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Expand Up @@ -89,38 +89,38 @@ Solves a 2D Laplace problem using Finite Differences methods. The code is adapte

Runs a molecular dynamics simulation. The code is adapted from examples written by [J. Burkardt](https://people.sc.fsu.edu/~jburkardt/py_src/py_src.html)
## Development branch results
### Performance Comparison (as of Tue Oct 8 16:19:47 UTC 2024)
### Performance Comparison (as of Wed Oct 9 05:32:47 UTC 2024)
## Compilation time
Algorithm | python | pythran_gnu | pythran_intel | numba | pyccel_fortran_gnu | pyccel_c_gnu | pyccel_fortran_intel | pyccel_c_intel
------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | -------------------------
Ackermann | - | 2.30 | 2.09 | 0.33 | 1.30 | 1.28 | 1.36 | 1.40
Bellman Ford | - | 3.26 | 3.59 | 1.10 | 3.63 | 3.95 | 3.74 | 4.51
Dijkstra | - | 2.32 | 2.69 | 1.61 | 3.69 | 3.99 | 3.89 | 4.68
Euler | - | 2.71 | 3.19 | 2.19 | 3.67 | 4.02 | 3.80 | 4.59
Midpoint Explicit | - | 2.95 | 3.57 | 3.16 | 3.91 | 4.23 | 4.03 | 4.84
Midpoint Fixed | - | 3.39 | 4.04 | 3.32 | 3.96 | 4.31 | 4.05 | 4.79
RK4 | - | 3.74 | 4.34 | 3.84 | 4.40 | 4.66 | 4.46 | 5.27
FD - L Convection | - | 2.38 | 2.83 | 0.90 | 1.43 | 3.96 | 1.57 | 4.59
FD - NL Convection | - | 3.13 | 3.60 | 0.89 | 1.39 | 3.91 | 1.56 | 4.42
FD - Poisson | - | 3.28 | 3.83 | 1.38 | 1.51 | 3.99 | 2.74 | 4.54
FD - Laplace | - | 6.37 | 9.05 | 3.11 | 1.82 | 4.33 | 2.08 | 4.96
M-D | - | 6.15 | 7.86 | 4.17 | 4.37 | 4.51 | 4.50 | 5.73
Ackermann | - | 2.16 | 2.04 | 0.33 | 1.30 | 1.27 | 1.37 | 1.37
Bellman Ford | - | 3.28 | 3.62 | 1.09 | 3.59 | 3.88 | 3.68 | 4.44
Dijkstra | - | 2.27 | 2.64 | 1.59 | 3.63 | 3.89 | 3.79 | 4.52
Euler | - | 2.52 | 2.97 | 2.04 | 3.57 | 3.89 | 3.67 | 4.41
Midpoint Explicit | - | 2.86 | 3.41 | 3.03 | 3.81 | 4.12 | 3.91 | 4.60
Midpoint Fixed | - | 3.25 | 3.79 | 3.24 | 3.87 | 4.17 | 3.96 | 4.72
RK4 | - | 3.52 | 4.11 | 3.77 | 4.30 | 4.57 | 4.36 | 5.11
FD - L Convection | - | 2.18 | 2.67 | 0.87 | 1.38 | 3.86 | 1.53 | 4.40
FD - NL Convection | - | 3.08 | 3.54 | 0.89 | 1.40 | 3.88 | 1.55 | 4.40
FD - Poisson | - | 3.17 | 3.65 | 1.34 | 1.50 | 3.97 | 2.72 | 4.51
FD - Laplace | - | 6.17 | 8.69 | 3.06 | 1.81 | 4.30 | 2.05 | 4.89
M-D | - | 6.03 | 7.64 | 4.07 | 4.30 | 4.45 | 4.46 | 5.59

## Execution time
Algorithm | python | pythran_gnu | pythran_intel | numba | pyccel_fortran_gnu | pyccel_c_gnu | pyccel_fortran_intel | pyccel_c_intel
------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | -------------------------
Ackermann (ms) | 293.00 | 2.88 | 3.05 | 9.68 | 1.51 | 1.56 | 8.97 | 4.38
Bellman Ford (ms) | 1760.00 | 5.26 | 3.15 | 3.84 | 3.03 | 6.02 | - | 18.50
Dijkstra (ms) | 4910.00 | 25.20 | 16.50 | 18.70 | 18.00 | 31.60 | - | 22.50
Euler (ms) | 3890.00 | 25.50 | 27.30 | 38.80 | 17.00 | 144.00 | 15.00 | 129.00
Midpoint Explicit (ms) | 8080.00 | 52.80 | 51.60 | 78.30 | 23.80 | 287.00 | 16.90 | 253.00
Midpoint Fixed (ms) | 40200.00 | 254.00 | 92.60 | 378.00 | 76.90 | 1400.00 | 62.10 | 1230.00
RK4 (ms) | 20200.00 | 159.00 | 38.50 | 139.00 | 37.10 | 492.00 | 39.20 | 412.00
FD - L Convection (ms) | 2230.00 | 1.64 | 1.50 | 2.68 | 1.67 | 1.60 | - | 4.16
FD - NL Convection (ms) | 2720.00 | 1.77 | 1.73 | 2.83 | 2.03 | 1.99 | - | 4.40
FD - Poisson (ms) | 6230.00 | 2.98 | 5.60 | 7.19 | 2.82 | 3.87 | - | 5.73
FD - Laplace (ms) | 589.00 | 65.30 | 150.00 | 248.00 | 59.40 | 283.00 | - | 326.00
M-D (ms) | 14800.00 | 15.30 | 53.00 | 59.60 | 54.70 | 60.00 | 80.60 | 61.70
Ackermann (ms) | 291.00 | 2.88 | 3.06 | 9.81 | 1.55 | 1.56 | 10.30 | 4.80
Bellman Ford (ms) | 1750.00 | 5.26 | 3.13 | 3.93 | 3.00 | 6.18 | - | 18.70
Dijkstra (ms) | 4980.00 | 24.30 | 15.60 | 18.80 | 17.80 | 30.20 | - | 21.50
Euler (ms) | 3830.00 | 24.90 | 24.80 | 37.50 | 15.50 | 146.00 | 14.40 | 128.00
Midpoint Explicit (ms) | 7820.00 | 53.30 | 51.10 | 77.70 | 24.20 | 284.00 | 15.50 | 251.00
Midpoint Fixed (ms) | 40200.00 | 252.00 | 91.80 | 380.00 | 74.50 | 1420.00 | 60.60 | 1270.00
RK4 (ms) | 20000.00 | 159.00 | 34.90 | 138.00 | 33.60 | 488.00 | 36.80 | 408.00
FD - L Convection (ms) | 2230.00 | 1.71 | 1.50 | 2.67 | 1.90 | 1.63 | - | 4.22
FD - NL Convection (ms) | 2760.00 | 1.77 | 1.80 | 3.03 | 2.02 | 2.00 | - | 4.15
FD - Poisson (ms) | 6320.00 | 3.03 | 5.62 | 7.18 | 2.76 | 3.85 | - | 5.66
FD - Laplace (ms) | 581.00 | 64.60 | 151.00 | 246.00 | 59.10 | 308.00 | - | 326.00
M-D (ms) | 15000.00 | 15.20 | 53.30 | 59.40 | 55.00 | 60.00 | 80.50 | 61.70

![Development compilation results](./version_specific_results/devel_performance_310_compilation.svg)
![Development execution results](./version_specific_results/devel_performance_310_execution.svg)
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