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Reference Neural Operators: Learning the Smooth Dependence of Solutions of PDEs on Geometric Deformations

ICML 2024 · Probabilistic and scientific modeling › Differential equations and PDEs · approach: Neural operators for general geometries · 1 citations (OpenAlex)

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Proposes reference neural operators (RNO) that learn the material-derivative-style change in solution caused by a geometric deformation from a reference solution, achieving strong accuracy with small datasets.

Problem

Learning neural operators that map geometries to PDE solutions requires large geometry-solution datasets, which are prohibitive for expensive industrial simulations such as engineering design optimization.

Approach

Instead of learning geometry-to-solution maps, learn the difference between the queried solution and the pushforward of a reference solution under a smooth deformation, using a distance-aware cross attention (with a linear-complexity random-feature variant) to combine reference solution, deformation, and geometry inputs.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
Use RNO to predict the solution from a reference solution and geometry deformationRNO vs. strongest listed baseline · NS2d-360, NS2d-sq-360, Inductor2d-320, Heatsink3d-80relative L2 error: NS2d-360 u: 1.0e-1 -> 3.9e-2; Inductor2d-320 Az: 2.5e-2 -> 4.3e-3Helped
Predict δu and add it to the pushed-forward reference solution instead of predicting u_q directly (ablation)RNO · NS2d, NS2d-sq, Inductor2drelative L2 error: 7.4e-2 -> 6.3e-2; 1.2e-1 -> 1.1e-1; 3.6e-2 -> 1.5e-2Helped
Add DACA layers (ablation)RNO · NS2d, NS2d-sq, Inductor2drelative L2 error: 9.9e-2 -> 6.3e-2; 2e-1 -> 1.1e-1; 3.8e-2 -> 1.5e-2Helped
Replace full DACA with linear DACA using random feature mapping (ablation)RNO-L · NS2d-360 and NS2d-1440relative L2 error: NS2d-360 u: 3.9e-2 -> 4.2e-2; NS2d-1440 u: 1.9e-2 -> 2.5e-2; NS2d-360 v: 1.1e-1 -> 1.1e-1Mixed
Increase the number of RNO layers beyond 3 (ablation)RNO · RNO experimentsrelative L2 errorNo clear effect
Increase DACA γ (ablation)RNO · NS2dmean relative L2 errorHurt
Increase DACA γ (ablation)RNO · Inductor2dmean relative L2 errorHelped
Use the reference pushforward alone, without predicting δu (ablation)RNO · NS2d, NS2d-sq, Inductor2d, Heatsink3dmean relative L2 error: 6.3e-2 -> 1.2e-1; 1.1e-1 -> 2.5e-1; 1.5e-2 -> 7.3e-2; 8.6e-2 -> 1.6e-1Hurt
Increase the training dataset size (ablation)RNO · NS2drelative L2 errorHelped

Surprising findings

Limitations

Experimental setup

Datasets: NS2d NS2d-sq Inductor2d Heatsink3d Airfoil-Euler Airfoil-RANS

Benchmarks: NS2d-360 NS2d-sq-360 Inductor2d-320 Heatsink3d-80 NS2d-1440 Airfoil-Euler Airfoil-RANS

Metrics: relative L2 error

Baselines: GNOT R-GNOT Geo-FNO R-FNO-i R-MIONet CORAL NU-FNO pushforward of reference solution

Builds on: Geo-FNO GNOT Fourier Neural Operator DeepONet random feature mapping

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