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Linearization Turns Neural Operators into Function-Valued Gaussian Processes

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arxiv 2406.05072 v2 pith:W7SMSYX6 submitted 2024-06-07 cs.LG stat.ML

classification cs.LGstat.ML
keywords neuraloperatorsgaussianapproachbayesianframeworkfunction-valuedlearn
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Neural operators generalize neural networks to learn mappings between function spaces from data. They are commonly used to learn solution operators of parametric partial differential equations (PDEs) or propagators of time-dependent PDEs. However, to make them useful in high-stakes simulation scenarios, their inherent predictive error must be quantified reliably. We introduce LUNO, a novel framework for approximate Bayesian uncertainty quantification in trained neural operators. Our approach leverages model linearization to push (Gaussian) weight-space uncertainty forward to the neural operator's predictions. We show that this can be interpreted as a probabilistic version of the concept of currying from functional programming, yielding a function-valued (Gaussian) random process belief. Our framework provides a practical yet theoretically sound way to apply existing Bayesian deep learning methods such as the linearized Laplace approximation to neural operators. Just as the underlying neural operator, our approach is resolution-agnostic by design. The method adds minimal prediction overhead, can be applied post-hoc without retraining the network, and scales to large models and datasets. We evaluate these aspects in a case study on Fourier neural operators.

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Cited by 2 Pith papers

Reviewed papers in the Pith corpus that reference this work. Sorted by Pith novelty score.

  1. Locally Adaptive Conformal Inference for Operator Models

    stat.ML 2025-07 conditional novelty 6.0 of 10

    LSCI constructs function-valued, locally adaptive conformal prediction sets for operator models by weighting a functional depth score around the test input, with a coverage-gap bound under local exchangeability.

  2. laplax -- Laplace Approximations with JAX

    cs.LG 2025-07 conditional novelty 6.0 of 10

    The paper presents laplax, a modular JAX library for Laplace approximations that supports multiple curvature estimates, uncertainty pushforwards, calibration, and evaluation routines.

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