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Main Authors: Loeffler, Shane E., Ahmad, Zan, Ali, Syed Yusuf, Yamamoto, Carolyna, Popescu, Dan M., Yee, Alana, Lal, Yash, Trayanova, Natalia, Maggioni, Mauro
Format: Preprint
Published: 2024
Subjects:
Online Access:https://arxiv.org/abs/2410.04655
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author Loeffler, Shane E.
Ahmad, Zan
Ali, Syed Yusuf
Yamamoto, Carolyna
Popescu, Dan M.
Yee, Alana
Lal, Yash
Trayanova, Natalia
Maggioni, Mauro
author_facet Loeffler, Shane E.
Ahmad, Zan
Ali, Syed Yusuf
Yamamoto, Carolyna
Popescu, Dan M.
Yee, Alana
Lal, Yash
Trayanova, Natalia
Maggioni, Mauro
contents Predicting time-dependent dynamics of complex systems governed by non-linear partial differential equations (PDEs) with varying parameters and domains is a challenging task motivated by applications across various fields. We introduce a novel family of neural operators based on our Graph Fourier Neural Kernels, designed to learn solution generators for nonlinear PDEs in which the highest-order term is diffusive, across multiple domains and parameters. G-FuNK combines components that are parameter- and domain-adapted with others that are not. The domain-adapted components are constructed using a weighted graph on the discretized domain, where the graph Laplacian approximates the highest-order diffusive term, ensuring boundary condition compliance and capturing the parameter and domain-specific behavior. Meanwhile, the learned components transfer across domains and parameters using our variant Fourier Neural Operators. This approach naturally embeds geometric and directional information, improving generalization to new test domains without need for retraining the network. To handle temporal dynamics, our method incorporates an integrated ODE solver to predict the evolution of the system. Experiments show G-FuNK's capability to accurately approximate heat, reaction diffusion, and cardiac electrophysiology equations across various geometries and anisotropic diffusivity fields. G-FuNK achieves low relative errors on unseen domains and fiber fields, significantly accelerating predictions compared to traditional finite-element solvers.
format Preprint
id arxiv_https___arxiv_org_abs_2410_04655
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Graph Fourier Neural Kernels (G-FuNK): Learning Solutions of Nonlinear Diffusive Parametric PDEs on Multiple Domains
Loeffler, Shane E.
Ahmad, Zan
Ali, Syed Yusuf
Yamamoto, Carolyna
Popescu, Dan M.
Yee, Alana
Lal, Yash
Trayanova, Natalia
Maggioni, Mauro
Machine Learning
Artificial Intelligence
Spectral Theory
Methodology
Predicting time-dependent dynamics of complex systems governed by non-linear partial differential equations (PDEs) with varying parameters and domains is a challenging task motivated by applications across various fields. We introduce a novel family of neural operators based on our Graph Fourier Neural Kernels, designed to learn solution generators for nonlinear PDEs in which the highest-order term is diffusive, across multiple domains and parameters. G-FuNK combines components that are parameter- and domain-adapted with others that are not. The domain-adapted components are constructed using a weighted graph on the discretized domain, where the graph Laplacian approximates the highest-order diffusive term, ensuring boundary condition compliance and capturing the parameter and domain-specific behavior. Meanwhile, the learned components transfer across domains and parameters using our variant Fourier Neural Operators. This approach naturally embeds geometric and directional information, improving generalization to new test domains without need for retraining the network. To handle temporal dynamics, our method incorporates an integrated ODE solver to predict the evolution of the system. Experiments show G-FuNK's capability to accurately approximate heat, reaction diffusion, and cardiac electrophysiology equations across various geometries and anisotropic diffusivity fields. G-FuNK achieves low relative errors on unseen domains and fiber fields, significantly accelerating predictions compared to traditional finite-element solvers.
title Graph Fourier Neural Kernels (G-FuNK): Learning Solutions of Nonlinear Diffusive Parametric PDEs on Multiple Domains
topic Machine Learning
Artificial Intelligence
Spectral Theory
Methodology
url https://arxiv.org/abs/2410.04655