Integrating Locality-Aware Attention with Transformers for General Geometry PDEs
This addresses the problem of accurate PDE simulation on irregular domains for computational science, representing a strong incremental advance in neural operator methods.
The paper tackles the limitation of Transformer-based neural operators in capturing fine-scale dynamics for PDEs on complex geometries by proposing LA2Former, which integrates global-local attention and achieves over 50% accuracy improvement over existing linear attention methods.
Neural operators have emerged as promising frameworks for learning mappings governed by partial differential equations (PDEs), serving as data-driven alternatives to traditional numerical methods. While methods such as the Fourier neural operator (FNO) have demonstrated notable performance, their reliance on uniform grids restricts their applicability to complex geometries and irregular meshes. Recently, Transformer-based neural operators with linear attention mechanisms have shown potential in overcoming these limitations for large-scale PDE simulations. However, these approaches predominantly emphasize global feature aggregation, often overlooking fine-scale dynamics and localized PDE behaviors essential for accurate solutions. To address these challenges, we propose the Locality-Aware Attention Transformer (LA2Former), which leverages K-nearest neighbors for dynamic patchifying and integrates global-local attention for enhanced PDE modeling. By combining linear attention for efficient global context encoding with pairwise attention for capturing intricate local interactions, LA2Former achieves an optimal balance between computational efficiency and predictive accuracy. Extensive evaluations across six benchmark datasets demonstrate that LA2Former improves predictive accuracy by over 50% relative to existing linear attention methods, while also outperforming full pairwise attention under optimal conditions. This work underscores the critical importance of localized feature learning in advancing Transformer-based neural operators for solving PDEs on complex and irregular domains.