.17 | 0.19 | 0.14 | 0.63 | 0.19 | 0.18 | 0.17 | 0.18 | 0.14 | 0.23 | 0.17 | 0.19 | 0.14 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1.11 | 1 | 8 | 1.34 | 1.67 | 2.08 | 1.94 | 1.88 | 1.9 | 1.75 | 2.26 | 1.77 | 2.15 | 0 | 2 | 0 | 2 | 1 | 60.00 | 1 | 0 | 0.21 | 0.08 | 0.18 | 0.1 | 0.18 | 0.1 | 0.14 | 0.1 | 0.16 | 0.09 | 0.09 | 0.17 | 0.1 | 0.14 | 0.08 | 0.18 | 0.1 | 0.13 |
21762 | exec - pair_eam.cpp:976-978 | LAMMPS_NS::PairEAM::unpack_reverse_comm(int, int*, double*) | Single | 0.03 | 0.10 | 0.08 | 0.09 | 0.09 | 0.09 | 0.10 | 0.09 | 0.10 | 0.09 | 0.02 | 0.06 | 0.05 | 0.06 | 0.06 | 0.06 | 0.05 | 0.06 | 0.07 | 0.06 | 0.02 | 0.06 | 0.05 | 0.06 | 0.06 | 0.06 | 0.05 | 0.06 | 0.07 | 0.06 | 0.69 | 0.19 | 0.14 | 0.14 | 0.14 | 0.12 | 0.13 | 0.11 | 0.11 | 0.10 | 0.69 | 0.19 | 0.14 | 0.14 | 0.14 | 0.12 | 0.13 | 0.11 | 0.11 | 0.10 | 0.56 | 0.10 | 0.08 | 0.08 | 0.09 | 0.07 | 0.07 | 0.07 | 0.07 | 0.06 | 0.56 | 0.10 | 0.08 | 0.08 | 0.09 | 0.07 | 0.07 | 0.07 | 0.07 | 0.06 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 2.94 | 40.52 | 56.95 | 58.20 | 58.18 | 73.47 | 83.94 | 84.68 | 88.97 | 116.45 | 0 | 12.5 | 1 | 1.41 | 8 | 1.24 | 1.81 | 1.63 | 1.75 | 1.65 | 1.7 | 2.09 | 1.7 | 1.68 | 1.91 | 0 | 2 | 0 | 0 | 1 | 66.67 | 1 | 0 | 0.33 | 0.04 | 0.34 | 0.04 | 0.33 | 0.04 | 0.27 | 0.04 | 0.28 | 0.04 | 0.27 | 0.04 | 0.24 | 0.05 | 0.21 | 0.05 | 0.24 | 0.04 |
21754 | exec - pair_eam.cpp:939-941 | LAMMPS_NS::PairEAM::pack_forward_comm(int, int*, double*, int, int*) | Single | 0.02 | 0.08 | 0.08 | 0.09 | 0.08 | 0.08 | 0.08 | 0.08 | 0.08 | 0.07 | 0.02 | 0.04 | 0.05 | 0.05 | 0.05 | 0.05 | 0.04 | 0.04 | 0.05 | 0.04 | 0.02 | 0.04 | 0.05 | 0.05 | 0.05 | 0.05 | 0.04 | 0.04 | 0.05 | 0.04 | 0.48 | 0.15 | 0.12 | 0.14 | 0.13 | 0.11 | 0.11 | 0.09 | 0.09 | 0.08 | 0.48 | 0.15 | 0.12 | 0.14 | 0.13 | 0.11 | 0.11 | 0.09 | 0.09 | 0.08 | 0.45 | 0.08 | 0.07 | 0.07 | 0.07 | 0.06 | 0.05 | 0.05 | 0.05 | 0.04 | 0.45 | 0.08 | 0.07 | 0.07 | 0.07 | 0.06 | 0.05 | 0.05 | 0.05 | 0.04 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 1 | 1 | 8 | 1.07 | 1.8 | 1.71 | 1.91 | 1.83 | 1.9 | 2.04 | 2.04 | 2.06 | 1.97 | 0 | 2 | 0 | 0 | 1 | 66.67 | 1 | 0 | 0.34 | 0.03 | 0.32 | 0.03 | 0.3 | 0.04 | 0.26 | 0.03 | 0.27 | 0.03 | 0.26 | 0.03 | 0.26 | 0.03 | 0.24 | 0.04 | 0.24 | 0.03 |
21736 | exec - pair_eam.cpp:232-249 | LAMMPS_NS::PairEAM::compute(int, int) | Innermost | 0.01 | 0.02 | 0.03 | 0.02 | 0.03 | 0.03 | 0.03 | 0.02 | 0.03 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.28 | 0.04 | 0.04 | 0.04 | 0.04 | 0.03 | 0.04 | 0.03 | 0.03 | 0.03 | 0.28 | 0.04 | 0.04 | 0.04 | 0.04 | 0.03 | 0.04 | 0.03 | 0.03 | 0.03 | 0.27 | 0.02 | 0.02 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.27 | 0.02 | 0.02 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 31.50 | 431.95 | 547.19 | 566.68 | 582.14 | 648.25 | 709.78 | 780.77 | 875.33 | 1013.73 | 0 | 11.85 | 1.26 | 1.72 | 10.45 | 1.05 | 2.03 | 2.58 | 2.34 | 2.76 | 2.69 | 2.95 | 2.79 | 3.16 | 3.18 | 2 | 1 | 0 | 1 | 8 | 29.17 | 1 | 0 | 0.86 | 0 | 0.87 | 0 | 0.86 | 0 | 0.77 | 0 | 0.74 | 0 | 0.71 | 0 | 0.69 | 0 | 0.7 | 0 | 0.79 | 0 |
1904 | exec - pair.cpp:1761-1767 | LAMMPS_NS::Pair::virial_fdotr_compute() | Single | 0.01 | 0.04 | 0.04 | 0.05 | 0.04 | 0.04 | 0.05 | 0.05 | 0.05 | 0.04 | 0.01 | 0.03 | 0.03 | 0.04 | 0.03 | 0.03 | 0.04 | 0.04 | 0.04 | 0.03 | 0.01 | 0.03 | 0.03 | 0.04 | 0.03 | 0.03 | 0.04 | 0.04 | 0.04 | 0.03 | 0.30 | 0.07 | 0.07 | 0.07 | 0.07 | 0.06 | 0.07 | 0.06 | 0.06 | 0.05 | 0.30 | 0.07 | 0.07 | 0.07 | 0.07 | 0.06 | 0.07 | 0.06 | 0.06 | 0.05 | 0.27 | 0.05 | 0.05 | 0.05 | 0.05 | 0.04 | 0.04 | 0.04 | 0.04 | 0.02 | 0.27 | 0.05 | 0.05 | 0.05 | 0.05 | 0.04 | 0.04 | 0.04 | 0.04 | 0.02 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 22.83 | 126.66 | 136.25 | 136.74 | 155.60 | 176.01 | 166.14 | 181.34 | 192.37 | 293.21 | 0 | 12.5 | 1.17 | 1.14 | 8 | 1.11 | 1.29 | 1.36 | 1.37 | 1.43 | 1.48 | 1.63 | 1.51 | 1.62 | 1.83 | 1 | 2 | 0 | 4 | 0 | 71.43 | 1 | 0 | 0.3 | 0.02 | 0.26 | 0.03 | 0.25 | 0.03 | 0.24 | 0.02 | 0.23 | 0.03 | 0.19 | 0.03 | 0.18 | 0.03 | 0.18 | 0.03 | 0.25 | 0.02 |
21728 | exec - pair_eam.cpp:181-326 [...] | LAMMPS_NS::PairEAM::compute(int, int) | Outermost | 0.01 | 0.03 | 0.03 | 0.03 | 0.03 | 0.02 | 0.03 | 0.03 | 0.02 | 0.03 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 1.31 | 1.31 | 1.29 | 1.25 | 1.15 | 1.18 | 1.25 | 1.20 | 1.20 | 1.14 | 0.28 | 0.05 | 0.05 | 0.04 | 0.04 | 0.03 | 0.04 | 0.04 | 0.03 | 0.03 | 33.06 | 2.54 | 2.08 | 1.89 | 2.26 | 1.88 | 1.63 | 1.47 | 1.30 | 1.42 | 0.24 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 32.24 | 2.45 | 1.97 | 1.76 | 1.74 | 1.47 | 1.54 | 1.30 | 1.17 | 1.13 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 10.56 | 165.65 | 188.73 | 196.23 | 186.01 | 250.99 | 205.82 | 280.64 | 328.37 | 280.83 | 20 | 13.13 | 2.8 | 1 | 11.79 | 1.16 | 3.22 | 3.32 | 2.99 | 3.25 | 2.86 | 2.73 | 3.72 | 3.13 | 3.25 | NA | NA | NA | NA | NA | 0.00 | 1 | 0 | 0.97 | 0 | 0.89 | 0 | 0.85 | 0 | 0.72 | 0 | 0.81 | 0 | 0.58 | 0 | 0.7 | 0 | 0.74 | 0 | 0.6 | 0 |
6586 | exec - atom_vec.cpp:823-830 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.01 | 0.03 | 0.03 | 0.03 | 0.04 | 0.03 | 0.05 | 0.04 | 0.05 | 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 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.29 | 0.06 | 0.05 | 0.05 | 0.07 | 0.05 | 0.07 | 0.06 | 0.06 | 0.05 | 0.29 | 0.06 | 0.05 | 0.05 | 0.07 | 0.05 | 0.07 | 0.06 | 0.06 | 0.05 | 0.22 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.22 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 6 | 80 | 96 | 106 | 116 | 128 | 144 | 160 | 180 | 184 | 2.20 | 31.90 | 38.14 | 39.59 | 34.60 | 53.99 | 38.19 | 44.95 | 54.04 | 65.64 | 0 | 12.5 | 2.07 | 1.61 | 8 | 1.32 | 3.41 | 2.89 | 2.94 | 3.96 | 3.49 | 3.84 | 3.57 | 4.6 | 4.29 | 1 | 1 | 12 | 2 | 4 | 60.00 | 1 | 0 | 0.86 | 0 | 0.79 | 0 | 0.81 | 0 | 0.64 | 0 | 0.79 | 0 | 0.5 | 0.01 | 0.53 | 0.01 | 0.55 | 0 | 0.67 | 0 |
6585 | exec - atom_vec.cpp:804-811 [...] | LAMMPS_NS::AtomVec::pack_border(int, int*, double*, int, int*) | Single | 0.01 | 0.06 | 0.06 | 0.07 | 0.07 | 0.08 | 0.10 | 0.09 | 0.11 | 0.07 | 0.01 | 0.03 | 0.03 | 0.03 | 0.04 | 0.04 | 0.05 | 0.05 | 0.06 | 0.04 | 0.01 | 0.03 | 0.03 | 0.03 | 0.04 | 0.04 | 0.05 | 0.05 | 0.06 | 0.04 | 0.30 | 0.11 | 0.09 | 0.11 | 0.11 | 0.11 | 0.13 | 0.10 | 0.12 | 0.09 | 0.30 | 0.11 | 0.09 | 0.11 | 0.11 | 0.11 | 0.13 | 0.10 | 0.12 | 0.09 | 0.22 | 0.06 | 0.05 | 0.05 | 0.06 | 0.04 | 0.06 | 0.06 | 0.06 | 0.04 | 0.22 | 0.06 | 0.05 | 0.05 | 0.06 | 0.04 | 0.06 | 0.06 | 0.06 | 0.04 | 6 | 96 | 120 | 126 | 144 | 168 | 192 | 216 | 240 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 12.5 | 2.07 | 1 | 8 | 1.42 | 1.82 | 1.76 | 2.24 | 1.68 | 2.37 | 2.06 | 1.89 | 1.93 | 1.98 | 1 | 1 | 12 | 2 | 4 | 60.00 | 1 | 0 | 0.22 | 0.03 | 0.21 | 0.03 | 0.22 | 0.03 | 0.14 | 0.04 | 0.17 | 0.03 | 0.11 | 0.05 | 0.11 | 0.05 | 0.09 | 0.06 | 0.12 | 0.04 |
6617 | exec - atom_vec.cpp:1035-1041 [...] | LAMMPS_NS::AtomVec::unpack_border(int, int, double*) | Single | 0.01 | 0.04 | 0.05 | 0.05 | 0.06 | 0.06 | 0.06 | 0.07 | 0.06 | 0.07 | 0.01 | 0.02 | 0.02 | 0.02 | 0.02 | 0.03 | 0.03 | 0.03 | 0.03 | 0.04 | 0.01 | 0.02 | 0.02 | 0.02 | 0.02 | 0.03 | 0.03 | 0.03 | 0.03 | 0.04 | 0.26 | 0.07 | 0.09 | 0.08 | 0.10 | 0.07 | 0.07 | 0.08 | 0.07 | 0.07 | 0.26 | 0.07 | 0.09 | 0.08 | 0.10 | 0.07 | 0.07 | 0.08 | 0.07 | 0.07 | 0.20 | 0.04 | 0.03 | 0.03 | 0.04 | 0.03 | 0.04 | 0.04 | 0.03 | 0.04 | 0.20 | 0.04 | 0.03 | 0.03 | 0.04 | 0.03 | 0.04 | 0.04 | 0.03 | 0.04 | 6 | 96 | 120 | 125 | 144 | 167 | 192 | 215 | 237 | 256 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0 | 10.42 | 2 | 1 | 10.67 | 1.28 | 1.77 | 2.49 | 2.35 | 2.66 | 2.4 | 1.89 | 2.15 | 2.17 | 2.16 | 0 | 4 | 1 | 1 | 0 | 87.50 | 1 | 0 | 0.32 | 0.01 | 0.29 | 0.02 | 0.28 | 0.02 | 0.23 | 0.02 | 0.23 | 0.02 | 0.16 | 0.03 | 0.15 | 0.03 | 0.15 | 0.03 | 0.13 | 0.03 |