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Codebase release 1.0 for TorchGPE

Lorenzo Fioroni, Luca Gravina, Justyna Stefaniak, Alexander Baumgärtner, Fabian Finger, Davide Dreon, Tobias Donner

SciPost Phys. Codebases 38-r1.0 (2024) · published 6 November 2024

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Abstract

TorchGPE is a general-purpose Python package developed for solving the Gross-Pitaevskii equation (GPE). This solver is designed to integrate wave functions across a spectrum of linear and non-linear potentials. A distinctive aspect of TorchGPE is its modular approach, which allows the incorporation of arbitrary self-consistent and time-dependent potentials, e.g., those relevant in many-body cavity QED models. The package employs a symmetric split-step Fourier propagation method, effective in both real and imaginary time. In our work, we demonstrate a significant improvement in computational efficiency by leveraging GPU computing capabilities. With the integration of the latter technology, TorchGPE achieves a substantial speed-up with respect to conventional CPU-based methods, greatly expanding the scope and potential of research in this field.

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