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Curvature-aware Graph Attention for PDEs on Manifolds

ICML 2025 · Graph learning › Graph algorithms and clustering · approach: Graph embedding and spectral sparsification

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Proposes Curv-GT, a curvature-aware graph attention for learning time-dependent PDEs on discrete 2D manifolds, using parallel transport, tensor fields, closed-form transport on constant-curvature surfaces, and subtree-based parameter sharing.

Problem

Neural operators for time-dependent PDEs on discrete manifolds (graphs with node coordinates) mostly ignore intrinsic geometry such as curvature, relying on spatial coordinates or Euclidean assumptions.

Approach

Generalizes vanilla graph attention to manifolds by moving neighbor features via parallel transport and replacing linear maps with (1,1) and (0,2) tensor fields; edges are embedded in sphere, plane, or pseudosphere according to local Gaussian curvature so transport has closed form, and subtree partitioning shares parameters across nodes via transport.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
replace vanilla attention with curvature-aware attention (ablation)GAT · Wrinkle manifold, p-Laplacian diffusionL2 relative error (%): 8.47±2.82 -> 3.41±0.59Helped
directly concatenate point curvatures to node features (ablation)GAT · Wrinkle manifold, p-Laplacian diffusionL2 relative error (%): 8.47±2.82 -> 6.92±1.86Helped
aggregate information with a shared linear mapping (ablation)GAT · Wrinkle manifold, p-Laplacian diffusionL2 relative error (%): 8.47±2.82 -> 4.57±0.70Helped
replace vanilla attention with curvature-aware attention (ablation)GraphTransformer · Wrinkle manifold, p-Laplacian diffusionL2 relative error (%): 9.70±4.24 -> 1.58±0.84Helped
replace vanilla attention with curvature-aware attention (ablation)GNOT · Wrinkle manifold, p-Laplacian diffusionL2 relative error (%): 4.39±1.92 -> 0.92±0.31Helped
increase the number of curvature-aware attention heads (ablation)Curvature-aware attention · Wrinkle manifoldsquare loss on test setHelped
use too large a maximum subtree depth (ablation)Curvature-aware attention · Wrinkle manifoldsquare loss on test setHurt

Surprising findings

Limitations

Experimental setup

Datasets: wrinkle manifold PDE data (isotropic diffusion, p-Laplacian diffusion, wave equation) torus elliptic paraboloid

Benchmarks: wrinkle manifold isotropic diffusion wrinkle manifold p-Laplacian diffusion wrinkle manifold wave equation

Metrics: relative L2 error (%) relative H1 error (%) training time per epoch

Baselines: ResNet GCN DeepONet GraphTransformer FourierType GalerkinType Graph U-Net MKGN GNOT GINO Geo-FNO Transolver

Builds on: Graph Transformer Graphormer Geo-FNO Transolver Graph Attention Networks

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