RaNNDy is a randomized neural network architecture for the data-driven approximation of transfer operators associated with complex dynamical systems. The weights and biases of the hidden layers of the network are randomly initialized and kept fixed, only the output layer is trained. This has several advantages over fully optimized neural networks, notably a closed-form solution for the output layer and significantly lower training costs. Despite these advantages, RaNNDy is restricted to the initial selection of weights and biases that parametrize the basis functions required for the operator approximation. Since the basis functions are determined by the activation function, choosing an appropriate activation function for the hidden layers is crucial. In this work, we propose an algorithm that optimizes the activation function itself, while keeping the weights and biases in the randomized neural network fixed, providing a more suitable dictionary. We illustrate the efficacy of the approach using various benchmark problems, including stochastic differential equations and random walks on graphons.
Finite-width fully connected neural networks with Gaussian-initialized weights deviate from their infinite-width Gaussian limit, exhibiting non-vanishing higher-order cumulants. We approximate these deviations, for a neural network evaluated in a finite number of inputs, using multidimensional Edgeworth expansions of arbitrary order 4m−1, with m∈N. Assuming that the corresponding Gaussian limit has an invertible covariance matrix and that the activation function is polynomially bounded, we establish a bound of order n−m on the total variation distance between the law of the true network output and its Edgeworth approximation, with matching lower bounds. As an application, we quantify the error in Bayesian posterior distributions when the prior is replaced by its Edgeworth expansion. Our results are more general and also apply to sequences of conditionally Gaussian vectors converging to a Gaussian vector with invertible covariance.
We introduce an abstract neural flow framework for neural networks and neural operators. The framework contains two continuous-depth models, namely neural flows with composition and separation structures, and covers both finite-dimensional function approximation and infinite-dimensional operator approximation. We prove well-posedness and universal approximation properties for the corresponding neural flows, including, to the best of our knowledge, the first universal approximation result for flow-based models between infinite-dimensional spaces. We also obtain universal approximation results for convolutional neural flow models. Through suitable time discretizations, the composition structure recovers ResNet-type architectures, while the separation structure, via a splitting-based discretization, yields plain architectures. This gives a unified flow-based route to both residual and plain architectures for neural networks and neural operators with fully connected or convolutional linear layers.
Universal approximation theorems provide a mathematical explanation for the expressive power of neural networks. They assert that, under mild conditions on the activation function, feedforward neural networks are dense in broad function classes, such as continuous functions on compact subsets of Rd, Lp spaces, or Sobolev spaces. Over the past four decades, these qualitative universality results have evolved into a rich quantitative theory addressing approximation rates, parameter efficiency, and the role of architectural features such as depth and width. This survey presents several glimpses into this theory. We review classical density results for single-hidden-layer networks, as well as quantitative bounds that relate approximation error to network size and smoothness assumptions on target functions. Particular emphasis is placed on depth--width trade-offs and on results demonstrating that deeper architectures can achieve superior parameter efficiency for structured function classes. In addition to standard feedforward neural networks, we also review recent developments on Kolmogorov--Arnold Networks (KANs), which offer an alternative architectural paradigm and whose approximation-theoretic properties have begun to attract significant theoretical attention.
Infinite-dimensional orthonormal basis expansions play a central role in representing and computing with function spaces due to their favorable linear algebraic properties. However, common bases such as Fourier or wavelets are fixed and do not adapt to the structure of a given problem or dataset. In this paper, we aim to represent these bases with neural networks and optimize them. Our key idea is that any target infinite-dimensional orthonormal basis can be viewed either as a point on the Lie manifold of the orthogonal group, or equivalently, as the endpoint of a continuous path on that manifold that connects a reference basis, e.g. Fourier, to that target. Paths on the Lie manifold satisfy ordinary differential equations (ODEs) governed by skew-adjoint integral operators. Using neural networks to define finite-rank generators of such ODEs allows us to parameterize and optimize orthonormal bases in function space. While relying on finite-rank generators to model infinite operators might seem restrictive, we prove a universality result: even with a rank-2 generator, the integrated solutions of the ODE are dense in the orthogonal group under the appropriate operator topology. In other words, for any target orthonormal basis, there exists a path originating from a reference basis and driven by finite-rank generators that gets arbitrarily close to that target basis. We demonstrate the flexibility of our framework by transforming the Fourier basis into the principal components of a functional dataset, eigenfunctions of linear operators, or dynamic modes of energy-preserving physical simulations.
Hamidreza Kamkari, Mohammad Sina Nabizadeh, Justin Solomon
This paper studies approximation by shallow ReLUs networks, σs(t)=max{0,t}s, together with their generalization behavior under ℓ1 path-norm control. For the Lp-type integral spaces Fp,τd,s, 1≤p≤2, spherical harmonic analysis yields approximation bounds for shallow networks. In particular, when τd is the uniform measure and 1≤p<2, the approximation rate is O(m−2dpp(2s+2d+1)−2d) for 1≤p≤p∗ and O(m−4dpp(4s+3d−1)−2d+2) for p∗<p<2, where p∗=d+32d+2. Approximation bounds for Sobolev spaces Wα,p, 1≤p<2, are obtained through embeddings into spectral Barron spaces. For nonparametric regression with sub-Gaussian noise, path-norm-regularized shallow ReLUs networks achieve minimax-optimal rates O(n−2d+2s+1d+2s+1logn) over Bs and O(n−2α+d2αlogn) over Wα,∞, with matching lower bounds up to logarithmic factors.
While the approximation properties of single-layer Transformer architectures have been studied in recent works, a rigorous theoretical understanding of the multi-layer setting remains limited. In this work, we establish that multi-layer Transformers possess fundamentally different approximation capabilities from single-layer ones: for certain retrieval tasks, any single-layer Transformer requires least Ω(ε−k) parameters to achieve precision ε, where k grows linearly with sequence length T, whereas a two-layer Transformer with a single head per layer achieves the same approximation precision with at most O(ε−1) parameters. To understand this separation, we identify two structural mechanisms underlying multi-layer approximation. Specifically, softmax attention can only efficiently retrieve the token attaining the maximum attention score, incurring exponential-in-length parameter cost for k-th largest retrieval with k≥2. Moreover, the parameter cost of decoding coupled information scales with the size of the retrieved token set. Motivated by these findings, we propose InfoFlow, a framework for multi-layer Transformers. The framework tracks an information set of accessible input positions at each token and layer, assigning an explicit approximation rate to each mode of information propagation. This abstraction recovers known approximation bounds, remains consistent with experimental observations on trained networks, and yields concrete predictions in settings where direct theoretical analysis is currently intractable. Our results provide a principled framework for reasoning about the approximation efficiency of multi-layer Transformers.
Neural operators have emerged as a powerful, discretization-invariant framework for solving partial differential equations (PDEs). Although established approaches like the Deep Operator Network (DeepONet) have successfully achieved universal approximation for operators, and architectures such as Fourier Neural Operators (FNOs) have shown algebraic convergence rates, a precise theoretical connection between the continuous theory and its discrete numerical implementation remains a challenge. Specifically, the relationship between the continuous formulation and the discrete numerical stability has yet to be fully explored. In this paper, we address this gap by establishing theoretical guarantees for the discretization error and stability of neural operator approximation schemes. We prove analytical bounds that link solution regularity to input discretization, providing a formal quantification of neural operator accuracy under real-world numerical constraints. We derive these bounds to the specific cases of State Space Model-based Neural Operators (SS-NOs) and FNOs, thus providing a new discretization error theorem for these models. Additionally, through an input-to-state stability (ISS) analysis, we formally assess the impact of discretization on the stability of SS-NOs results obtained in the continuous domain. Our empirical experiments on 1D and 2D benchmarks validate our theoretical bounds and show the robustness of SS-NOs under varying resolutions.
Abderrahim Bendahi, Adrien Fradin, Johan Peralez +2
Establishing Universal Approximation Theorems (UATs) for nonlinear operators and their derivatives is a foundational open problem in Operator Learning (OL) and raises delicate questions in Nonlinear Functional Analysis. We prove the first UATs for k-times differentiable nonlinear operators and their derivatives via OL architectures, uniformly on compact sets and in weighted Bastiani--Sobolev spaces for general finite input measures. In full Banach-space generality, these are the first complete generalizations of the corresponding influential classical UATs in [Hornik, 1991] to infinite-dimensional spaces and OL, {and launch Derivative-Informed Operator Learning (DIOL) (i.e. learning nonlinear operators and their derivatives)} on general Banach spaces. Based on our UATs, we formulate Bastiani--Sobolev training in DIOL. We present open frontiers where DIOL and our UATs find applications: high-order accuracy in OL; fast constrained optimization in Banach spaces (e.g. optimal control of PDEs, inverse problems) via Learn-Then-Optimize; numerical methods for infinite-dimensional PDEs (e.g. HJB PDEs on Banach spaces from infinite-dimensional optimal control via Optimize-Then-Learn, such as optimal control of PDEs, SPDEs, path-dependent systems, partially observed systems, mean-field control). We parameterize nonlinear operators via Encoder-Decoder Architectures, classical OL architectures. These include DeepONets, Deep-H-ONets, and PCA-Nets, which our UATs cover. Our UATs are based on (i) Approximation Properties of Banach spaces; (ii) continuous Bastiani differentiability (weaker than continuous Fréchet differentiability); (iii) CBk (Bastiani) compact-open topologies; indeed, UA in Ck (Fréchet) compact-open topologies (induced by operator norms) fails; (iv) construction of weighted Bastiani--Sobolev spaces, generalizing classical Gaussian Sobolev spaces on Banach spaces.
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.
We introduce a technique that enables Neural-ODEs to approximate arbitrary velocity fields with a priori planted fixed-points. Specifically, a recipe is given to explicitly accommodate for a finite collection of points in the reference multi-dimensional space of the Neural-ODE where the velocity field is exactly equal to zero. In this way, the gradient-based training is rigorously constrained inside the prescribed hypothesis class while leaving the expressive power of the Neural-ODE unaltered. We rigorously prove the universality of the Neural-ODE under any local constraints in the velocity field and give a computationally convenient way of imposing the fixed points. Our method is then tested on two paradigmatic physical models.
Feliciano Giuseppe Pacifico, Duccio Fanelli, Lorenzo Buffoni +3
The core challenge in unsupervised anomaly detection is identifying abnormal patterns without prior knowledge of their characteristics. While existing methods have addressed aspects of this problem, they often struggle to learn a robust representation of the normal data distribution that is distinct from anomalous patterns. In this paper, we present a novel framework, Unified Unsupervised Anomaly Detection (U2AD), that comprehensively addresses anomaly detection in multivariate time series. Our approach learns the underlying data distribution of normal samples by utilizing score-based generative modeling. We introduce a novel time-dependent score network and a unified training objective that together delineate the manifold of normal data while considering both local and global temporal contexts. Reconstruction is then performed via a deterministic sampling process using an ordinary differential equation solver. Our extensive experimental evaluations demonstrate that U2AD not only outperforms current state-of-the-art methods in detection accuracy but also identifies anomalies at significantly earlier stages of their occurrence.
Prithul Sarker, Sushmita Sarker, Nicholas G. Murray +1
Although the Laplace approximation offers a simple route to uncertainty quantification in deep neural networks, its reliance on inverting large Hessian matrices has motivated a range of computationally feasible low-dimensional or sparse approximations. A prominent class of such methods - sub-network Laplace approximations, constructs surrogates by restricting attention to a small subset of parameters. Existing approaches in this family typically rely on diagonal, layer-wise, or other architectural heuristics for subset selection, which ignore cross-parameter interactions and lack formal optimality guarantees. In this paper, we provide a rigorous theoretical analysis of the sub-network Laplace paradigm. We prove that all sub-network Laplace methods systematically underestimate the predictive variance of the full Laplace posterior, and that this bias decreases monotonically as the retained sub-matrix expands. Leveraging this insight, we propose two principled, analytically grounded sub-network Hessian approximations: \textit{Gradient-Laplace} selects parameters with the largest average squared gradients of the model output with respect to the parameters over a reference dataset; while \textit{Greedy-Laplace} iteratively refines this selection by accounting for off-diagonal interactions in the precision matrix. We establish theoretical guarantees characterizing their optimality properties and show that Gradient-Laplace provably outperforms existing heuristic approaches. Extensive numerical studies across diverse settings indicate that these methods perform strongly relative to existing benchmarks.
Convex functionals are ubiquitous in applied analysis, appearing as value functions, risk measures, super-hedging prices, and loss functionals in machine learning. In many applications, however, the functional is only observed through finitely many exact pointwise evaluations. We ask whether a convex functional on a separable Hilbert space H can be reconstructed, up to arbitrary uniform accuracy, by an explicit formula which preserves convexity and Lipschitz regularity and is finitely computable. We answer this affirmatively. For every compact convex C⊆H, every L-Lipschitz convex functional ρ:C→R, and every ε>0, we construct an explicit finite-sample reconstruction which is convex, L-Lipschitz, and uniformly ε-accurate on C. The construction uses only finitely many linear measurements ⟨b,⋅⟩H, with b lying in a finite-dimensional subspace of H, and is exactly implementable by a ReLU-MLP. Building on this, we introduce convex neural functionals (CNFs), a structured trainable architecture class containing our reconstruction, whose every admissible parameter configuration is automatically convex and Lipschitz, providing a principled foundation for learning convex functionals from finite data.
Strichartz inequalities are a cornerstone of the modern theory of dispersive PDEs, but their extremizers are known explicitly only in a handful of sharp cases. The non-convexity of the underlying functional makes the problem hard, and to our knowledge no systematic numerical attack has been attempted. We propose a simple neural-network-based pipeline that searches for extremizers as critical points of the Strichartz ratio, and apply it in three settings. First, on the Schrödinger group we recover the Gaussian extremizers of Foschi and Hundertmark--Zharnitsky in dimensions d=1,2 to within 10−3 relative error, with no analytical prior. Second, on 59 further admissible pairs in d=1 where the answer is conjectural, the method consistently finds Gaussians, supporting the conjecture that Gaussians are the universal extremizers in the admissible range. Third, on the critical Airy--Strichartz inequality at γ=1/q, where existence is open, the optimization does not converge to any L2 profile: instead, the iterates organize themselves as mKdV breathers B(0,⋅;α,1,0,0) with growing internal frequency α, and the discovered ratio approaches the Frank--Sabin universal lower bound Aq,r from below with a power-law gap ∼α−0.9. We confirm the same picture with an independent Hermite-basis ansatz. We propose a precise conjecture: the supremum equals Aq,r and is approached, but not attained, along the breather family. The pipeline thus serves both as a validator on known cases and as a discovery tool when no extremizer exists.
This paper develops convolutional neural network (CNN) methods for simultaneous Sobolev approximation and elliptic boundary value problems on compact Riemannian manifolds. We prove approximation estimates for single- and multichannel CNNs, with rates governed by the intrinsic dimension and the smoothness gap. Motivated by elliptic stability, we propose a physics-informed CNN framework with a spectral boundary loss. The boundary residual is expanded in boundary Laplace--Beltrami eigenmodes and penalized by Sobolev trace weights, matching the natural H2s−1/2(∂Md) trace norm for 2s-order elliptic problems. This avoids smooth auxiliary constructions for exact boundary enforcement and singular Sobolev--Slobodeckij double integrals, while allowing FFT-based or precomputed spectral implementations. We also derive an error decomposition separating approximation, generalization, and spectral truncation errors, showing that the proposed loss is aligned with localized fast-rate generalization analysis. Numerical experiments on the upper hemisphere and upper half-torus demonstrate improved accuracy, convergence, and stability over standard PINNs, with one to two orders of magnitude gains for high-frequency boundary data.
The dual norm characterisation of weak solutions of second-order linear elliptic partial differential equations is mathematically natural but computationally intractable: evaluating the H−1 norm of the residual requires a supremum over an infinite-dimensional test space. We prove that the H−1 norm of any functional is equivalent to its expected squared evaluation against a random test function whose probability distribution depends only on the domain. Crucially, realisations of this random test function have negative Sobolev regularity for d≥2, yet this roughness is not an obstacle: averaging over the distribution exactly recovers the correct weak topology, independently of the differential operator, and no supremum evaluation is necessary. This equivalence introduces the notion of stochastically weak solutions, which coincide with classical weak solutions, and motivates stochastic variational physics-informed neural networks (SV-PINNs): neural networks trained by minimising an empirical approximation of the stochastic norm of the PDE residual. Although instantiated here with neural networks, the underlying principle is independent of the trial space and suggests a broader paradigm for numerical methods based on stochastic rather than deterministic test spaces. The framework extends naturally to higher-order elliptic, parabolic and hyperbolic equations and to abstract operator equations on Hilbert spaces. As a proof of concept, we present numerical experiments on eight challenging second-order linear elliptic problems spanning high-frequency and multi-scale solutions, indefinite operators, variable coefficients, and non-standard domains, in which SV-PINNs consistently and significantly outperform standard PINNs, recovering solutions to within one percent relative error in hundreds of L-BFGS steps.
We propose a neural parameterization of convex sets by learning sublinear (positively homogeneous and convex) functions. Our networks implicitly represent both the support and gauge functions of a convex body. We prove a universal approximation theorem for convex sets under this parametrization. Empirically, we demonstrate the method on shape optimization and inverse design tasks, achieving accurate reconstruction of target shapes.
Neural operators have emerged as a powerful tool for learning mappings between infinite-dimensional function spaces. However, their approximation properties in Sobolev norms remain poorly quantified, even though these norms control both function values and derivatives and are the natural metrics for PDE well-posedness, stability, and generalization. We develop a functional-analytic framework for operator learning in Sobolev spaces and connect it to the numerical behavior of Fourier Neural Operators (FNOs) on a prototypical PDE. First, for a continuous nonlinear operator G:Hs(D)→Ht(D′) with s>d/2 and inputs restricted to a compact subset of Hs(D), we prove that G can be uniformly approximated in Ht-norm by a neural operator with O(ε−d/s) trainable parameters. This yields an explicit complexity--error relation of the form ∥G−Gθ∥Ht≲CN−s/d. We then study the one-dimensional viscous Burgers solution operator G:u0↦u(⋅,1) on a bounded H1-ball and train FNOs with an H1-loss. Across a sweep of model sizes, we obtain test H1-errors down to O(10−7) and relative errors of order 10−3, with predictions accurately matching both solutions and spatial derivatives on held-out data. A log-log plot of Sobolev error versus parameter count exhibits an approximate power law ∥G−Gθ∥H1≈CN−α with empirical exponent α≈1.4, and long-horizon training reveals optimization instabilities in large FNOs, providing quantitative evidence that Sobolev-space approximation theory meaningfully predicts neural-operator scaling behavior.
We analyze the universal approximation property of Kolmogorov-Arnold Networks (KANs) in terms of their edge functions. If these functions are all affine, then universality clearly fails. How many non-affine functions are needed, in addition to affine ones, to ensure universality? We show that a single one suffices. More precisely, we prove that deep KANs in which all edge functions are either affine or equal to a fixed continuous function σ are dense in C(K) for every compact set K⊂Rn if and only if σ is non-affine. In contrast, for KANs with exactly two hidden layers, universality holds if and only if σ is nonpolynomial. We further show that the full class of affine functions is not required; it can be replaced by a finite set without affecting universality. In particular, in the nonpolynomial case, a fixed family of five affine functions suffices when the depth is arbitrary. More generally, for every continuous non-affine function σ, there exists a finite affine family Aσ such that deep KANs with edge functions in Aσ∪{σ} remain universal. We also prove that KANs with the spline-based edge parameterization introduced by Liu et al.~\cite{Liu2024} are universal approximators in the classical sense, even when the spline degree and knot sequence are fixed in advance.
We address the problem of searching for an unknown number of stationary targets at unknown positions with a mobile agent. A probability hypothesis density filter is used to estimate the expected number of targets under measurement uncertainty. Existing planners, such as Active Search (AS) and its Intermittent variant (ASI), achieve accurate detection but require costly online optimization. To reduce online computation, we propose to use a convolutional neural network to approximate AS or ASI decisions through direct inference. The network is trained on AS/ASI data using a multi-channel grid that encodes target beliefs, the agent position, visitation history, and boundary information. Simulations with uniform and clustered target distributions show that the network achieves detection rates comparable to AS or ASI while reducing computation by orders of magnitude.
Depth is widely viewed as a central contributor to the success of deep neural networks, whereas standard neural network approximation theory typically provides guarantees only for the final output and leaves the role of intermediate layers largely unclear. We address this gap by developing a quantitative framework in which depth admits a precise scale-dependent interpretation. Specifically, we design a single shared mixed-activation architecture of fixed width 2dN+d+2 and any prescribed finite depth such that each intermediate readout Φℓ is itself an approximant to the target function f. For f∈Lp([0,1]d) with p∈[1,∞), the approximation error of Φℓ is controlled by (2d+1) times the Lp modulus of continuity at the geometric scale N−ℓ for all ℓ. The estimate reduces to the geometric rate (2d+1)N−ℓ if f is 1-Lipschitz. Our network design is inspired by multigrade deep learning, where depth serves as a progressive refinement mechanism. For every prescribed terminal depth, the construction yields a finite nested family of prefix readouts whose earlier correction terms remain embedded in later readouts. Thus the approximation may be truncated within the prescribed depth range once the desired certified accuracy is reached.
Neural operators are widely used to approximate solution maps of complex physical systems. In many applications, however, the goal is not to recover the full solution trajectory, but to summarize the solution trajectory via a scalar target quantity (e.g., a functional such as time spent in a target range, time above a threshold, accumulated cost, or total energy). In this paper, we introduce DOPE (debiased neural operator): a semiparametric estimator for such target quantities of solution trajectories obtained from neural operators. DOPE is broadly applicable to settings with both partial and irregular observations and can be combined with arbitrary neural operator architectures. We make three main contributions. (1) We show that, in contrast to DOPE, naive plug-in estimation can suffer from first-order bias. (2) To address this, we derive a novel one-step, Neyman-orthogonal estimator that treats the neural operator as a high-dimensional nuisance mapping between function spaces, and removes the leading bias term. For this, DOPE uses a weighting mechanism that simultaneously accounts for irregular observation designs and for how sensitive the target quantity is to perturbations of the underlying trajectory. (3) To learn the weights, we extend automatic debiased machine learning to operator-valued nuisances via Riesz regression. We demonstrate the benefits of DOPE across various numerical experiments.
We prove error bounds for operator surrogates of solution operators for partial differential and boundary integral equations on families of domains which are diffeomorphic to one common reference (or latent) domain Dref. The pullback of the PDE to Dref via affine-parametric shape encoding produces a collection of holomorphic parametric PDEs on Dref. Sufficient conditions for (uniformly with respect to the parameter) well-posedness are given, implying existence, uniqueness and stability of parametric solution families on Dref. We illustrate the abstract hypotheses by reviewing recent holomorphy results for a suite of elliptic and parabolic PDEs. Quantified parametric holomorphy implies existence of finite-parametric, discrete approximations of the parametric solution families with convergence rates in terms of the number N of parameters. We obtain constructive proofs of existence of Neural and Spectral Operator surrogates for the shape-to-solution maps with error bounds and convergence rate guarantees uniform on the collection of admissible shapes. We admit principal-component shape encoders and frame decoders. Our results support in particular the (empirically reported) ability of neural operators to realize data-to-solution maps for elliptic and parabolic PDEs and BIEs that generalize across parametric families of shapes.
Uncertainty quantification for partial differential equations is traditionally grounded in discretization theory, where solution error is controlled via mesh/grid refinement. Physics-informed neural networks fundamentally depart from this paradigm: they approximate solutions by minimizing residual losses at collocation points, introducing new sources of error arising from optimization, sampling, representation, and overfitting. As a result, the generalization error in the solution space remains an open problem. Our main theoretical contribution establishes generalization bounds that connect residual control to solution-space error. We prove that when neural approximations lie in a compact subset of the solution space, vanishing residual error guarantees convergence to the true solution. We derive deterministic and probabilistic convergence results and provide certified generalization bounds translating residual, boundary, and initial errors into explicit solution error guarantees.
Amartya Mukherjee, Maxwell Fitzsimmons, David C. Del Rey Fernández +1
In a spiking neural network, is it enough for each neuron to spike at most once? In recent work, approximation bounds for spiking neural networks have been derived, quantifying how well they can fit target functions. However, these results are only valid for neurons that spike at most once, which is commonly thought to be a strong limitation. Here, we show that the opposite is true for a large class of spiking neuron models, including the commonly used leaky integrate-and-fire model with subtractive reset: for every approximation bound that is valid for a set of multi-spike neural networks, there is an equivalent set of single-spike neural networks with only linearly more (or less) neurons, in the maximum number of spikes, for which the bound holds. The same is true for the reverse direction too, showing that regarding their approximation capabilities in general machine learning tasks, single-spike and multi-spike neural networks are equivalent. Consequently, many approximation results in the literature for single-spike neural networks also hold for the multi-spike case.
Partial differential equation (PDE) models frequently contain unknown functional terms that cannot be measured directly, limiting their predictive utility. While data-driven methods for estimating scalar PDE parameters are well established, the recovery of unknown functions remains comparatively underexplored. Here, we show that standard parameter estimation workflows can be extended to infer functional components of PDEs directly from data. Our approach embeds neural networks within the PDE framework, allowing unknown functions to be learned during training with high accuracy. Using nonlocal aggregation-diffusion equations as a case study, we infer interaction kernels and external potentials from steady-state observations. We systematically examine how reconstruction accuracy depends on factors such as the number and diversity of available solutions, sampling density, and measurement noise. The resulting framework retains the advantages of conventional PDE calibration approaches while extending them to functional inference: once trained, the PDE model can be used in the standard way to analyse system behaviour and generate predictions.
Torkel E. Loman, Yurij Salmaniw, Antonio Leon Villares +2
Neural networks, particularly message-passing neural networks (MPNNs), are increasingly used as heuristics for hard combinatorial optimization problems. Yet many learning-based methods rely on supervision, reinforcement learning, or gradient estimators, causing high computational cost, unstable training, or limited guarantees. Classical approximation algorithms provide worst-case guarantees but are non-differentiable and cannot adapt to structure in natural input distributions. We study this tradeoff through Uniform Facility Location (UniFL), a problem with applications in clustering, summarization, logistics, and supply chains. We propose a fully differentiable MPNN that incorporates approximation-algorithmic principles without solver supervision or discrete relaxations. The model has provable approximation guarantees and empirically improves on standard approximation algorithms, narrowing the gap to integer linear programming.
Chendi Qian, Christopher Morris, Stefanie Jegelka +1
Deep neural networks have been widely used as universal approximators for functions with inherent physical structures, including permutation symmetry. In this paper, we construct symmetric deep neural networks to approximate symmetric Korobov functions and prove that both the convergence rate and the constant prefactor scale at most polynomially with respect to the ambient dimension. This represents a substantial improvement over prior approximation guarantees that suffer from the curse of dimensionality. Building on these approximation bounds, we further derive a generalization-error rate for learning symmetric Korobov functions whose leading factors likewise avoid the curse of dimensionality.
Regression with non-Euclidean responses---e.g., probability distributions, networks, symmetric positive-definite matrices, and compositions---has become increasingly important in modern applications. In this paper, we propose deep Fréchet neural networks (DFNNs), an end-to-end deep learning framework for predicting non-Euclidean responses---which are considered as random objects in a metric space---from Euclidean predictors. Our method utilizes the representation-learning power of deep neural networks (DNNs) to the task of approximating conditional Fréchet means of the response given the predictors, the metric-space analogue of conditional expectations, by minimizing a Fréchet risk. The framework is highly flexible, accommodating diverse metrics and high-dimensional predictors. We establish a universal approximation theorem for DFNNs, advancing the state-of-the-art of neural network approximation theory to general metric-space-valued responses, without making model assumptions or relying on local smoothing. We further establish rigorous generalization guarantees for DFNNs and derive corresponding risk bounds, providing, to the best of our knowledge, the first such theoretical results for deep learning regression with metric-space-valued responses. Empirical studies on synthetic distributional and network-valued responses, as well as real-world applications to predicting compositional responses in an Aitchison simplex and spherical responses, demonstrate that DFNNs consistently outperform all existing methods.
We establish two related but logically distinct results for shallow ReLUk neural networks on the unit sphere \SSd. First, for an arbitrary set of inner neural-network parameters, the best L2(\SSd) approximation of a fixed target function with smoothness r>2d+2k+1 admits an asymptotic lower bound given by a constant multiple of n−1/2hk+1/2, where h denotes the antipodal separation distance of the normalized inner-parameter set. This lower bound depends explicitly on the parameter configuration through h and applies without additional assumptions on the parameters. Second, for antipodally quasi-uniform parameters, h≃n−1/d, and the lower bound establishes the exact saturation order n−2dd+2k+1 for such parameter families: a target function with regularity greater than 2d+2k+1 and satisfying the required parity condition can be approximated at this rate, whereas approximation at any strictly faster rate forces the target function to be zero. Our results therefore place linearized neural-network approximation within the classical saturation framework and show that, although ReLUk network spaces can outperform finite elements of the same degree, this advantage is intrinsically limited.
We develop a new and general encode-approximate-reconstruct operator learning model that leverages learned neural representations of bases for input and output function distributions. We introduce the concepts of numerical operator learning and discretization independence, which clarify the relationship between theoretical formulations and practical realizations of operator learning models. Our model is discretization-independent, making it particularly effective for multiresolution learning. We establish theoretical approximation guarantees, demonstrating uniform universal approximation under strong assumptions on the input functions and statistical approximation under weaker conditions. To our knowledge, this is the first comprehensive study that investigates how discretization independence enables robust and efficient multiresolution operator learning. We validate our method through extensive numerical experiments involving both local and nonlocal PDEs, including time-independent and time-dependent problems. The results show that multiresolution training significantly improves accuracy and computational efficiency. Moreover, multiresolution training further enhances empirical discretization independence.
Motivated by the rapidly growing field of mathematics for operator approximation with neural networks, we present a novel universal operator approximation theorem for broad classes of encoder-decoder architectures and a wide range of input and output spaces. In this study, we focus on the approximation of continuous operators between infinite-dimensional normed or metric spaces in the topology of uniform convergence on compact sets. Unlike standard results in the operator learning literature, we additionally investigate the case where the approximating sequence of encoder-decoder architectures can be chosen independently of the compact sets. Taking a topological perspective, we point out that compact-set-independent approximation is a strictly stronger property in most relevant operator learning frameworks. To establish our results, we introduce new approximation properties of input and output spaces tailored to encoder-decoder architectures. These properties enable us to prove a universal operator approximation theorem ensuring uniform convergence on every compact subset of the input space. Our results unify and extend existing universal operator approximation theorems for various encoder-decoder architectures, including classical DeepONets, BasisONets, MIONets, architectures based on frames and other related approaches. A notable feature of our framework is that it also applies to metric spaces beyond the normed setting. In particular, it allows the consideration of p-Wasserstein spaces of probability measures as input or output spaces, and Skorohod spaces of càdlàg functions as input spaces. This generality also opens up potential applications in optimal transport.
This review examines neural operator architectures for learning solution operators of parametric partial differential equations (PDEs), with an emphasis on conceptual clarity and practical implementation. The work analyzes key models, including DeepONet, PCANet, and the Fourier Neural Operator, highlighting their underlying representations, computational structures, and comparative performance. These architectures are demonstrated on three canonical PDE problems: the Poisson equation, a linear elasticity problem, and a hyperelasticity problem. To make the presentation self-contained, key foundational topics are introduced, including finite-dimensional representations of function spaces, singular-value decomposition, and sampling from infinite-dimensional function spaces. Beyond forward modeling, the review discusses the use of neural operators as surrogate models within a Bayesian inverse-problem framework, including prior specification, forward-map approximation, and posterior computation. The performance of the three neural-operator architectures is evaluated on in-distribution samples, out-of-distribution samples, and Bayesian inference tasks. The review also discusses challenges related to prediction accuracy and generalization, outlining emerging strategies such as residual-based error correction and multi-level training. The review concludes by positioning neural operators within broader scientific-computing workflows and by identifying directions for reliable, scalable operator learning.
Neural operator (NO) architectures learn nonlinear maps between infinite-dimensional function spaces and are widely used to accelerate simulation and enable data-driven model discovery. While universality results ensure expressivity, they do not address \emph{complexity}: for broad operator classes described only through regularity (e.g.\ uniform continuity or Cr-regularity), information-theoretic lower bounds imply that minimax-optimal NO approximation rates scale \emph{exponentially} in the reciprocal accuracy 1/ε. This has shifted the focus of NO theory toward identifying additional problem-specific structure, beyond regularity, under which suitably tailored NO architectures can leverage to unlock polynomial scaling in 1/ε. We exhibit the first polynomial-scaling regime for NO approximations of solution operators in stochastic analysis; by identifying structured families of \emph{non-Markovian} BSDEs with randomized terminal condition parameterized by the Sobolev-regular terminal condition and by Sobolev-regular additive nonlinear perturbations of the generator. We prove that their solution operator can be approximated (uniformly over the family) by a tailored NO whose number of trainable parameters grows \emph{polynomially} in 1/ε. We unlock this polynomial scaling regime by \emph{informing the NO's inductive bias} by factoring out the singular part of the associated semilinear elliptic PDE Green's function and by incorporating the Doléans--Dade exponential of the BSDE's common non-Markovian factor into the NO's decoding layers. As a byproduct, we extend polynomial-scaling guarantees from families of linear elliptic PDEs on regular domains to the semilinear setting.
This paper explores the expressive power of deep neural networks for a diverse range of activation functions. An activation function set A is defined to encompass the majority of commonly used activation functions, such as ReLU, LeakyReLU, ReLU2, ELU, CELU, SELU, Softplus, GELU, SiLU, Swish, Mish, Sigmoid, Tanh, Arctan, Softsign, dSiLU, and SRS. We demonstrate that for any activation function ϱ∈A, a ReLU network of width N and depth L can be approximated to arbitrary precision by a ϱ-activated network of width 3N and depth 2L on any bounded set. This finding enables the extension of most approximation results achieved with ReLU networks to a wide variety of other activation functions, albeit with slightly increased constants. Significantly, we establish that the (width,depth) scaling factors can be further reduced from (3,2) to (1,1) if ϱ falls within a specific subset of A. This subset includes activation functions such as ELU, CELU, SELU, Softplus, GELU, SiLU, Swish, and Mish.
In this article, we introduce a deep learning based approximation algorithm for SPDEs. Our approach employs neural networks to approximate the solutions of SPDEs along given realizations of the driving noise process. If applied to a set of simulated noise trajectories, it yields empirical distributions of SPDE solutions, from which functionals like the mean and variance can be estimated. We test the performance of the method on stochastic heat equations with additive and multiplicative noise as well as stochastic Black-Scholes equations with multiplicative noise and Zakai equations from nonlinear filtering theory. In all cases, the proposed algorithm yields accurate results with short runtimes in up to 100 space dimensions.
Christian Beck, Sebastian Becker, Patrick Cheridito +2
We show that using autonomous-flow-based generation, one can universally approximate orientation-preserving diffeomorphisms defined on the cube by Neural ODEs with rate O(P−1/d) with P parameters. On the other hand, we show that by using only a single autonomous flow, the class of Neural ODEs is nowhere dense on the cube in dimension d≥2 . Under a compact-supportid condition on (0,1)d, we show that using autonomous-flow-based generation, one can universally approximate compactly supportedid diffeomorphisms on (0,1)d for any dimension with rate O((logPP)−2/d) with P parameters and for compactly supportedid homeomorphisms on (0,1)d in dimension d≥5 with rate O(P−1/(d+1)) with P parameters and by a composition of at most Id autonomous Neural ODEs with the same supportid, where Id depends only on the dimension. Moreover, we show that the class of single autonomous flows compactly supportedid on (0,1)d is meagre in the space of compactly supportedid homeomorphisms on (0,1)d for d≥2. By linearly lifting the domain into one higher dimension, we obtain a universal approximation result for Lipschitz functions compactly supported on (0,1)d with rate O(P−1/(d+1)) with P parameters.