From Basis to Basis: Gaussian Particle Representation for Interpretable PDE Operators

Neural operators provide efficient surrogates for spatiotemporal PDE systems, but purely data-driven formulations often accumulate substantial errors during long-horizon autoregressive prediction and may fail to exploit available governing-equation structure. Existing approaches incorporate physics primarily through residual-based training objectives or PDE-specific architectural constraints, which can introduce optimization difficulties or limit architectural generality. In this work, we introduce a representation-level approach to physics integration in which a feed-forward Gaussian splatting (FFGS) representation serves as a continuous interface between discretized solution fields and governing operators. The FFGS representation reconstructs the state as a continuous Gaussian field with closed-form spatial derivatives, allowing available physical PDE operators to be integrated directly within the learned evolution map without introducing a physics-residual loss. We evaluate the framework across two- and three-dimensional PDE systems, including advection, diffusion, nonlinear self-advection, and reaction dynamics. Over long-horizon autoregressive rollouts, the proposed framework reduces relative $\ell_2$ error by $1.5\times$--$2.2\times$ compared with the strongest purely data-driven baseline across the benchmark suite, while consistently improving spectral fidelity. The framework also remains effective when the governing equations are partially known, demonstrating robustness to incomplete physics. These results demonstrate that continuous field representations can provide a practical interface for incorporating known physical structure into generic neural-operator surrogates.

Neural operators have emerged as powerful data-driven solvers for PDEs, offering substantial acceleration over classical numerical methods. However, existing transformer-based operators still face critical challenges when modeling PDEs on complex geometries: directly processing over massive mesh points is computationally expensive, while operating in raw discretization coordinates may obscure the intrinsic geometry where physical interactions are more naturally expressed. To address these limitations, we introduce the Charted Axial Transformer Operator (CATO), a geometry-adaptive and derivative-aware neural operator for PDEs on general geometries. Instead of applying attention directly in the physical coordinate system, CATO learns a continuous latent chart that maps mesh coordinates into a learned chart space, where chart-conditioned axial attention efficiently captures long-range dependencies with reduced computational cost. In addition, CATO introduces a derivative-aware physics loss for steady-state PDEs that jointly supervises solution values, mesh-consistent gradients, and an auxiliary flux-like field, improving physical fidelity and reducing oversmoothing. We further provide a theoretical approximation result showing that, under a favorable chart, charted axial attention can represent low-rank axial solution operators with controlled error, and that small chart perturbations induce bounded approximation degradation. CATO achieves the best performance across all evaluated datasets, yielding an average improvement of approximately 26.76% over the strongest competing baselines while reducing the number of parameters by 81.98%. These results highlight the effectiveness of learning geometry-adaptive charts and derivative-aware physical supervision for accurate and efficient PDE operator learning.

Spectral neural operators achieve strong performance for PDE learning, but rely on fixed global bases that limit their ability to represent spatially heterogeneous and multiscale dynamics. We propose Adaptive Basis Learning (ABLE), a framework that learns data-dependent spectral representations instead of relying on predefined bases. ABLE constructs a spatially adaptive Parseval frame via a learned ancillary density, enabling the operator to act in a lifted spectral space while preserving invertibility and maintaining $O(N\log N)$ complexity through FFT-based implementation. This shifts the source of expressivity from spectral coefficients to the representation itself, allowing the model to capture localized structures and non-translation-invariant interactions more efficiently. ABLE integrates seamlessly into existing neural operator architectures as a drop-in replacement for spectral layers. Across a range of benchmarks ABLE improves accuracy over strong baselines, with the largest gains in regimes characterized by sharp gradients and multiscale behavior. Moreover, augmenting existing models (e.g., U-FNO, HPM) with ABLE further enhances their performance, demonstrating its role as a general and complementary spectral refinement. Our results highlight that the data-driven choice of representation, rather than operator complexity alone, is a key bottleneck in neural operator design. By learning the basis itself, ABLE provides a principled and efficient framework for improving spectral methods in PDE learning.