| ID | Module | Source Location | Source Function | Level | Max Time Over Threads (s) | Time w.r.t. Wall Time (s) | Coverage (% app. time) | Speedup if no scalar integer | Speedup if FP arith vectorized | Speedup if fully vectorized | Speedup if FP only | Number of paths | Vectorization Ratio (%) | Vector Length Use (%) | Flops (GFLOP/s) | CQA cycles | CQA cycles if no scalar integer | CQA cycles if FP arith vectorized | CQA cycles if fully vectorized | CQA cycles if FP only |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ○Loop 88 | exec | ljForce.c:191-191,ljForce.c:197-216 | ljForce.extracted | Innermost | 2.51 | 2.17 | 44.65 | 1.00 | 2.54 | 5.18 | 1.00 | 3 | 35.93 | 16.99 | 0.00 | 5.17 | 5.17 | 2.03 | 1.00 | 5.17 |
| ○Loop 94 | exec | timestep.c:74-78 | advanceVelocity.extracted | Innermost | 0.08 | 0.03 | 0.68 | 1.08 | 1.13 | 8.00 | 1.50 | 1 | 0.00 | 12.50 | 0.00 | 4.50 | 4.17 | 4.00 | 0.56 | 3.00 |
| ○Loop 96 | exec | timestep.c:88-94 | advancePosition.extracted | Innermost | 0.08 | 0.03 | 0.68 | 1.00 | 1.68 | 2.00 | 1.00 | 1 | 0.00 | 12.50 | 0.00 | 8.00 | 8.00 | 4.75 | 4.00 | 8.00 |
| ○Loop 87 | exec | ljForce.c:187-187,ljForce.c:197-197 | ljForce.extracted | InBetween | 0.07 | 0.03 | 0.61 | 1.00 | 1.00 | 16.00 | 2.67 | 3 | 0.00 | 6.25 | 0.00 | 1.33 | 1.33 | 1.33 | 0.08 | 0.50 |
| ○Loop 90 | exec | mytype.h:23-23,ljForce.c:158-162 | ljForce.extracted.27 | Single | 0.07 | 0.03 | 0.60 | 3.00 | 1.00 | 8.00 | 12.00 | 1 | 33.33 | 12.50 | 0.00 | 12.00 | 4.00 | 12.00 | 1.50 | 1.00 |
| ○Loop 82 | exec | linkCells.c:209-221,linkCells.c:227-247,linkCells.c:258-269,linkCells.c:295-301,linkCells.c:327-334,linkCells.c:352-353,linkCells.c:359-365,linkCells.c:371-371 | updateLinkCells | Innermost | 0.91 | 0.02 | 0.43 | 2.60 | 2.51 | 11.15 | 3.28 | 70 | 34.43 | 14.45 | 0.00 | 31.17 | 12.00 | 12.41 | 2.80 | 9.50 |
| ○Loop 58 | exec | haloExchange.c:621-629 | sortAtomsInCell | Single | 0.05 | 0.02 | 0.39 | 1.60 | 1.00 | 5.55 | 2.67 | 1 | 50.00 | 22.92 | 0.00 | 2.67 | 1.67 | 2.67 | 0.48 | 1.00 |
| ○Loop 86 | exec | ljForce.c:178-184,ljForce.c:191-191,ljForce.c:197-197 | ljForce.extracted | InBetween | 0.04 | 0.01 | 0.18 | 1.00 | 1.00 | 13.24 | 2.00 | 4 | 0.00 | 10.16 | 0.00 | 3.00 | 3.00 | 3.00 | 0.23 | 1.50 |
| ○Loop 46 | exec | haloExchange.c:380-389 | loadAtomsBuffer | Innermost | 0.13 | 0.00 | 0.05 | 1.58 | 1.06 | 7.24 | 3.17 | 1 | 30.77 | 13.94 | 0.00 | 3.17 | 2.00 | 3.00 | 0.44 | 1.00 |
| ○Loop 95 | exec | timestep.c:86-96 | advancePosition.extracted | Outermost | 0.02 | 0.00 | 0.04 | 1.71 | 2.31 | 3.42 | 1.71 | 5 | 0.00 | 10.55 | 0.00 | 6.83 | 4.00 | 2.95 | 2.00 | 4.00 |
| ○Loop 91 | exec | random.c:26-29,random.c:45-48 | gasdev | Single | 0.01 | 0.00 | 0.04 | 1.00 | 2.97 | 8.00 | 1.00 | 1 | 0.00 | 12.50 | 0.00 | 18.00 - 30.00 | 18.00 - 30.00 | 6.07 - 10.11 | 2.25 - 3.75 | 18.00 - 30.00 |
| ○Loop 59 | exec | haloExchange.c:633-642 | sortAtomsInCell | Single | 0.01 | 0.00 | 0.03 | 1.50 | 1.00 | 6.86 | 3.00 | 1 | 33.33 | 14.58 | 0.00 | 3.00 | 2.00 | 3.00 | 0.44 | 1.00 |
| ○Loop 47 | exec | haloExchange.c:414-424 | unloadAtomsBuffer | Single | 0.05 | 0.00 | 0.02 | 1.33 | 1.00 | 9.14 | 5.33 | 1 | 0.00 | 11.25 | 0.00 | 5.33 | 4.00 | 5.33 | 0.58 | 1.00 |
| ○Loop 101 | exec | timestep.c:110-116 | kineticEnergy.extracted | Innermost | 0.01 | 0.00 | 0.02 | 1.00 | 1.00 | 1.00 | 1.00 | 1 | 100.00 | 45.65 | 0.00 | 8.00 | 8.00 | 8.00 | 8.00 | 8.00 |
| ○Loop 85 | exec | ljForce.c:172-175,ljForce.c:180-182,ljForce.c:187-187,ljForce.c:222-222 | ljForce.extracted | Outermost | 0.01 | 0.00 | 0.01 | 1.00 | 1.00 | 15.70 | 1.06 | 2 | 0.00 | 7.70 | 0.00 | 8.75 | 8.75 | 8.75 | 0.56 | 8.25 |
| ○Loop 93 | exec | timestep.c:72-80 | advanceVelocity.extracted | Outermost | 0.01 | 0.00 | 0.01 | 2.06 | 2.14 | 12.19 | 2.33 | 5 | 0.00 | 10.42 | 0.00 | 5.83 | 2.83 | 2.72 | 0.48 | 2.50 |
| ○Loop 74 | exec | initAtoms.c:197-202 | randomDisplacements.extracted | Innermost | 0.00 | 0.00 | 0.01 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 81 | exec | linkCells.c:229-229,linkCells.c:234-234,linkCells.c:291-297,linkCells.c:353-353,linkCells.c:359-359,linkCells.c:365-365 | updateLinkCells | Outermost | 0.03 | 0.00 | 0.01 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 45 | exec | haloExchange.c:376-384,haloExchange.c:387-387 | loadAtomsBuffer | Outermost | 0.01 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 80 | exec | linkCells.c:151-153,linkCells.c:209-221,linkCells.c:227-237,linkCells.c:246-247 | getNeighborBoxes | Innermost | 0.01 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 72 | exec | initAtoms.c:154-162 | setTemperature.extracted.30 | Innermost | 0.00 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 100 | exec | timestep.c:110-116 | kineticEnergy.extracted | Innermost | 0.00 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 99 | exec | timestep.c:108-114,timestep.c:118-118 | kineticEnergy.extracted | Outermost | 0.00 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 98 | exec | timestep.c:153-154 | redistributeAtoms.extracted | Single | 0.01 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 62 | exec | initAtoms.c:90-100 | createFccLattice | Innermost | 0.00 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |
| ○Loop 71 | exec | initAtoms.c:152-157,initAtoms.c:164-164 | setTemperature.extracted.30 | Outermost | 0.00 | 0.00 | 0.00 | NA | NA | NA | NA | NA | NA | NA | 0.00 | NA | NA | NA | NA | NA |