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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 Fri Jan 17 12:17:53 UTC 2025)
### Performance Comparison (as of Fri Jan 17 13:07:48 UTC 2025)
## Compilation time
Algorithm | python | pythran_gnu | pythran_intel | numba | pyccel_fortran_gnu | pyccel_c_gnu | pyccel_fortran_intel | pyccel_c_intel
------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | -------------------------
Ackermann | - | 2.34 | 2.11 | 0.33 | 1.34 | 1.31 | 1.45 | 1.42
Bellman Ford | - | 3.51 | 3.72 | 1.08 | 3.74 | 4.07 | 3.92 | 4.07
Dijkstra | - | 2.42 | 2.67 | 1.58 | 3.76 | 4.07 | 3.95 | 4.06
Euler | - | 2.70 | 3.04 | 2.11 | 3.78 | 4.05 | 3.92 | 4.15
Midpoint Explicit | - | 3.24 | 3.67 | 3.16 | 4.05 | 4.46 | 4.17 | 4.45
Midpoint Fixed | - | 3.68 | 4.09 | 3.36 | 4.06 | 4.39 | 4.24 | 4.43
RK4 | - | 4.06 | 4.42 | 3.87 | 4.47 | 4.77 | 4.59 | 4.83
FD - L Convection | - | 2.42 | 2.75 | 0.89 | 1.45 | 4.05 | 1.64 | 4.01
FD - NL Convection | - | 3.40 | 3.64 | 0.92 | 1.44 | 4.04 | 1.62 | 4.01
FD - Poisson | - | 3.46 | 3.82 | 1.39 | 1.59 | 4.21 | 2.93 | 4.14
FD - Laplace | - | 6.91 | 8.19 | 3.08 | 1.87 | 4.45 | 2.13 | 4.38
M-D | - | 6.58 | 6.95 | 4.11 | 4.62 | 4.78 | 4.85 | 5.02
Ackermann | - | 2.32 | 2.13 | 0.34 | 1.34 | 1.30 | 1.45 | 1.39
Bellman Ford | - | 3.43 | 3.68 | 1.09 | 3.67 | 4.00 | 3.85 | 4.13
Dijkstra | - | 2.50 | 2.73 | 1.61 | 3.73 | 4.03 | 3.94 | 4.05
Euler | - | 2.77 | 3.12 | 2.07 | 3.70 | 4.05 | 3.90 | 4.07
Midpoint Explicit | - | 3.13 | 3.68 | 3.16 | 4.03 | 4.33 | 4.13 | 4.31
Midpoint Fixed | - | 3.75 | 4.29 | 3.39 | 4.14 | 4.57 | 4.26 | 4.60
RK4 | - | 4.11 | 4.58 | 4.14 | 4.44 | 4.85 | 4.56 | 4.80
FD - L Convection | - | 2.40 | 2.76 | 0.91 | 1.45 | 3.99 | 1.64 | 4.09
FD - NL Convection | - | 3.35 | 3.66 | 0.93 | 1.49 | 4.06 | 1.68 | 4.04
FD - Poisson | - | 3.56 | 3.92 | 1.37 | 1.58 | 4.19 | 2.96 | 4.12
FD - Laplace | - | 7.03 | 8.55 | 3.20 | 1.92 | 4.46 | 2.15 | 4.56
M-D | - | 6.80 | 7.21 | 4.30 | 4.60 | 4.71 | 4.77 | 4.93

## Execution time
Algorithm | python | pythran_gnu | pythran_intel | numba | pyccel_fortran_gnu | pyccel_c_gnu | pyccel_fortran_intel | pyccel_c_intel
------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | ------------------------- | -------------------------
Ackermann (ms) | 290.00 | 2.86 | 3.03 | 9.64 | 1.50 | 1.59 | 10.30 | 4.76
Bellman Ford (ms) | 1840.00 | 5.21 | 3.44 | 3.79 | 3.00 | 5.98 | 4.20 | 18.90
Dijkstra (ms) | 4950.00 | 24.60 | 17.10 | 20.40 | 19.60 | 31.00 | 24.30 | 23.00
Euler (ms) | 3880.00 | 25.50 | 26.10 | 37.30 | 16.30 | 144.00 | 14.40 | 127.00
Midpoint Explicit (ms) | 7860.00 | 52.60 | 52.50 | 77.50 | 23.90 | 283.00 | 17.30 | 250.00
Midpoint Fixed (ms) | 40100.00 | 252.00 | 93.40 | 376.00 | 75.90 | 1410.00 | 59.40 | 1220.00
RK4 (ms) | 19800.00 | 184.00 | 36.70 | 136.00 | 36.20 | 488.00 | 38.50 | 404.00
FD - L Convection (ms) | 2320.00 | 1.63 | 1.60 | 2.66 | 1.58 | 1.88 | 1.63 | 4.11
FD - NL Convection (ms) | 2850.00 | 1.78 | 1.66 | 2.79 | 1.86 | 2.21 | 1.48 | 4.18
FD - Poisson (ms) | 6230.00 | 2.96 | 5.48 | 7.23 | 2.62 | 3.71 | 2.58 | 4.93
FD - Laplace (ms) | 580.00 | 69.30 | 143.00 | 247.00 | 58.60 | 257.00 | 62.40 | 300.00
M-D (ms) | 15000.00 | 15.10 | 52.60 | 59.30 | 53.70 | 59.50 | 91.80 | 60.70
Ackermann (ms) | 291.00 | 2.87 | 3.04 | 9.60 | 1.50 | 1.59 | 8.72 | 3.92
Bellman Ford (ms) | 1850.00 | 5.24 | 3.41 | 3.93 | 3.00 | 6.15 | 4.37 | 19.20
Dijkstra (ms) | 4980.00 | 25.90 | 17.00 | 19.30 | 19.30 | 31.00 | 23.50 | 21.80
Euler (ms) | 3830.00 | 24.90 | 25.60 | 36.90 | 15.40 | 143.00 | 14.80 | 127.00
Midpoint Explicit (ms) | 7810.00 | 52.50 | 51.80 | 78.50 | 23.50 | 282.00 | 16.60 | 250.00
Midpoint Fixed (ms) | 39800.00 | 252.00 | 92.60 | 370.00 | 77.10 | 1430.00 | 62.80 | 1220.00
RK4 (ms) | 19900.00 | 160.00 | 35.70 | 137.00 | 34.60 | 496.00 | 37.70 | 405.00
FD - L Convection (ms) | 2300.00 | 1.64 | 1.61 | 2.70 | 1.63 | 1.62 | 1.49 | 4.09
FD - NL Convection (ms) | 2850.00 | 1.85 | 1.69 | 2.80 | 1.99 | 1.99 | 1.34 | 4.37
FD - Poisson (ms) | 6190.00 | 3.01 | 5.52 | 7.12 | 2.58 | 3.79 | 2.56 | 4.97
FD - Laplace (ms) | 577.00 | 68.00 | 143.00 | 246.00 | 63.30 | 256.00 | 58.30 | 273.00
M-D (ms) | 14800.00 | 15.20 | 52.90 | 58.90 | 53.70 | 59.30 | 91.40 | 63.30

![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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