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semiclassical-dynamics

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EliousMondal / PLDM

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A serial, parallel and vectorised version of PLDM dynamics has been implemented. The serial version uses numba to get speedup of a compiled language. The parallel version uses mpi4py to utilise the multiprocessing capability of HPC clusters. The vectorised version uses a wide variety of GPU libraries (cuda, cupy, pytorch) to highly vectorise PLDM.

numpy cuda pytorch path-integral gpu-acceleration fft numba mpi4py cupy chebyshev-polynomials pldm semiclassical-dynamics
  • Updated Jul 15, 2024
  • Python

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