Vectorized Conditional Neural Fields: A Framework for Solving Time-dependent Parametric Partial Differential Equations

Bibliographic Details
Title: Vectorized Conditional Neural Fields: A Framework for Solving Time-dependent Parametric Partial Differential Equations
Authors: Hagnberger, Jan, Kalimuthu, Marimuthu, Musekamp, Daniel, Niepert, Mathias
Publication Year: 2024
Collection: Computer Science
Physics (Other)
Subject Terms: Computer Science - Machine Learning, Computer Science - Artificial Intelligence, Computer Science - Computer Vision and Pattern Recognition, Computer Science - Neural and Evolutionary Computing, Physics - Computational Physics
More Details: Transformer models are increasingly used for solving Partial Differential Equations (PDEs). Several adaptations have been proposed, all of which suffer from the typical problems of Transformers, such as quadratic memory and time complexity. Furthermore, all prevalent architectures for PDE solving lack at least one of several desirable properties of an ideal surrogate model, such as (i) generalization to PDE parameters not seen during training, (ii) spatial and temporal zero-shot super-resolution, (iii) continuous temporal extrapolation, (iv) support for 1D, 2D, and 3D PDEs, and (v) efficient inference for longer temporal rollouts. To address these limitations, we propose Vectorized Conditional Neural Fields (VCNeFs), which represent the solution of time-dependent PDEs as neural fields. Contrary to prior methods, however, VCNeFs compute, for a set of multiple spatio-temporal query points, their solutions in parallel and model their dependencies through attention mechanisms. Moreover, VCNeF can condition the neural field on both the initial conditions and the parameters of the PDEs. An extensive set of experiments demonstrates that VCNeFs are competitive with and often outperform existing ML-based surrogate models.
Comment: Accepted for publication at the 41st International Conference on Machine Learning (ICML) 2024, Vienna, Austria; Project Page: https://jhagnberger.github.io/vectorized-conditional-neural-field/
Document Type: Working Paper
Access URL: http://arxiv.org/abs/2406.03919
Accession Number: edsarx.2406.03919
Database: arXiv
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