PDE Operator Learning

Physics-informed neural networks (PINNs) approximate solutions of ODEs and PDEs by minimising a weighted combination of residual, boundary, initial, and data losses. Their performance is often dominated by the choice of loss weights: a poor weighting can drive training to a degenerate solution in which one physical constraint is satisfied while another is ignored. Existing methods select or adapt a single good set of weights. We take a different view: instead of tuning one weight vector, we explore the entire weight space during training. We introduce LC-PINN, which adapts the loss-conditional training of Dosovitskiy and Djolonga (2020) to the PDE-residual setting: the conditioning vector (either the loss weights or a scalar physical coefficient) is treated as a network input and sampled from a simple prior at every optimisation step. This turns PINN training into learning a continuous family of solutions indexed by that vector, with no solver-generated paired data. LC-PINN thus lies between classical PINNs and operator learning: it stays fully physics-informed but amortises training over a parametric family. Our contribution is not the loss-conditional construction itself, but its extension to PINNs, the unification of the loss-weight and parametric-coefficient regimes under one architecture (concatenation for loss weights, FiLM for coefficients), and a fixed-quadrature L-BFGS finishing protocol that makes the parametric-coefficient regime trainable. We give a lambda-invariance result for the conditional optimum and study LC-PINN on parametric Helmholtz, Schrodinger, viscous Burgers, and Buckley-Leverett equations. A single LC-PINN matches or improves retrained per-weight PINN baselines while parameterising the full family in one model, at a total cost that amortises favourably against per-instance retraining.

Neural operators learn mappings between infinite-dimensional function spaces and provide a data-driven surrogate modeling paradigm for parametric partial differential equations (PDEs). Existing architectures typically obtain expressivity by parameterizing integral kernels in prescribed transform domains or by applying attention-like interactions over discretized spatial points. While these approaches have achieved substantial progress, they often face a persistent trade-off among physical interpretability, nonlocal spatial communication, mesh scalability, and computational cost. We propose a Light-inspired neural operator(LiNO), an operator-learning architecture whose latent evolution is decomposed into three mechanisms motivated by elementary light transport: reflection, refraction, and scattering. Reflection and refraction act as adaptive pointwise transformations in latent feature space, enabling local feature reorientation and anisotropic modulation, whereas scattering performs input-dependent nonlocal propagation over the physical domain. We first formulate scattering as a normalized pairwise kernel with relative positional bias, and then develop an efficient scattering variant that replaces explicit pairwise interactions with positive-feature global propagation and a local diffusion branch, reducing the dominant spatial complexity from quadratic to linear. This yields a structured neural operator that separates local feature modulation from global spatial communication while retaining a modular and interpretable latent evolution.

Deep learning surrogates for 3D Partial Differential Equations (PDEs) often fail to generalize across geometric transformations because they depend heavily on specific coordinate systems. While equivariant networks offer a solution, they typically rely on local operations in the spatial domain, making the global receptive field, which is essential for PDE dynamics, computationally expensive. Conversely, Fourier Neural Operators (FNOs) efficiently capture global interactions, yet establishing 3D equivariance within them remains impractical due to the prohibitive cost of spectral group convolutions. To bridge this gap, we introduce EqGINO, a geometrically robust framework that enforces isotropy in the spectral domain. By design, EqGINO guarantees exact equivariance to the discrete symmetries inherent to the discretized computational domain. Beyond this discrete guarantee, our structural prior enables effective generalization to arbitrary continuous orientations even with a limited number of SE(3)-transformed training samples. Consequently, our method robustly models coordinate-invariant physical laws on complex irregular 3D geometries. Our code is available at https://github.com/sung-won-kim/EqGINO

Existing evaluations of neural operators and in-context operator learning rely primarily on prediction error, but accurate output prediction does not guarantee the correct local dynamical structure. A model may match solutions while exhibiting incorrect sensitivities, distorted frequency response, spurious mode coupling, or unstable tangent behavior. We introduce a Jacobian-based spectral audit for in-context operator learning. For a fixed prompt, we differentiate the network output with respect to the query function and view the resulting Jacobian as a learned tangent operator. Projecting it onto Fourier modes, we obtain a local spectral characterization of the inferred operator, including frequency-dependent gains, phase structure, and cross-mode coupling. The audit complements standard prediction metrics by testing whether the model reproduces local mechanisms of the underlying PDE operator rather than only outputs. Across benchmarks, the audit reveals distinct operator-level phenomena, including phase transport, viscosity-dependent damping, nonlinear mode coupling, and reaction--diffusion stability structure. It also detects failures partially hidden by prediction-error metrics, including high-frequency degradation, incorrect phase recovery, and prompt--operator inconsistencies. Corrupted or internally inconsistent prompts lead to degraded tangent-operator structure even when pointwise predictions remain partially accurate. Our results suggest that prediction accuracy and local operator fidelity are distinct properties of learned neural operators. Our framework also provides a diagnostic for stability, sensitivity, and operator consistency.

Learning mappings between infinite-dimensional function spaces, or operator learning, is essential for many machine learning applications. Although transformer-based operators are popular, they often rely on token-wise attention. These methods treat continuous fields as discrete tokens and usually ignore the global functional structure. We introduce \emph{Functional Attention}, which reinterprets attention as a functional correspondence between adaptive bases. Inspired by geometric functional maps, our method replaces softmax affinities with structured linear operators. This yields a compact, generalizable, resolution-invariant representation that explicitly captures global dependencies. Experiments demonstrate that \emph{Functional Attention} can match state-of-the-art performance in many operator learning tasks, including solving PDEs, 3D segmentation, and regression, while remaining robust to varying discretizations. Project page is available at https://github.com/xjffff/FUNCATTN.

We introduce the Laplace-Fourier Neural Operator (LFNO), a unified framework for modeling dynamical systems across transient and steady-state regimes by integrating the spectral advantages of Laplace and Fourier Neural Operators. LFNO employs a dual-branch architecture that explicitly decomposes system dynamics into transient and steady-state components. We evaluate LFNO on nine benchmarks, including three ODE systems (Duffing, Lorenz, and Pendulum) and six PDE systems (Euler-Bernoulli beam, Heat, Reaction-diffusion, Brusselator, Burgers, and Navier-Stokes). LFNO significantly outperforms existing operators on ODE systems, where transient dynamics dominate, and consistently surpasses LNO while achieving performance competitive with FNO on PDE benchmarks. Furthermore, LFNO offers improved stability and physical interpretability through its component-wise decomposition. These results demonstrate that LFNO provides a robust and unified approach for learning complex dynamical systems across multiple temporal scales.

Learned physics simulators are often evaluated by one-step or short-horizon prediction error, but these metrics can miss failures in temporal composition and long-horizon rollout. For autonomous, state-complete systems, exact solution maps satisfy a semigroup law: direct evolution over $s+t$ should agree with evolution over $s$ followed by $t$. We propose normalized semigroup error as a post hoc, model-agnostic diagnostic comparing these direct and composed learned predictions. On one-dimensional heat and Burgers dynamics with time-conditioned ConvNet and FNO baselines, semigroup error is positively associated with rollout degradation, with trajectory-level Spearman correlation $ρ= 0.635$ and $95$ CI $[0.621, 0.649]$. Semigroup regularization has mixed effects, supporting semigroup consistency primarily as an evaluation diagnostic rather than a universally beneficial training objective.

Neural PDE solvers have followed the scaling trajectory of vision and language, with recent foundation models reaching billions of parameters. We argue that scale is a poor substitute for architectural inductive bias in this domain: structured priors deliver outsized parameter efficiency, and the pattern of where they succeed and fail is itself informative about what they capture. We instantiate this argument in WaveLiT, an architecture combining a discrete wavelet transform for lossless multi-resolution tokenization, an augmented linear attention block, a shared-weight multiscale feature pyramid, and a wavelet-domain auxiliary loss. Bespoke 1-10M-parameter WaveLiT models compete with foundation models of 100-1000$\times$ their size across eight TheWell benchmarks, with the largest gains on wave and acoustic-dominated benchmarks where the wavelet-multiscale prior fits the dominant dynamical structure and small per-step errors do not compound geometrically under rollout. Trained jointly across all eight benchmarks, a 10M-parameter foundation variant exhibits a structured, physically interpretable transfer pattern -- strongest where the wavelet-multiscale prior matches the dynamics, weakest on chaotic advection-dominated flows. The entire pipeline trains on a single GPU. The results suggest that small-model PDE performance is shaped by architectural inductive bias rather than scale, and that the structure of a prior's failures is a useful empirical signal about its content.

Neural operators learn mappings from function-dependent inputs to solutions, providing an effective framework for solving partial differential equations (PDEs). For time-dependent PDEs, existing methods typically perform long-horizon prediction through autoregressive rollout directly in high-dimensional physical field spaces, where each predicted state is recursively fed back as the input for the next step. Although effective for short-term prediction, this autoregressive rollout and the lack of continuous-time modeling lead to progressive error accumulation over long-horizon rollouts. In this work, we propose Autoregression-Free Neural Operators (AFNO), which map the time evolution of PDEs into a latent space and model continuous-time vector fields within it. AFNO uses flow matching to learn the latent vector field, thereby enabling continuous evolution over extended horizons, avoiding autoregressive rollout and capturing dynamics under varying parameter configurations through explicit conditioning on physical parameters. Theoretical analysis and extensive experiments on six PDEs demonstrate that AFNO improves long-horizon prediction stability and consistently reduces rollout errors compared with the baselines.

We introduce a novel neural operator architecture designed to approximate solutions of linear elliptic partial differential equations with high-contrast, spatially varying coefficients. The network, termed the Iterated V-shaped Net (IV-Net), realizes a mapping from the input coefficients and righthand side to the corresponding solution field. The architecture of IV-Net is informed by, and closely resembles, a V-cycle multigrid solver. The IV-Net model is parameterized via convolutional layers defined in the physical domain. For coercive problems with highly heterogeneous coefficients, the proposed network exhibits superior performance relative to a proper orthogonal decomposition (POD) approach and several existing neural operator architectures. For low-frequency oscillatory Helmholtz problems with smooth coefficients, its performance is similar to that of a Fourier neural operator. We analyze the approximation error and convergence behavior of IV-Net, its data efficiency, and its dependence on the underlying discretization mesh. Furthermore, we demonstrate the practical effectiveness of the architecture through a series of numerical experiments, including applications to uncertainty quantification, inverse problems, and prediction of quantities of interest.

Reconstructing flow fields from sparse measurements is a fundamental problem in fluid mechanics with broad implications for modeling, control, and design. In this work, we propose a novel operator learning framework that leverages the architecture of language models to perform flow reconstruction in a mesh-free manner. We reformulate flow field reconstruction as a sequence-to-sequence learning task, where sparse measurements are treated as context and unobserved locations as queries. Our model learns to reconstruct the full flow field from sparse inputs, effectively capturing spatial correlations and long-range dependencies. We evaluate the proposed approach on four benchmark datasets: (1) two-dimensional vortex street simulations, (2) daily average temperature data across the contiguous United States, (3) three-dimensional blood flow simulations based on dissipative particle dynamics, and (4) three-dimensional turbulent jet flow measurements obtained via particle tracking velocimetry. Across all cases, our method demonstrates competitive reconstruction accuracy, even with highly incomplete data (less than 10% observed), and achieves efficient performance. The results highlight the potential of language models as robust and scalable tools for scientific data reconstruction, and suggest a promising direction toward the development of foundation models for scientific and engineering applications.

Neural operators have achieved significant success in modern scientific computing due to their flexibility and strong generalization capabilities. Existing models, however, primarily rely on first-order kernel integral approximations, which severely limit their expressivity. To address this, we propose the Infinite-order Kernel Neural Operator (IKNO), which constructs neural operators via infinite-order kernel integrals and admits an elegant closed-form finite approximation. We develop two complementary infinite-order neural operator constructions: IKNO-Vanilla, which applies the full-kernel resolvent on the product grid via Kronecker eigendecomposition, and IKNO-TP, an alternative tensor-product operator that composes per-axis resolvents. Furthermore, we develop fast computation schemes for both variants of IKNO, which achieve outstanding global information aggregation while maintaining high computational efficiency. Empirically, we evaluate our IKNO on both time-dependent and time-independent benchmarks with arbitrary input shapes, including large-scale industrial datasets. Extensive experiments demonstrate that the IKNO method consistently achieves the SOTA accuracy with significant improvements on nearly all benchmark datasets while maintaining scalability to very large point clouds.

Neural operators have achieved strong performance in learning solution operators of partial differential equations (PDEs), but their inherently continuous representations struggle to capture discontinuities and sharp transitions. Existing approaches typically approximate such features within continuous function spaces, often requiring increased model capacity and high-resolution data. In this work, we propose Cut-DeepONet, a two-stage training framework that explicitly models discontinuities while reducing learning complexity. Our approach reformulates the problem via a lifting strategy, partitioning the domain into smooth subregions while representing discontinuities as boundaries in a higher-dimensional space. This separation aligns the operator learning task with the inductive bias of neural networks and avoids directly approximating discontinuities. An additional network predicts input-dependent discontinuity locations for unseen inputs, which are then used to guide the neural operator in generating smooth components within each region. Experiments on benchmark PDEs show that Cut-DeepONet outperforms state-of-the-art methods, even when trained on low-resolution datasets. The method excels on problems with discontinuities and sharp transitions, while using fewer trainable parameters. Our results highlight the benefits of changing the representation of operator learning rather than increasing model complexity.

Neural operators are often tested on states that differ physically from training data. A distinct failure occurs when the physical dynamics are unchanged but the observed coordinate frame differs from training. PACE-FNO addresses this case by estimating the frame, predicting after pulling the field to a canonical representative, and restoring the requested terminal frame. The default inference path uses one forward prediction; optional test-time adaptation (TTA) updates only the low-dimensional coordinate. On translated and Galilean-shifted Burgers and shallow-water systems, PACE-FNO lowers out-of-distribution (OOD) relative error by up to $12\times$ relative to a data-augmented Fourier Neural Operator (FNO+Aug). A matched-estimator control supports attributing the gain to prediction in the canonical frame rather than added estimator capacity. Our analysis separates the canonical approximation error from the two alignment residuals. We also test regional WeatherBench2 time-series forecasting with the fifth-generation ECMWF reanalysis (ERA5) under natural time OOD, where PACE-FNO and FNO achieve nearly identical performance. Experiments with approximate rotation, other backbones, irregular domains, rollouts, and image data delineate the conditions under which the mechanism is effective.

The modeling and simulation of infinite-dimensional Hamiltonian systems are central problems in mathematical physics and engineering, however they pose significant computational and structural challenges for standard data-driven architectures. In this work, we introduce the Symplectic Neural Operator, a neural operator architecture designed to preserve the symplectic structure intrinsic to Hamiltonian PDEs. We provide a theoretical characterization of their symplecticity and establish a rigorous long-term stability result based on the combination of symplectic structure preservation and learning accuracy. Numerical experiments on canonical Hamiltonian PDEs corroborate this theoretical result and show that SNOs exhibit improved energy behavior compared with non-structure-preserving neural operators.

Pre-training neural operators on diverse partial differential equation (PDE) datasets has emerged as a promising direction for building general-purpose surrogate models in scientific machine learning. However, the inherent complexity and structural diversity of PDE solution operators make multi-PDE pre-training fundamentally challenging. Existing methods mainly address this by increasing model capacity, while leaving the target solution operators unchanged. Inspired by classical numerical analysis, we instead propose to transform complex and diverse solution operators into simpler, better-aligned forms that are easier to model jointly. Since the optimal transformation varies across PDE types, it must be adaptive and input-dependent, allowing a single neural operator to approximate an entire family of operators. We instantiate this idea as AOT-POT (adaptive operator-transformation for pre-training operator transformer), which expands hidden representations into multiple parallel streams, adaptively aggregates and redistributes them before and after each sub-layer, and mixes streams through Sinkhorn-projected doubly stochastic matrices for stable training. These mechanisms together reshape diverse solution operators into a unified form that can be effectively modeled by a single architecture. Empirically, AOT-POT achieves state-of-the-art performance on 12 PDE benchmarks with only 3% additional parameters, reducing relative L2 error by up to 77.6% (40.9% on average). Fine-tuning AOT-POT further reduces L2 error by up to 92% on in-domain PDEs and 89% on out-of-domain PDEs (unseen types during pre-training), demonstrating that adaptive operator transformation is an effective and complementary direction for advancing PDE foundation models beyond simply scaling model capacity.

Scaling Scientific Machine Learning (SciML) toward universal foundation models is bottlenecked by negative transfer: the simultaneous co-training of disparate partial differential equation (PDE) regimes can induce gradient conflict, unstable optimization, and plasticity loss in dense neural operators. In particular, broadband open-channel fluid dynamics and boundary-dominated porous media flows impose incompatible spectral and geometric demands on a single dense parameter path. We introduce Shodh-MoE, a sparse-activated latent transformer architecture for multi-physics transport. Shodh-MoE operates on compressed 16^3 physical latents produced by a physics-informed autoencoder with an intra-tokenizer Helmholtz-style velocity parameterization, restricting decoded states to divergence-free velocity manifolds. The model guarantees exact mass conservation, achieving a physically verifiable velocity divergence of ~2.8 x 10^-10 (evaluated post-hoc in FP64) on 128^3 grids. A Top-1 soft-semantic router dynamically assigns localized latent patches to expert subnetworks, enabling specialized parameter paths for distinct physical mechanisms while preserving shared experts for universal symmetries. In a 20,000-step distributed pretraining run over mixed three-dimensional physical tensors, routing telemetry shows autonomous domain bifurcation: held-out validation tokens from the open-channel domain route exclusively to Expert 0, while porous-media tokens route exclusively to Expert 1. The model converges simultaneously across both regimes, achieving latent validation MSEs of 2.46 x 10^-5 and 9.76 x 10^-6, and decoded physical MSEs of 2.48 x 10^-6 and 1.76 x 10^-6. These results support sparse expert routing as a practical architectural mechanism for mitigating multi-physics interference in universal neural operators.

In this paper, we study solution operators of physical field equations on geometric meshes from a function-space perspective. We reveal that Hodge orthogonality fundamentally resolves spectral interference by isolating unlearnable topological degrees of freedom from learnable geometric dynamics, enabling an additive approximation confined to structure-preserving subspaces. Building on Hodge theory and operator splitting, we derive a principled operator-level decomposition. The result is a Hybrid Eulerian-Lagrangian architecture with an algebraic-level inductive bias we call Hodge Spectral Duality (HSD). In our framework, we use discrete differential forms to capture topology-dominated components and an orthogonal auxiliary ambient space to represent complex local dynamics. Our method achieves superior accuracy and efficiency on geometric graphs with enhanced fidelity to physical invariants. Our code is available at https://github.com/ContinuumCoder/Hodge-Spectral-Duality

Neural operators learn to map initial conditions to the terminal solution of partial differential equations (PDEs), providing a surrogate for the full operator mapping. This enables rapid prediction across different input configurations. While recent neural operator architectures have demonstrated strong performance on diverse PDE tasks, their behavior under structured distribution shifts remains insufficiently understood. To investigate this, we study operator learning in a wave propagation setting governed by a one-dimensional variable-coefficient wave equation, using two representative architectures, the Fourier Neural Operator (FNO) and the Deep Operator Network (DeepONet). To examine their generalization under distribution shifts, we consider structured out-of-distribution (OOD) settings that independently vary input frequency and coefficient smoothness. The results show that under smoothness shifts, both models maintain stable performance, with FNO achieving lower error. In contrast, under frequency shifts, FNO exhibits a sharp increase in error under unseen high-frequency inputs, whereas DeepONet shows milder degradation despite higher overall error. Our analysis reveals that these differences arise from how each architecture represents and responds to variations in frequency structure. Together, these findings highlight a fundamental gap between strong in-distribution performance and generalization under distribution shifts in operator learning, underscoring the role of architectural representation bias in developing more reliable neural operators for physics-based PDE simulations beyond the training distribution.

Neural operators have become an effective framework for learning mappings between function spaces, yet most existing architectures realize operators within a single representational domain, such as physical, spectral, or latent space. In this work, we introduce UFO (Domain-Unification-Free Operator), a cross-domain neural operator framework that realizes operators through adaptive, jointly conditioned interactions among representations defined on distinct domains. UFO enables discretization decoupling: the input function can be observed at resolutions or locations different from those used during training, while the solution can be queried at arbitrary output resolutions. Across four complementary benchmarks covering discontinuous inputs, irregular sampling with spectral mismatch, nonlinear dynamics, and stochastic high-frequency fields, UFO delivers accurate, robust, and physically coherent predictions under distribution shifts. These results establish cross-domain, phase-modulated realization as a powerful framework for discretization-decoupled neural operator learning.

Neural operators provide a framework for learning solution operators of partial differential equations (PDEs), enabling efficient surrogate modeling for complex systems. While universal approximation results are now well understood, approximation analysis specific to nonlinear reaction-diffusion systems remains limited. In this paper, we study neural operators applied to the solution mapping from initial conditions to time-dependent solutions of a generalized Gierer-Meinhardt reaction-diffusion system, a prototypical model of nonlinear pattern formation. Our main results establish explicit approximation error bounds in terms of network depth, width, and spectral rank by exploiting the Laplacian spectral representation of the Green's function underlying the PDE. We show that the required parameter complexity grows at most polynomially with respect to the target accuracy, demonstrating that Laplacian eigenfunction-based neural operator architectures alleviate the curse of parametric complexity encountered in generic operator learning. Numerical experiments on the Gierer-Meinhardt system support the theoretical findings.

Partial differential equations (PDEs) are central to modeling physical and engineering systems, but repeatedly solving parametric PDEs remains computationally expensive. Operator learning enables fast surrogate inference, yet typically requires large input-output paired datasets generated by costly high-fidelity PDE solvers. Unsupervised operator learning frameworks alleviate data dependency but remain hindered by computational bottlenecks. To address this, we propose Neural Variational Quantum Linear Solver (NVQLS), the first hybrid quantum-classical operator learning framework leveraging the Legendre--Galerkin weak formulation. We critically resolve the sign ambiguity in VQLS energy minimization, preventing erroneous solution representations. Additionally, we introduce a neural embedding, a novel encoding scheme to map varying forcings and PDE coefficients into parameterized quantum circuit representations. These structural innovations provide theoretical computational complexity advantages under efficient state preparation schemes, while achieving superior accuracy compared to a representative classical baseline. Validations on 1D and 2D parametric PDEs under diverse boundary conditions demonstrate NVQLS's capability to simultaneously process varying inputs, offering a scalable unsupervised approach to quantum-enhanced operator learning.

Partial differential equations (PDEs) govern diverse physical phenomena, yet high-fidelity numerical solutions are computationally expensive and Machine Learning approaches lack generalization. While Scientific Foundation Models (SFMs) aim to provide universal surrogates, typical encoding-decoding approaches suffer from high pretraining costs and limited interpretability. In this paper, we propose Compositional Neural Operators (CompNO) for 2D systems, a framework that decomposes complex PDEs into a library of Foundation Blocks. Each block is a specialized Neural Operator pretrained on elementary physics. This modular library contains convection, diffusion, and nonlinear convection blocks as well as a Poisson Solver, enabling the framework to address the pressure-velocity coupling. These experts are assembled via an Adaptation Block featuring an Aggregator. This aggregator learns nonlinear interactions by minimizing data loss and physics-based residuals driven from governing equations. The proposed approach has been evaluated on the Convection-Diffusion equation, the Burgers' equation, and the Incompressible Navier-Stokes equation. Our results demonstrate that learning from elementary operators significantly improves adaptability, enhances model interpretability and facilitates the reuse of pretrained blocks when adapting to new physical systems.

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.

Operator learning for partial differential equations (PDEs) aims to learn solution operators on infinite-dimensional function spaces from finite-resolution data. In this setting, it is important for the learned model to be discretization-invariant, or resolution-robust, and to reflect PDE-specific structure. It is therefore natural to ask how such structure should be encoded in the model architecture, hypothesis class, or learning procedure. In this paper, we study operator learning for solution operators of nonlinear parabolic PDEs based on Duhamel--Picard iteration. We formulate Picard iteration as an abstract state-transition model and present a theoretical framework for Picard-type operator learning. We derive implementation-agnostic generalization error bounds that separate the implementation error from the estimation error associated with the abstract state-transition model induced by Picard iteration. A key consequence is that increasing the Picard depth reduces the Picard truncation error without causing an unbounded growth of the entropy-based estimation error. We also extend the analysis to long-time prediction by rolling out the same learned local model over successive time blocks. Finally, we illustrate the theory for nonlinear heat equations on the torus using a Picard-type Fourier neural operator as a concrete implementation.

jNO (jax Neural Operators) is a JAX-native library for neural operators and foundation models with unified support for both data-driven and physics-informed training. Its core design is a tracing system in which domains, model calls, residuals, supervised losses, and diagnostics are written in one symbolic language and compiled into one optimization pipeline. This allows users to move between operator regression, mesh-aware residual evaluation, and PDE-constrained training without restructuring the surrounding code. jNO also supports multi-model compositions, fine-grained control at parameter level (model, optimizer, and learning rate), hyperparameter tuning, and JAX-native workflows for translated PDE foundation-model families. The source repository is available at https://github.com/FhG-IISB/jNO.

Long-horizon forecasting of time-dependent partial differential equations (PDEs) is critical for characterizing the sustained evolution of physical systems. While neural operators have emerged as efficient surrogates, they typically learn implicit finite-time transitions from discrete observations. When deployed autoregressively, such propagators often suffer from rapid error accumulation and dynamic drift. To address this, we propose a neural forecasting framework that reformulates PDE rollout as learning a Structured Spectral Propagator (SSP) in a propagation-oriented latent space. Following an analysis-propagation-synthesis design, our framework: (i) maps physical states into a shared, time-consistent spatial representation; (ii) projects this space into a compact propagation state to isolate recurrent dynamics from fine-grained spatial details, thereby decoupling reconstruction fidelity from rollout regularity; and (iii) evolves retained spectral modes using a frequency-conditioned linear backbone complemented by a nonlinear spectral closure to account for truncated interactions. This explicit structuring endows the propagator with a strong inductive bias for coherent modal evolution. Extensive experiments demonstrate that SSP significantly outperforms state-of-the-art baselines, reducing relative $L_2$ errors by up to 48.9% and exhibiting improved stability in temporal extrapolation beyond the supervised horizon.

Neural operators provide fast surrogate models for time-dependent partial differential equations, but their standard autoregressive use usually assumes that the instantaneous field $u(t,\cdot)$ is a complete state. This assumption fails for delay equations, distributed-memory systems, and other non-Markovian dynamics: two trajectories may agree at time $t$ and nevertheless have different futures because their histories differ. We introduce the History-Space Fourier Neural Operator (HS-FNO), a neural operator for delay and memory-driven PDEs formulated on the lifted state $u_t(θ,x)=u(t+θ,x)$, $θ\in[-τ,0]$. The key computational step is to decompose one history-state update into a learned predictor for the newly exposed future slice and an exact shift-append transport for the portion of the history window already known from the previous state. This avoids learning deterministic history coordinates, reduces the learned output dimension, and enforces the natural discrete history update. We test HS-FNO on five benchmark families covering delayed reaction--diffusion, spatial epidemiology, nonlocal neural-field dynamics, delayed waves, and distributed-memory closures. Across ten random seeds, HS-FNO attains the lowest aggregate one-step, history-space, and rollout errors among the principal baselines. The largest gain occurs in autoregressive prediction, where aggregate rollout error decreases from $0.241$, $0.188$, and $0.185$ for current-state, lag-stack, and unconstrained history-to-history operators, respectively, to $0.094$. The same model uses fewer parameters than unconstrained history prediction. These results indicate that enforcing the discrete shift structure of history-state evolution is an effective inductive bias for non-Markovian PDE surrogate modeling.

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.

Neural surrogate models for physical simulations are trained on discretized samples of continuous domains, where the induced empirical measure leads to uneven supervision, biasing optimization and causing spatial inconsistencies in physical fidelity. To mitigate this measure-induced bias, we propose M$^3$ (Multi-scale Morton Measure), a scalable framework that balances training measures by partitioning space according to physical variation and allocating supervision across multiple scales. Applied to three industrial-scale datasets with diverse discretizations, M$^3$ consistently improves predictions in the continuous physical domain, achieving up to 4.7$\times$ lower error in large-scale volumetric cases. These gains persist under aggressive subsampling (160M $\rightarrow$ 16M $\rightarrow$ 1.6M points), where M$^3$-trained models outperform those trained on higher-resolution data, reducing physics-weighted relative $L_2$ error by 3--4$\times$ and the corresponding MSE by up to 13$\times$. These results highlight data distribution as a key factor in operator learning and position M$^3$ as a scalable, data-efficient approach for physically consistent modeling. Code is available at https://github.com/PhysDataRefine/M3.