Daily Papers

Accurate skull-to-array registration is essential for transcranial focused ultrasound (tFUS) because CT-derived skull models must be aligned with the physical-array coordinate system to support patient-specific aberration correction. Current workflows typically use MRI and/or external tracking to establish this spatial relationship, adding imaging infrastructure and coordinate transformations to the treatment workflow. Here, we describe an MRI-free CT-to-ultrasound registration framework using a hybrid hemispherical CMUT tFUS array that combines a sparse therapeutic array with an integrated CMUT US-Cross imaging array. The therapeutic array provides pulse-echo measurements of skull location, while the US-Cross array provides local high-resolution images of the skull surface. The approach was evaluated using a CT-derived outer cortical skull surface across a 25-pose matrix with 10-mm lateral offsets between the skull and array centers and +/-5 degree angular perturbations. Five randomized radial-noise seeds were applied to therapeutic pulse-echo measurements to model measurement or element-placement errors, yielding 125 pose-seed realizations per noise and active-element setting. US-Cross imaging features were generated using Field II and delay-multiply-and-sum plane-wave compounding. Four registration modes were evaluated: Therapeutic only, US-imaging only, Sequential, and Fused registration. Fused registration yielded the best overall performance, with a median total displacement error of 0.271 mm [0.169-0.420] and a median rotation error of 0.904 degrees [0.432-1.639]. These results support an all-ultrasound-based approach using a hybrid CMUT tFUS array for MRI-free CT-US skull registration.

Chirality plays an important role in many optical phenomena, and it is crucial to have efficient and accurate numerical algorithms to simulate solutions in this setting. In this paper, we discuss a High-Order Spectral method coupled to geometric regular perturbation theory, which results in just such a method. We view the chirality of the laterally periodic, constant permittivity/permeability structure as deviating from a background value, and demonstrate analyticity of the field scattered by a plane electromagnetic wave with respect to this deformation. This analyticity is not only with respect to chirality deformations of arbitrarily large real size, but also joint in the spatial variables. We also show how the High--Order Perturbation of Envelopes (HOPE) recursions, which we used to establish these results, can be implemented as a rapid, robust, and reliable numerical algorithm.

We present a generative framework for inverse design of five-layer transmissive Huygens' metasurfaces (HMSs), addressing a longstanding challenge in achieving full-phase, high-efficiency unit cell designs with minimal full-wave simulations. The key to achieving this is our reliance on the field-based semianalytical (SA) scheme developed in Part I of this paper, which allows rapid and highly effective synthesis of such multilayer composites, however with limited accuracy. To overcome the prohibitive data demands of traditional pipelines, we employ Mamba, a selective state space model well suited for long-range sequence modeling as the backbone of our learning framework. A bidirectional Mamba (Bi-Mamba) forward surrogate is first trained on SA-generated data and subsequently fine-tuned with full-wave CST samples. An ablation over a 1080-sample CST pool shows that as few as 270 full-wave calibration samples suffice to reach near-CST-level agreement at a fraction of the simulation cost. An autoregressive Mamba inverse generator is subsequently trained on surrogate-augmented data, treating unit-cell synthesis as a sequential generation task. The resulting one-to-many generative model produces diverse unit cell geometries conditioned on target scattering responses. It achieves CST-validated designs with field transmission magnitude 0.9 across the full 0-2π phase range at 20 GHz. Moreover, a CST-calibrated surrogate trained to accurately predict frequency responses (18-22 GHz) enables functional post-selection of inverse generated designs. Together, the hybrid SA-generative methodology in this two-part compilation establishes a scalable and data-efficient solution for multilayer HMS synthesis, with natural extensions toward broadband, oblique-incidence, and higher-dimensional electromagnetic inverse-design problems.

Strategies for the generation of periodic discrete structures with identical two-point correlation are developed. Starting from a pair of root structures, which are not related by translation, phase inversion or axis reflections, child structures of arbitrary resolution (i.e., pixel or voxel numbers) and number of phases (i.e., material phases/species) can be generated by means of trivial embedding based phase extension, application of kernels and/or phase coalescence, such that the generated structures inherit the two-point-correlation equivalence. Proofs of the inheritance property are provided by means of the Discrete Fourier Transform theory. A Python 3 implementation of the results is offered by the authors through the Github repository https://github.com/DataAnalyticsEngineering/EQ2PC in order to make the provided results reproducible and useful for all interested readers. Examples for the generation of structures are demonstrated, together with applications in the homogenization theory of periodic media.

The spectral smoothness properties of the low-frequency array of the Square Kilometer Array (SKA), namely SKA-Low, are an important issue for its scientific objectives to be attainable. A large array of 256 log-periodic dipole antennas, installed on top of a 42~m circular ground plane, will work as an SKA-Low station in the frequency range 50-350 MHz. In this article, the ground plane induced effects are examined in terms of antenna beam spectral characteristics, while different antenna placements are considered. Results are produced both at isolated antenna and at array level in the band 50-100 MHz, by employing an approximate method for the speeding-up of array simulations. We attempt to distinguish the ground plane effect from that of mutual coupling among antennas, which appears to be more severe at specific frequencies, using 2 figures of merit. The Discrete Fourier Transform (DFT) components of gain pattern ratios identify the fundamental spatial components of the ripple, while the Envelope Correlation Coefficient quantifies the penalty to considering an infinite ground plane.

We present a high-order boundary integral equation (BIE) method for the frequency-domain acoustic scattering of a point source by a singly-periodic, infinite, corrugated boundary. We apply it to the accurate numerical study of acoustic radiation in the neighborhood of a sound-hard two-dimensional staircase modeled after the El Castillo pyramid. Such staircases support trapped waves which travel along the surface and decay exponentially away from it. We use the array scanning method (Floquet--Bloch transform) to recover the scattered field as an integral over the family of quasiperiodic solutions parameterized by their on-surface wavenumber. Each such BIE solution requires the quasiperiodic Green's function, which we evaluate using an efficient integral representation of lattice sum coefficients. We avoid the singularities and branch cuts present in the array scanning integral by complex contour deformation. For each frequency, this enables a solution accurate to around 10 digits in a couple of seconds. We propose a residue method to extract the limiting powers carried by trapped modes far from the source. Finally, by computing the trapped mode dispersion relation, we use a simple ray model to explain an observed acoustic "raindrop" effect (chirp-like time-domain response).

We address the challenge of sound propagation simulations in 3D virtual rooms with moving sources, which have applications in virtual/augmented reality, game audio, and spatial computing. Solutions to the wave equation can describe wave phenomena such as diffraction and interference. However, simulating them using conventional numerical discretization methods with hundreds of source and receiver positions is intractable, making stimulating a sound field with moving sources impractical. To overcome this limitation, we propose using deep operator networks to approximate linear wave-equation operators. This enables the rapid prediction of sound propagation in realistic 3D acoustic scenes with moving sources, achieving millisecond-scale computations. By learning a compact surrogate model, we avoid the offline calculation and storage of impulse responses for all relevant source/listener pairs. Our experiments, including various complex scene geometries, show good agreement with reference solutions, with root mean squared errors ranging from 0.02 Pa to 0.10 Pa. Notably, our method signifies a paradigm shift as no prior machine learning approach has achieved precise predictions of complete wave fields within realistic domains. We anticipate that our findings will drive further exploration of deep neural operator methods, advancing research in immersive user experiences within virtual environments.

Planar metasurfaces can profoundly control electromagnetic scattering. At microwave frequencies, such devices are typically implemented using multilayer cascades of patterned metallic sheets, whose design often requires time-consuming full-wave optimization. Here, we extend analytical models originally developed for sparse loaded-wire metagratings to accurately describe densely packed Jerusalem-cross meta-atoms embedded in standard printed circuit board (PCB) dielectric stacks. The model captures both near- and far-field coupling within and between layers, enabling efficient prediction of the dual-polarized response. Using this framework, we identify highly transmissive meta-atoms whose phase is controlled by the leg lengths of the Jerusalem crosses (microscopic design stage). This (phase)-(leg-length) "lookup table" allows rapid synthesis of Huygens' metasurfaces (macroscopic design stage), demonstrated through a full-wave-validated metalens exhibiting low-reflection beam manipulation. Notably, we implement a judicious scaling method to further extend the model to predict wideband meta-atom responses. In the companion paper (Part II), a hybrid machine-learning approach leverages this semianalytical framework to enhance accuracy without requiring the conventional exhaustive full-wave training, enabling ultrafast inverse design across the full parameter space. Overall, the presented methodology -- the standalone semianlytical scheme (Part I) and the machine-learning enhanced version (Part II) -- establishes an effective open-source toolkit for versatile, rapid, and highly accurate synthesis of fabrication-ready dual-polarized transmissive Huygens' meta-atoms and metasurfaces.

Radio-frequency (RF) data synthesis predicts the received signal given transmitter and receiver positions, and is essential for wireless applications. Recent 3D Gaussian Splatting (3DGS)-based methods achieve efficient synthesis at any transmitter but only for a fixed receiver. Therefore, supporting N receivers in one scene requires N independent models and precludes prediction at unseen receivers. We present RxGS, which achieves receiver-generalizable synthesis within a single unified model. Our key insight is that scene geometry is receiver-independent while directional radiance is not: a first stage learns shared 3D Gaussian geometry, and a second stage freezes it and learns directional radiance conditioned on receiver position. A global conditioning branch captures shared receiver-dependent effects across the scene, while a local branch models per-scatterer variations from the receiver's geometry and occlusion. A multi-receiver CUDA rasterizer further batches rendering across all N receivers. Evaluated across various RF datasets, RxGS matches or improves over per-receiver baselines with a single shared model and generalizes to receivers unseen during training within the scene, cutting training cost by up to 45times, inference cost by 7.6times, and storage by Ntimes.

The cascade of 2D geometric transformations were exploited to model relations between entities in a knowledge graph (KG), leading to an effective KG embedding (KGE) model, CompoundE. Furthermore, the rotation in the 3D space was proposed as a new KGE model, Rotate3D, by leveraging its non-commutative property. Inspired by CompoundE and Rotate3D, we leverage 3D compound geometric transformations, including translation, rotation, scaling, reflection, and shear and propose a family of KGE models, named CompoundE3D, in this work. CompoundE3D allows multiple design variants to match rich underlying characteristics of a KG. Since each variant has its own advantages on a subset of relations, an ensemble of multiple variants can yield superior performance. The effectiveness and flexibility of CompoundE3D are experimentally verified on four popular link prediction datasets.

We require decomposition methods for the ABCD-matrix formulation in rotationally symmetric paraxial geometric optics when designing a multi-component optical system from a given single paraxial specification (represented by an ABCD matrix) to optimize non-paraxial specifications (e.g., optical aberrations). In this study, we propose two kinds of three-matrix decomposition of ABCD matrices by focusing on the fact that the ABCD matrices have three real-number degrees of freedom. In addition, we formulate a transformation between the two kinds of decomposition for a single matrix, which can increase or decrease the number of refraction surfaces in the optical configuration while keeping the paraxial specifications fixed. This nature is useful for the optical design of multi-component systems with optimized non-paraxial characteristics.

We study a kinematical consequence of the Hopf-algebraic momentum composition law in κ-Minkowski spacetime. The same curved momentum space can be described in different coordinates. In the bicrossproduct basis the ordered-plane-wave labels are the translation-generator eigenvalues, so the relevant map is one-to-one. In the classical basis, instead, the translation eigenvalues P_μ are nonlinearly related to the ordered-plane-wave labels p_μ. This relation can fail to be globally one-to-one in a high-momentum region. When a given classical-basis four-momentum admits more than one real auxiliary preimage, the branch-sensitive quantity P_+equiv P_0+P_4=κe^{p_0/κ} enters the coproduct and resolves the branches in two-particle states. Imposing the vanishing total-momentum constraint therefore gives branch-dependent κ-deformed back-to-back momentum correlations. In a single-branch regime this is just a deformed correlated product, while in a multibranch regime a state specified only by P_μ can be expanded into distinct auxiliary branches. If P_μ are taken as the directly meaningful momenta, the physical content is the resulting deformed correlation pattern. If the auxiliary variables p_μ are assigned operational meaning, the same constrained state can be interpreted as a superposition over different auxiliary branches. We also compare this structure with standard regular self-adjoint nonrelativistic minimal-length models and find no analogous smooth local two-real-branch inversion on their physical domains.

The Reduced Basis Method can be exploited in an efficient way only if the so-called affine dependence assumption on the operator and right-hand side of the considered problem with respect to the parameters is satisfied. When it is not, the Empirical Interpolation Method is usually used to recover this assumption approximately. In both cases, the Reduced Basis Method requires to access and modify the assembly routines of the corresponding computational code, leading to an intrusive procedure. In this work, we derive variants of the EIM algorithm and explain how they can be used to turn the Reduced Basis Method into a nonintrusive procedure. We present examples of aeroacoustic problems solved by integral equations and show how our algorithms can benefit from the linear algebra tools available in the considered code.

Full-wave electromagnetic (EM) simulation enables accurate patch-antenna analysis but is computationally expensive for large-scale forward prediction and inverse design. We present a mesh-native, physics-augmented graph-learning framework that treats radiation-pattern prediction as signal reconstruction on an irregular surface mesh. For the forward problem, a GPS graph transformer is trained with Physics-Augmented Intermediate Supervision (PAIS), an auxiliary node-level objective that predicts complex surface currents, the physical intermediate linking geometry to radiation. PAIS improves multiple GNN backbones at no inference-time cost, while shuffled-current and non-physical controls show the gain comes from physical correspondence. Direction-conditioned decoding and a differentiable radiation-integral consistency loss further exploit this structure. On an 80,000-sample CST benchmark, GPS+PAIS reaches MSE 0.17 / PSNR 19.67, generalizes to a PCA split, and transfers zero-shot to canonical patches. For inverse design, surrogate-filtered diffusion beats nearest-neighbor retrieval by 32% relative MSE.

Correlative computational microscopy is accelerating the mapping of dynamic biological systems by integrating morphological and molecular measurements across spatial scales, from organelles to entire organisms. Visualization, measurement, and prediction of interactions among the components of biological systems can be accelerated by generalist computational imaging frameworks that relax the trade-offs imposed by multiplex dynamic imaging. This work reports a generalist framework for wave optical imaging of the architectural order (waveOrder) among biomolecules for encoding and decoding multiple specimen properties from a minimal set of acquired channels, with or without fluorescent labels. waveOrder expresses material properties in terms of elegant physically motivated basis vectors directly interpretable as phase, absorption, birefringence, diattenuation, and fluorophore density; and it expresses image data in terms of directly measurable Stokes parameters. We report a corresponding multi-channel reconstruction algorithm to recover specimen properties in multiple contrast modes. With this framework, we implement multiple 3D computational microscopy methods, including quantitative phase imaging, quantitative label-free imaging with phase and polarization, and fluorescence deconvolution imaging, across scales ranging from organelles to whole zebrafish. These advances are available via an extensible open-source computational imaging library, waveOrder, and a napari plugin, recOrder.

Machine learning based solvers have garnered much attention in physical simulation and scientific computing, with a prominent example, physics-informed neural networks (PINNs). However, PINNs often struggle to solve high-frequency and multi-scale PDEs, which can be due to spectral bias during neural network training. To address this problem, we resort to the Gaussian process (GP) framework. To flexibly capture the dominant frequencies, we model the power spectrum of the PDE solution with a student t mixture or Gaussian mixture. We apply the inverse Fourier transform to obtain the covariance function (by Wiener-Khinchin theorem). The covariance derived from the Gaussian mixture spectrum corresponds to the known spectral mixture kernel. Next, we estimate the mixture weights in the log domain, which we show is equivalent to placing a Jeffreys prior. It automatically induces sparsity, prunes excessive frequencies, and adjusts the remaining toward the ground truth. Third, to enable efficient and scalable computation on massive collocation points, which are critical to capture high frequencies, we place the collocation points on a grid, and multiply our covariance function at each input dimension. We use the GP conditional mean to predict the solution and its derivatives so as to fit the boundary condition and the equation itself. As a result, we can derive a Kronecker product structure in the covariance matrix. We use Kronecker product properties and multilinear algebra to promote computational efficiency and scalability, without low-rank approximations. We show the advantage of our method in systematic experiments. The code is released at https://github.com/xuangu-fang/Gaussian-Process-Slover-for-High-Freq-PDE.

Millimeter-wave (mmWave) radar pointcloud offers attractive potential for 3D sensing, thanks to its robustness in challenging conditions such as smoke and low illumination. However, existing methods failed to simultaneously address the three main challenges in mmWave radar pointcloud reconstruction: specular information lost, low angular resolution, and strong interference and noise. In this paper, we propose DREAM-PCD, a novel framework that combines signal processing and deep learning methods into three well-designed components to tackle all three challenges: Non-Coherent Accumulation for dense points, Synthetic Aperture Accumulation for improved angular resolution, and Real-Denoise Multiframe network for noise and interference removal. Moreover, the causal multiframe and "real-denoise" mechanisms in DREAM-PCD significantly enhance the generalization performance. We also introduce RadarEyes, the largest mmWave indoor dataset with over 1,000,000 frames, featuring a unique design incorporating two orthogonal single-chip radars, lidar, and camera, enriching dataset diversity and applications. Experimental results demonstrate that DREAM-PCD surpasses existing methods in reconstruction quality, and exhibits superior generalization and real-time capabilities, enabling high-quality real-time reconstruction of radar pointcloud under various parameters and scenarios. We believe that DREAM-PCD, along with the RadarEyes dataset, will significantly advance mmWave radar perception in future real-world applications.

We report an optical method of generating arbitrary polarization states by manipulating the thicknesses of a pair of uniaxial birefringent plates, the optical axes of which are set at a crossing angle of {\pi}/4. The method has the remarkable feature of being able to generate a distribution of arbitrary polarization states in a group of highly discrete spectra without spatially separating the individual spectral components. The target polarization-state distribution is obtained as an optimal solution through an exploration. Within a realistic exploration range, a sufficient number of near-optimal solutions are found. This property is also reproduced well by a concise model based on a distribution of exploration points on a Poincar\'e sphere, showing that the number of near-optimal solutions behaves according to a power law with respect to the number of spectral components of concern. As a typical example of an application, by applying this method to a set of phase-locked highly discrete spectra, we numerically demonstrate the continuous generation of a vector-like optical electric field waveform, the helicity of which is alternated within a single optical cycle in the time domain.

Holographic Metasurface Transceivers (HMTs) are emerging as cost-effective substitutes to large antenna arrays for beamforming in Millimeter and TeraHertz wave communication. However, to achieve desired channel gains through beamforming in HMT, phase-shifts of a large number of elements need to be appropriately set, which is challenging. Also, these optimal phase-shifts depend on the location of the receivers, which could be unknown. In this work, we develop a learning algorithm using a {\it fixed-budget multi-armed bandit framework} to beamform and maximize received signal strength at the receiver for far-field regions. Our algorithm, named \Algo exploits the parametric form of channel gains of the beams, which can be expressed in terms of two {\it phase-shifting parameters}. Even after parameterization, the problem is still challenging as phase-shifting parameters take continuous values. To overcome this, {\it\HB} works with the discrete values of phase-shifting parameters and exploits their unimodal relations with channel gains to learn the optimal values faster. We upper bound the probability of {\it\HB} incorrectly identifying the (discrete) optimal phase-shift parameters in terms of the number of pilots used in learning. We show that this probability decays exponentially with the number of pilot signals. We demonstrate that {\it\HB} outperforms state-of-the-art algorithms through extensive simulations.

Every Cartesian three-dimensional PDE solver hides a structural secret that production CFD codes have used for half a century and that graduate-level textbooks rarely state plainly. The derivative matrices, the compact Padé line solves, the Galerkin mass inversions, the alternating-direction-implicit substeps, and even the fast Poisson and Helmholtz diagonalization transforms all factor along the coordinate axes and collapse into repeated one-dimensional banded kernels executed along the grid lines. The three-dimensional operator exists only on paper; it is never assembled, factored, or stored. This paper is the manual for that collapse. We derive the Kronecker-product algebra that makes it exact, carry it cleanly through central differences, compact schemes, tensor-product Galerkin, B-spline and isogeometric methods, collocation, ADI time stepping, and direct Poisson and Helmholtz solves, and bring into the open the three production tricks that turn the reduction into hardware-conscious floating-point throughput on real machines: the multi-right-hand-side reshape that exposes a sweep as one batched line kernel (a dense BLAS-3 GEMM when the line factor is dense or element-local, a banded or stencil kernel when it is not), the sum factorization that rescues high-order Galerkin from the O(p^{2d}) quadrature trap, and the pencil decomposition that keeps every direction contiguous across an MPI cluster. For fixed stencil width or fixed polynomial degree, the compute cost stays O(N) in the total number of unknowns N = N_x N_y N_z; the operator storage drops to O(N_x + N_y + N_z) up to bandwidth constants; direct separable Poisson and Helmholtz solvers add the expected transform cost; the line kernels are embarrassingly parallel. These facts are familiar to practitioners but rarely assembled in one place; this paper collects them and shows how to use them.

Bound states in the continuum (BIC) metasurfaces are typically described by geometry-specific parameters, hindering cross-geometry comparison, while ultranarrow qBIC features are easily diluted in full-spectrum learning. Here, 2015 samples from seven dielectric metasurface families are mapped to a shared reciprocal-lattice grid, where two frozen low-order Fourier channels capture resonance shifts with mean within-branch R^2 values of 0.871-0.999. Field-level analysis of two representative branches further confirms that these shifts are consistent with the Maxwell-Fourier perturbation picture. A five-channel K-space backbone models the broadband spectrum, while a local complex K-space expert parameterizes the qBIC resonance through a differentiable Fano layer. The expert reduces resonance-position mean absolute error (MAE) from 3.2 to 0.95 nm and the resonance-depth error by 14-fold on a geometry-blocked test set. The same coordinate supports spectrum-to-structure reconstruction.

Intelligent surfaces represent a breakthrough technology capable of customizing the wireless channel cost-effectively. However, the existing works generally focus on planar wavefront, neglecting near-field spherical wavefront characteristics caused by large array aperture and high operation frequencies in the terahertz (THz). Additionally, the single-layer reconfigurable intelligent surface (RIS) lacks the signal processing ability to mitigate the computational complexity at the base station (BS). To address this issue, we introduce a novel stacked intelligent metasurfaces (SIM) comprised of an array of programmable metasurface layers. The SIM aims to substitute conventional digital baseband architecture to execute computing tasks with ultra-low processing delay, albeit with a reduced number of radio-frequency (RF) chains and low-resolution digital-to-analog converters. In this paper, we present a SIM-aided multiuser multiple-input single-output (MU-MISO) near-field system, where the SIM is integrated into the BS to perform beamfocusing in the wave domain and customize an end-to-end channel with minimized inter-user interference. Finally, the numerical results demonstrate that near-field communication achieves superior spatial gain over the far-field, and the SIM effectively suppresses inter-user interference as the wireless signals propagate through it.

Maxwell's equations, a system of linear partial differential equations (PDEs), describe the behavior of electric and magnetic fields in time and space and are essential for many important electromagnetic applications. Although numerical methods have been applied successfully in the past, the primary challenge in solving these equations arises from the frequency of electromagnetic fields, which depends on the shape and size of the objects to be resolved. Since the domain of influence for these equations is compactly supported, even a small perturbation in frequency necessitates a new discretization of Maxwell's equations, resulting in substantial computational costs. In this work, we investigate the potential of neural operators, particularly the Deep Operator Network (DeepONet) and its variants, as a surrogate model for Maxwell's equations. Existing DeepONet implementations are restricted to real-valued data in R^n, but since the time-harmonic Maxwell's equations yield solutions in the complex domain C^n, a specialized architecture is required to handle complex algebra. We propose a formulation of DeepONet for complex data, define the forward pass in the complex domain, and adopt a reparametrized version of DeepONet for more efficient training. We also propose a unified framework to combine a plurality of DeepONets, trained for multiple electromagnetic field components, to incorporate the boundary condition. We conduct computational experiments on a 3D metallic sphere without singularities and on a metallic almond-shaped target to demonstrate the effectiveness of the proposed method for problems involving singularity-prone solutions. As shown by computational experiments, our method significantly enhances the efficiency of predicting scattered fields from a spherical object at arbitrary high frequencies.

We present anyakrakusuma, an open-source Python library that solves the discrete static Schrödinger bridge problem, the entropically regularized counterpart of optimal transport, through a log-domain Sinkhorn--Knopp iteration and reconstructs the entropic interpolation between two empirical point clouds. The solver is paired with a diagnostic pipeline that characterizes the optimal coupling and the intermediate distributions through information-theoretic and geometric measures. We exercise the library on four idealized planar cases spanning a circle-to-circle dilation, a spiral-to-mixture fragmentation, a rigid reorientation of two moons, and a Lissajous-to-trefoil deformation. The log-domain formulation is necessary rather than merely convenient at the parameters studied, where the cost-to-regularization ratio reaches four hundred and the Gibbs kernel underflows double precision across most of its range; the iteration nonetheless attains a marginal residual of 10^{-9} and unit marginal fidelity in every case. Residual histories decay geometrically over approximately eight decades at per-iteration contraction factors between 0.966 and 0.976, which are local rates near the fixed point that lie many orders of magnitude below the worst-case Hilbert-metric bound. The covariance analysis recovers an imposed ninety-degree reorientation to within 0.07^circ, roughly forty times smaller than its uncertainty, across a masked interval of near-isotropy on which the principal axis is unobservable. The diagnostics are reported with explicit attention to the regimes in which each is well defined, including the differential entropy, which is meaningful only on the open interpolation interval. The presented cases are constructed rather than measured; quantitative application to empirical point clouds requires further study.

The upper 6 GHz (U6G) band with XL-MIMO is a key enabler for sixth-generation wireless systems, yet intelligent radiomap prediction for such systems remains challenging. Existing datasets support only small-scale arrays (up to 8x8) with predominantly isotropic antennas, far from the 1024-element directional arrays envisioned for 6G. Moreover, current methods encode array configurations as scalar parameters, forcing neural networks to extrapolate array-specific radiation patterns, which fails when predicting radiomaps for configurations absent from training data. To jointly address data scarcity and generalization limitations, this paper advances XL-MIMO radiomap prediction from three aspects. To overcome data limitations, we construct the first XL-MIMO radiomap dataset containing 78400 radiomaps across 800 urban scenes, five frequency bands (1.8-6.7 GHz), and nine array configurations up to 32x32 uniform planar arrays with directional elements. To enable systematic evaluation, we establish a comprehensive benchmark framework covering practical scenarios from coverage estimation without field measurements to generalization across unseen configurations and environments. To enable generalization to arbitrary beam configurations without retraining, we propose the beam map, a physics-informed spatial feature that analytically computes array-specific coverage patterns. By decoupling deterministic array radiation from data learned multipath propagation, beam maps shift generalization from neural network extrapolation to physics-based computation. Integrating beam maps into existing architectures reduces mean absolute error by up to 60.0% when generalizing to unseen configurations and up to 50.5% when transferring to unseen environments. The complete dataset and code are publicly available at https://lxj321.github.io/MulticonfigRadiomapDataset/.

Channel foundation models assume access to fully observed channels, an assumption that fails in deployment. We introduce PilotWiMAE, a self-supervised framework whose encoder ingests noisy pilot observations directly and whose attention factorizes along the axis separating temporal from joint space-frequency processing, an inductive bias inspired by the physics of the problem. Pilot input shrinks the observation space by up to two orders of magnitude and also removes the unrealistic assumption of full-CSI availability while incurring lower latency. The factorized design generates robust representations by exploiting the separable channel structure and allows a pretraining mask ratio of 99%. We pair patch-normalized reconstruction, which captures small-scale fading structure, with an auxiliary scale loss that recovers the large-scale fading features, and use an AWGN curriculum to match pilot noise at pretraining and deployment. Pretrained solely on 3.5\,GHz and evaluated at 28\,GHz across in-distribution and out-of-distribution settings, PilotWiMAE's cross-frequency beam selection and channel characterization beat supervised baselines despite operating on a smaller observation space. To weaken the coupling between decoder capacity and representation quality, we further propose a decoder-centric pretraining stage following the encoder-decoder joint pretraining, which allows PilotWiMAE to demonstrate competitive channel estimation without sacrificing representation quality. To foster further work in this direction, we release the PilotWiMAE pretrained weights and training pipeline, together with CSIGen, our Sionna-based ray-tracing channel-generation tool, and the channel datasets used in this work.

Harmonic retrieval techniques are the foundation of radio channel sounding, estimation and modeling. This paper introduces a Deep Learning approach for two-dimensional spectral estimation from frequency and time samples of a radio channel transfer function. Our work can estimate two-dimensional parameters from a signal containing an unknown number of paths. In contrast to existing deep learning-based methods, the signal parameters are not estimated via classification but instead in a quasi-grid-free manner. This alleviates the bias, spectral leakage, and ghost targets that grid-based approaches inherently produce. The proposed architecture also reliably estimates the number of spectral components in the measurement. Hence, the architecture jointly solves the model order selection problem and the parameter estimation task. Additionally, we propose a multi-channel windowing of the data during preprocessing, increasing the resulting estimator's robustness. We verify the performance compared to existing harmonic retrieval methods and also show how it can be integrated into an existing maximum likelihood estimator for efficient initialization of a gradient-based iteration.

The Helmholtz equation governs time-harmonic wave propagation, and in dissipative media a complex modulus renders its squared wavenumber κ^2 complex. Inferring such fields from sparse, noisy data calls for solvers that also quantify their own uncertainty. Physics-informed Gaussian-process (GP) regression supplies this by returning a posterior over the solution, yet operator-conditioned formulations have been developed almost exclusively for real-valued fields. We extend operator-informed GP regression to complex-valued Helmholtz problems by realifying the complex operator into an equivalent coupled real block, which enables inference with standard real-valued GP conditioning. The construction admits a family of priors, from a proper diagonal prior to coregionalized and multiscale variants, and conditions on PDE residuals and boundary traces. On benchmark problems in one to three dimensions, the solver is competitive with finite-difference and neural-network baselines at a far smaller interior-constraint budget. Unlike those deterministic baselines, it returns a posterior over the complex wavefield rather than a point estimate. Applied to in vivo brain magnetic resonance elastography, a proper multiscale prior reconstructs the shear curl field to a correlation of 0.77 with measurement, above a 0.75 target. The gain arises from the multiscale kernel rather than from real--imaginary coupling. We further identify a low-frequency accuracy ceiling set by model mismatch and a posterior uncertainty that is not yet calibrated. Calibrated uncertainty therefore emerges as the central next step for probabilistic wavefield inference in dissipative media.

The coexistence of heterogeneous cellular standards (2G-5G) in shared spectrum demands sophisticated RF source separation techniques, yet no public dataset exists for data-driven research on this problem. We present RFSS (RF Signal Source Separation), an open-source dataset of 100,000 multi-source RF signal samples generated with full 3GPP standards compliance. The dataset covers GSM (TS 45.004), UMTS (TS 25.211), LTE (TS 36.211), and 5G NR (TS 38.211), with 2-4 simultaneous sources per sample plus 4,000 single-source reference samples, at 30.72 MHz sample rate. Each sample passes through independent 3GPP TDL multipath fading channels and realistic hardware impairments: carrier frequency offset, I/Q imbalance, phase noise, DC offset, and PA nonlinearity (Rapp model). Two mixing modes are provided: co-channel (all sources at baseband) and adjacent-channel (each source frequency-shifted to its standard-specific carrier). The dataset totals 103 GB in HDF5 format with a 70/15/15 train/validation/test split. We benchmark five methods: FastICA, Frobenius-norm NMF, Conv-TasNet, DPRNN, and a CNN-LSTM baseline, evaluated using permutation-invariant SI-SINR (PI-SI-SINR). Conv-TasNet achieves -21.18 dB PI-SI-SINR on 2-source mixtures versus -34.91 dB for ICA, a 13.7 dB improvement. On co-channel mixtures, Conv-TasNet reaches -12.34 dB versus -28.04 dB for ICA and -16.19 dB for NMF. The dataset and evaluation code are publicly released at submission time.

One of the distinguishing aspects of CP2K is its seamless integration of diverse structural and transition-state optimization techniques with advanced sampling approaches including Monte Carlo, molecular dynamics, and metadynamics, enabling the efficient exploration of complex potential- and free-energy landscapes, including rare events. These capabilities are combined with a broad hierarchy of energy and force evaluation methods, ranging from classical and machine-learned interaction potentials and mixed quantum-classical multiscale and semiempirical schemes, to highly accurate quantum-mechanical electronic-structure approaches. At the heart of the latter lies the Gaussian and plane-wave framework, along with its augmented all-electron generalization, which have been described in detail in our previous code review [T. D. Kühne et al., J. Chem. Phys. 152, 194103 (2020)]. Building on this foundation, the present work revisits the methods within CP2K that turn electronic structure into dynamics, transport, and spectroscopic response. Particular emphasis is placed on the coupling between static response calculations and nuclear motion: spectra may be evaluated at optimized structures, averaged over thermally sampled configurations, obtained from time-correlation functions along ab-initio or path integral molecular trajectories, or followed in real time together with electronic and nuclear dynamics. The same modular structure also enables equilibrium and biased transport simulations, from Kubo-type linear response to open-boundary approaches under external potentials, highlighting CP2K's unique capability to unify quantum chemistry with quantum and statistical mechanics within a versatile, holistic simulation environment.

Artificial transmission lines built with lumped-element inductors and capacitors form the backbone of broadband, nearly quantum-limited traveling-wave parametric amplifiers (TWPAs). However, systematic design methods for TWPAs, and more generally artificial transmission lines, are lacking. Here, I develop a general synthesis framework for lossless artificial transmission lines by borrowing from periodic structure theory and passive network synthesis. These complementary approaches divide the design space: periodic loading synthesis employs spatial modulation of frequency-independent components, while filter synthesis employs frequency-dependent responses in spatially-uniform components. When tailoring transmission lines for parametric processes, nonlinear elements are added, typically nonlinear inductances in superconducting circuits, while ensuring energy and momentum conservation between interacting tones. Applying this framework, I design a kinetic inductance TWPA with a novel phase-matching architecture, and a backward-pumped Josephson TWPA exploiting an ambidextrous i.e., right-left-handed transmission line.

The lack of freely available standardized datasets represents an aggravating factor during the development and testing the performance of novel computational techniques in exposure assessment and dosimetry research. This hinders progress as researchers are required to generate numerical data (field, power and temperature distribution) anew using simulation software for each exposure scenario. Other than being time consuming, this approach is highly susceptible to errors that occur during the configuration of the electromagnetic model. To address this issue, in this paper, the limited available data on the incident power density and resultant maximum temperature rise on the skin surface considering various steady-state exposure scenarios at 10-90 GHz have been statistically modeled. The synthetic data have been sampled from the fitted statistical multivariate distribution with respect to predetermined dosimetric constraints. We thus present a comprehensive and open-source dataset compiled of the high-fidelity numerical data considering various exposures to a realistic source. Furthermore, different surrogate models for predicting maximum temperature rise on the skin surface were fitted based on the synthetic dataset. All surrogate models were tested on the originally available data where satisfactory predictive performance has been demonstrated. A simple technique of combining quadratic polynomial and tensor-product spline surrogates, each operating on its own cluster of data, has achieved the lowest mean absolute error of 0.058 {\deg}C. Therefore, overall experimental results indicate the validity of the proposed synthetic dataset.

We present a 380-520 GHz balanced superconductor-insulator-superconductor (SIS) mixer on a single silicon substrate. All radio-frequency (RF) circuit components are fabricated on a 9 μm thick membrane. The intermediate frequency (IF) is separately amplified and combined. The balanced mixer chip, using Nb/Al/Al_{2}O_{3}/Nb SIS junctions, is mounted in a tellurium copper waveguide block at 4.2 K using Au beam lead contacts. We find uncorrected minimum receiver double-sideband noise temperatures of 70 K and a noise suppression of up to 18 dB, measured within a 440-495 GHz RF and a 4-8 GHz IF bandwidth, representing state-of-the-art device performance.

In this article, we introduce a novel algorithm for efficient near-field synthetic aperture radar (SAR) imaging for irregular scanning geometries. With the emergence of fifth-generation (5G) millimeter-wave (mmWave) devices, near-field SAR imaging is no longer confined to laboratory environments. Recent advances in positioning technology have attracted significant interest for a diverse set of new applications in mmWave imaging. However, many use cases, such as automotive-mounted SAR imaging, unmanned aerial vehicle (UAV) imaging, and freehand imaging with smartphones, are constrained to irregular scanning geometries. Whereas traditional near-field SAR imaging systems and quick personnel security (QPS) scanners employ highly precise motion controllers to create ideal synthetic arrays, emerging applications, mentioned previously, inherently cannot achieve such ideal positioning. In addition, many Internet of Things (IoT) and 5G applications impose strict size and computational complexity limitations that must be considered for edge mmWave imaging technology. In this study, we propose a novel algorithm to leverage the advantages of non-cooperative SAR scanning patterns, small form-factor multiple-input multiple-output (MIMO) radars, and efficient monostatic planar image reconstruction algorithms. We propose a framework to mathematically decompose arbitrary and irregular sampling geometries and a joint solution to mitigate multistatic array imaging artifacts. The proposed algorithm is validated through simulations and an empirical study of arbitrary scanning scenarios. Our algorithm achieves high-resolution and high-efficiency near-field MIMO-SAR imaging, and is an elegant solution to computationally constrained irregularly sampled imaging problems.

Materials combining both a high refractive index and a wide band gap are of great interest for optoelectronic and sensor applications. However, these two properties are typically described by an inverse correlation with high refractive index appearing in small gap materials and vice-versa. Here, we conduct a first-principles high-throughput study on more than 4000 semiconductors (with a special focus on oxides). Our data confirm the general inverse trend between refractive index and band gap but interesting outliers are also identified. The data are then analyzed through a simple model involving two main descriptors: the average optical gap and the effective frequency. The former can be determined directly from the electronic structure of the compounds, but the latter cannot. This calls for further analysis in order to obtain a predictive model. Nonetheless, it turns out that the negative effect of a large band gap on the refractive index can counterbalanced in two ways: (i) by limiting the difference between the direct band gap and the average optical gap which can be realized by a narrow distribution in energy of the optical transitions and (ii) by increasing the effective frequency which can be achieved through either a high number of transitions from the top of the valence band to the bottom of the conduction or a high average probability for these transitions. Focusing on oxides, we use our data to investigate how the chemistry influences this inverse relationship and rationalize why certain classes of materials would perform better. Our findings can be used to search for new compounds in many optical applications both in the linear and non-linear regime (waveguides, optical modulators, laser, frequency converter, etc.).

Time series forecasting is crucial for various applications, such as weather forecasting, power load forecasting, and financial analysis. In recent studies, MLP-mixer models for time series forecasting have been shown as a promising alternative to transformer-based models. However, the performance of these models is still yet to reach its potential. In this paper, we propose Wavelet Patch Mixer (WPMixer), a novel MLP-based model, for long-term time series forecasting, which leverages the benefits of patching, multi-resolution wavelet decomposition, and mixing. Our model is based on three key components: (i) multi-resolution wavelet decomposition, (ii) patching and embedding, and (iii) MLP mixing. Multi-resolution wavelet decomposition efficiently extracts information in both the frequency and time domains. Patching allows the model to capture an extended history with a look-back window and enhances capturing local information while MLP mixing incorporates global information. Our model significantly outperforms state-of-the-art MLP-based and transformer-based models for long-term time series forecasting in a computationally efficient way, demonstrating its efficacy and potential for practical applications.

We consider a family of linear systems A_mu alpha=C with system matrix A_mu depending on a parameter mu and for simplicity parameter-independent right-hand side C. These linear systems typically result from the finite-dimensional approximation of a parameter-dependent boundary-value problem. We derive a procedure based on the Empirical Interpolation Method to obtain a separated representation of the system matrix in the form A_muapproxsum_{m}beta_m(mu)A_{mu_m} for some selected values of the parameter. Such a separated representation is in particular useful in the Reduced Basis Method. The procedure is called nonintrusive since it only requires to access the matrices A_{mu_m}. As such, it offers a crucial advantage over existing approaches that instead derive separated representations requiring to enter the code at the level of assembly. Numerical examples illustrate the performance of our new procedure on a simple one-dimensional boundary-value problem and on three-dimensional acoustic scattering problems solved by a boundary element method.

Incorporating prior information into inverse problems, e.g. via maximum-a-posteriori estimation, is an important technique for facilitating robust inverse problem solutions. In this paper, we devise two novel approaches for linear inverse problems that permit problem-specific statistical prior selections within the compound Gaussian (CG) class of distributions. The CG class subsumes many commonly used priors in signal and image reconstruction methods including those of sparsity-based approaches. The first method developed is an iterative algorithm, called generalized compound Gaussian least squares (G-CG-LS), that minimizes a regularized least squares objective function where the regularization enforces a CG prior. G-CG-LS is then unrolled, or unfolded, to furnish our second method, which is a novel deep regularized (DR) neural network, called DR-CG-Net, that learns the prior information. A detailed computational theory on convergence properties of G-CG-LS and thorough numerical experiments for DR-CG-Net are provided. Due to the comprehensive nature of the CG prior, these experiments show that DR-CG-Net outperforms competitive prior art methods in tomographic imaging and compressive sensing, especially in challenging low-training scenarios.

In this paper, we propose an alternating numerical scheme for constructing quasi-periodic solutions to a class of nonlinear partial differential equations (PDEs) with bounded perturbations, including the one-dimensional nonlinear Schrödinger (NLS) equations and nonlinear wave (NLW) equations under periodic and Dirichlet boundary conditions. A key observation concerning the resonant Q-equations allows us to establish directly a local diffeomorphism between the amplitudes and the drifted frequencies. This renders the proof considerably cleaner, since it avoids the Birkhoff normal form and the associated coordinate transformations required in classical KAM theory for PDEs.Unlike in the finite-dimensional setting, the lattice boxes must also include the spatial index, so that the multiscale induction has to be carried out in one additional dimension. This introduces two difficulties. First, the measure estimate for the excluded set of ``bad'' frequencies must account for the spatial index. For both the NLS and NLW equations, the linear frequencies and their differences are integers or close to integers; this allows the spatial dependence to be controlled through the modulus of the temporal index, so that the excluded measure remains under control. Second, a singular set may contain sites with the same temporal index but widely separated spatial indices, which obstructs the ``inversion implies localization'' process. For the one-dimensional NLS and NLW equations, however, such sites occur only in pairs with opposite spatial indices. They can therefore be separated by small boxes, after which the global inverse is obtained from the local inverses via the resolvent identity. Numerical experiments illustrate the scheme for nonlinear traveling and standing waves, exhibiting both the computed quasi-periodic solutions and the convergence of the iteration.

Periodic signals play an important role in daily lives. Although conventional sequential models have shown remarkable success in various fields, they still come short in modeling periodicity; they either collapse, diverge or ignore details. In this paper, we introduce a novel framework inspired by Fourier series to generate periodic signals. We first decompose the given signals into multiple sines and cosines and then conditionally generate periodic signals with the output components. We have shown our model efficacy on three tasks: reconstruction, imputation and conditional generation. Our model outperforms baselines in all tasks and shows more stable and refined results.

General full-wave electromagnetic solvers, such as those utilizing the finite-difference time-domain (FDTD) method, are computationally demanding for simulating practical GPR problems. We explore the performance of a near-real-time, forward modeling approach for GPR that is based on a machine learning (ML) architecture. To ease the process, we have developed a framework that is capable of generating these ML-based forward solvers automatically. The framework uses an innovative training method that combines a predictive dimensionality reduction technique and a large data set of modeled GPR responses from our FDTD simulation software, gprMax. The forward solver is parameterized for a specific GPR application, but the framework can be extended in a straightforward manner to different electromagnetic problems.

Medical imaging is limited by acquisition time and scanning equipment. CT and MR volumes, reconstructed with thicker slices, are anisotropic with high in-plane resolution and low through-plane resolution. We reveal an intriguing phenomenon that due to the mentioned nature of data, performing slice-wise interpolation from the axial view can yield greater benefits than performing super-resolution from other views. Based on this observation, we propose an Inter-Intra-slice Interpolation Network (I^3Net), which fully explores information from high in-plane resolution and compensates for low through-plane resolution. The through-plane branch supplements the limited information contained in low through-plane resolution from high in-plane resolution and enables continual and diverse feature learning. In-plane branch transforms features to the frequency domain and enforces an equal learning opportunity for all frequency bands in a global context learning paradigm. We further propose a cross-view block to take advantage of the information from all three views online. Extensive experiments on two public datasets demonstrate the effectiveness of I^3Net, and noticeably outperforms state-of-the-art super-resolution, video frame interpolation and slice interpolation methods by a large margin. We achieve 43.90dB in PSNR, with at least 1.14dB improvement under the upscale factor of times2 on MSD dataset with faster inference. Code is available at https://github.com/DeepMed-Lab-ECNU/Medical-Image-Reconstruction.

Elastic geophysical properties (such as P- and S-wave velocities) are of great importance to various subsurface applications like CO_2 sequestration and energy exploration (e.g., hydrogen and geothermal). Elastic full waveform inversion (FWI) is widely applied for characterizing reservoir properties. In this paper, we introduce mathbb{E^{FWI}}, a comprehensive benchmark dataset that is specifically designed for elastic FWI. mathbb{E^{FWI}} encompasses 8 distinct datasets that cover diverse subsurface geologic structures (flat, curve, faults, etc). The benchmark results produced by three different deep learning methods are provided. In contrast to our previously presented dataset (pressure recordings) for acoustic FWI (referred to as OpenFWI), the seismic dataset in mathbb{E^{FWI}} has both vertical and horizontal components. Moreover, the velocity maps in mathbb{E^{FWI}} incorporate both P- and S-wave velocities. While the multicomponent data and the added S-wave velocity make the data more realistic, more challenges are introduced regarding the convergence and computational cost of the inversion. We conduct comprehensive numerical experiments to explore the relationship between P-wave and S-wave velocities in seismic data. The relation between P- and S-wave velocities provides crucial insights into the subsurface properties such as lithology, porosity, fluid content, etc. We anticipate that mathbb{E^{FWI}} will facilitate future research on multiparameter inversions and stimulate endeavors in several critical research topics of carbon-zero and new energy exploration. All datasets, codes and relevant information can be accessed through our website at https://efwi-lanl.github.io/

Surrogate modeling of wave propagation and scattering (i.e. the wave speed and source to wave field map) in heterogeneous media has significant potential in applications such as seismic imaging and inversion. High-contrast settings, such as subsurface models with salt bodies, exhibit strong scattering and phase sensitivity that challenge existing neural operators. We propose a hybrid architecture that decomposes the scattering operator into two separate contributions: a smooth background propagation and a high-contrast scattering correction. The smooth component is learned with a Fourier Neural Operator (FNO), which produces globally coupled feature tokens encoding background wave propagation; these tokens are then passed to a vision transformer, where attention is used to model the high-contrast scattering correction dominated by strong, spatial interactions. Evaluated on high-frequency Helmholtz problems with strong contrasts, the hybrid model achieves substantially improved phase and amplitude accuracy compared to standalone FNOs or transformers, with favorable accuracy-parameter scaling.

This article focuses on estimating relative transfer functions (RTFs) for beamforming applications. Traditional methods often assume that spectra are uncorrelated, an assumption that is often violated in practical scenarios due to factors such as time-domain windowing or the non-stationary nature of signals, as observed in speech. To overcome these limitations, we propose an RTF estimation technique that leverages spectral and spatial correlations through subspace analysis. Additionally, we derive Cram\'er--Rao bounds (CRBs) for the RTF estimation task, providing theoretical insights into the achievable estimation accuracy. These bounds reveal that channel estimation can be performed more accurately if the noise or the target signal exhibits spectral correlations. Experiments with both real and synthetic data show that our technique outperforms the narrowband maximum-likelihood estimator, known as covariance whitening (CW), when the target exhibits spectral correlations. Although the proposed algorithm generally achieves accuracy close to the theoretical bound, there is potential for further improvement, especially in scenarios with highly spectrally correlated noise. While channel estimation has various applications, we demonstrate the method using a minimum variance distortionless (MVDR) beamformer for multichannel speech enhancement. A free Python implementation is also provided.

The large and chemically diverse GMTKN55 benchmark was used as a training set for parametrizing composite wave function thermochemistry protocols akin to G4(MP2)XK theory (Chan et al, JCTC 2019, 15, 4478-4484). Even after reparametrization, the GMTKN55 WTMAD2 (weighted mean absolute deviation, type 2) for G4(MP2)-XK is actually inferior to that of the best rung-4 DFT functional, wB97M-V. By increasing the basis set for the MP2 part to def2-QZVPPD, we were able to substantially improve performance at modest cost (if an RI-MP2 approximation is made), with WTMAD2 for this G4(MP2)-XK-D method now comparable to the better rung-5 functionals (albeit at greater cost). A three-tier approach with a scaled MP3/def2-TZVPP intermediate step, however, leads to a G4(MP3)-D method that is markedly superior to even the best double hybrids wB97M(2) and revDSD-PBEP86-D4. Evaluating the CCSD(T) component with a triple-zeta, rather than split-valence, basis set yields only a modest further improvement that is incommensurate with the drastic increase in computational cost. G4(MP3)-D and G4(MP2)- XK-D have about 40% better WTMAD2, at similar or lower computational cost, than their counterparts G4 and G4(MP2), respectively: detailed comparison reveals that the difference lies in larger molecules due to basis set incompleteness error. An E2/ {T,Q} extrapolation and a CCSD(T)/def2-TZVP step provided the G4-T method of high accuracy and with just three fitted parameters. Using KS orbitals in MP2 leads to the G4(MP3|KS)-D method, which entirely eliminates the CCSD(T) step and has no steps costlier than scaled MP3; this shows a path forward to further improvements in double-hybrid density functional methods. G4-T-DLPNO, a variant in which post-MP2 corrections are evaluated at the DLPNO- CCSD(T) level, achieves nearly the accuracy of G4-T but is applicable to much larger systems.

Stacking heterogeneous vision backbones (CNNs, ViTs, and hybrids) is the de facto recipe for accuracy, calibration, and robustness, yet two coupled pathologies limit its returns. Prediction-space multicollinearity ill-conditions the meta-learner's Gram matrix, inflating weight variance and producing brittle solutions on a thin manifold. Calibration collapse compounds constituent miscalibration through naive linear stacking, so adding more models can hurt expected calibration error (ECE). Existing remedies, ridge regularization, greedy selection, model soups, and SWAG address at most one of these issues, and none jointly target conditioning and calibration in heterogeneous prediction pools. We introduce CORE-STACK+, a preconditioning pipeline with four components: (i) a kernelized redundancy filter that removes non-linear inter-model dependencies invisible to Pearson correlation, using Centered Kernel Alignment (CKA) [23]; (ii) a <15K-parameter differentiable meta-feature gate that learns per-sample attention over ensemble statistics; (iii) a spectrum-adaptive Ridge penalty lambda^{star}=lmax(Chat)/SNR(Chat) derived from a Marchenko-Pastur signal-noise decomposition, eliminating nested cross-validation; and (iv) a Laplace-approximate Bayesian blender replacing inverse-RMSE heuristics. We prove a PAC-Bayes excess-risk bound that, for the first time, jointly accounts for prediction-space redundancy and meta-learner capacity. Across six benchmarks, CORE-STACK+ delivers +1.8% top-1 on ImageNet-1K, -4.2 mCE on ImageNet-C, +0.9 mIoU on ADE20K, and +1.3 AP on COCO, while reducing retained models by 35-57% and inference FLOPs by up to 41%. ECE improves 2.1times over deep ensembles without post hoc temperature scaling.

With their non-Abelian topological charges, real multi-bandgap systems challenge the conventional topological phase classifications. As the minimal sector of multi-bandgap systems, real triple degeneracies (RTPs), which serve as real 'Weyl points', lay the foundation for the research on real topological phases. However, experimental demonstration of physical systems with global band configurations consisting of multiple RTPs in crystals has not been reported. Here we present experimental evidence of RTPs in photonic meta-crystals, characterizing them using the Euler number, and establishing their connection with both Abelian and non-Abelian charges. By considering RTPs as the basic elements, we further propose the concept of a topological compound, akin to a chemical compound, where we find that certain phases are not topologically allowed. The topological classification of RTPs in crystals demonstrated in our work plays a similar role as the 'no-go' theorem in Weyl systems.

In recent years, the neural radiance field (NeRF) model has gained popularity due to its ability to recover complex 3D scenes. Following its success, many approaches proposed different NeRF representations in order to further improve both runtime and performance. One such example is Triplane, in which NeRF is represented using three 2D feature planes. This enables easily using existing 2D neural networks in this framework, e.g., to generate the three planes. Despite its advantage, the triplane representation lagged behind in its 3D recovery quality compared to NeRF solutions. In this work, we propose TriNeRFLet, a 2D wavelet-based multiscale triplane representation for NeRF, which closes the 3D recovery performance gap and is competitive with current state-of-the-art methods. Building upon the triplane framework, we also propose a novel super-resolution (SR) technique that combines a diffusion model with TriNeRFLet for improving NeRF resolution.

Enantiomers share atoms, bonds, and pairwise distances yet can behave differently in chiral environments, so molecular encoders must respect atom relabelings and proper rotations without becoming blind to reflection. We introduce GSF-χ, a graph transformer in which stereogenic units modulate all pairwise interactions rather than single out one atom as special. Each central or axial stereogenic unit creates a reflection-even phase field over all atoms, a handedness pseudoscalar χ sets the direction of a relative rotation on latent query--key blocks, giving a Chiral-RoPE that reflection inverts rather than leaves fixed. A C_2 projection separates mirror-even ECD peak counts and positions from mirror-odd peak signs. We prove the operator's even--odd decomposition and its annotation-inversion, permutation, and unit-order identities under explicit canonical-role conditions; property tests and a coordinate-reflection audit verify the laws end to end. GSF-χ leads every central-ECD output and improves axial Rotation and Symbol by 12.6% and 7.9% over the strongest baseline. Equal-budget controls attribute the Rotation advantage to global signed support rather than parameter or edge count; the C_2 projection yields exact enantiomer-pair consistency at a small raw-accuracy cost under complete supervision and becomes predictive when mirror supervision is scarce.

Data inconsistency leads to a slow training process when deep neural networks are used for the inverse design of photonic devices, an issue that arises from the fundamental property of non-uniqueness in all inverse scattering problems. Here we show that by combining forward modeling and inverse design in a tandem architecture, one can overcome this fundamental issue, allowing deep neural networks to be effectively trained by data sets that contain non-unique electromagnetic scattering instances. This paves the way for using deep neural networks to design complex photonic structures that requires large training sets.

We audit frequency and decoder-depth claims for AdvWave-P, an additive audio jailbreak, on Qwen2-Audio. The protocol masks frequency components of the perturbation in the short-time Fourier transform (STFT) domain and measures attack success and audio-span representations. On 520 AdvBench prompts, the primary judge labels 76.7% of adversarial inputs as jailbreaks. A condition-blind, single-annotator validation yields a Rogan-Gladen sensitivity estimate of 0.87 for this condition (about 0.83-0.95 with validation-rate uncertainty); this correction is not applied to masked conditions. The apparent frequency ranking depends on the partition: energy share alone predicts the standard eight-band ranking (Spearman's rho = 0.95), and equal-Hz and equal-energy partitions show that masking any tested band can sharply reduce attack success. At a finer 16-band equal-energy resolution, however, masking the narrow 7520-7960 Hz band leaves ASR at 0.10, which remains unresolved without a matched control. Matched-energy scattered-removal tests show that contiguous removal is more damaging in lower bands, while both forms approach the floor in upper bands. Global rescaling leaves ASR near baseline but tests amplitude sensitivity rather than frequency location. In a re-optimization pilot (n = 20), tested single- and two-band supports reach ASRs of 0.00, 0.25, and 0.40, while random supports covering about half the STFT bins reach a mean of 0.86. In a prompt- and energy-adjusted model, audio-span divergence is associated with band necessity, with the coefficient rising from +0.63 at the projector output to +0.93 at layer 30 (contrast +0.293, 95% CI [0.11, 0.51]). This association is not a causal localization, and single-layer patching does not establish a causal layer. The results support partition-aware auditing of frequency claims, leaving the fine-resolution top-band result and broader generality open.

We present a boundary integral equation (BIE) framework for two-dimensional time-harmonic elastic transmission problems. Using the Helmholtz decomposition, the elastodynamic displacement fields are expressed in terms of scalar pressure and shear potentials, so that only the four classical Helmholtz boundary integral operators are needed. The key step is a rewriting of the Navier traction operator in the local normal--tangential frame of the interface, in which second-order normal derivatives are eliminated in favour of tangential derivatives and curvature terms. This leads to a one-parameter family of indirect combined field integral equations, depending on a coupling constant αne 0, which we prove to be uniquely solvable. The principal part of the resulting operator is, however, defective, and the discretized systems are severely ill-conditioned. Using the pseudodifferential calculus of the Helmholtz BIOs, we construct explicit left and right analytical preconditioners and prove that the preconditioned operator is a compact perturbation of the identity. Numerical experiments based on high-order Nyström discretizations confirm that the preconditioner clusters the spectrum: the number of GMRES iterations becomes independent of the discretization and is reduced by one order of magnitude or more, also in the high-frequency regime and for non-convex scatterers.

Understanding how nano- or micro-scale structures and material properties can be optimally configured to attain specific functionalities remains a fundamental challenge. Photonic metasurfaces, for instance, can be spectrally tuned through material choice and structural geometry to achieve unique optical responses. However, existing numerical design methods require prior identification of specific material-structure combinations, or device classes, as the starting point for optimization. As such, a unified solution that simultaneously optimizes across materials and geometries has yet to be realized. To overcome these challenges, we present a global deep learning-based inverse design framework, where a conditional deep convolutional generative adversarial network is trained on colored images encoded with a range of material and structural parameters, including refractive index, plasma frequency, and geometric design. We demonstrate that, in response to target absorption spectra, the network can identify an effective metasurface in terms of its class, materials properties, and overall shape. Furthermore, the model can arrive at multiple design variants with distinct materials and structures that present nearly identical absorption spectra. Our proposed framework is thus an important step towards global photonics and materials design strategies that can identify combinations of device categories, material properties, and geometric parameters which algorithmically deliver a sought functionality.

Suppressing parasitic back-reflection caused by imperfections, such as random defects, material inhomogeneities, localized inclusions, and fabrication-induced geometric deviations, has long been a central objective in optical-waveguide engineering. In this Letter, we theoretically establish that universal immunity to backscattering from arbitrary disorder is fundamentally impossible in reciprocal optical waveguides, irrespective of whether the underlying structure is topologically trivial or nontrivial.We establish this result through two complementary constructions of physically admissible reciprocal perturbations. The first considers weak permittivity perturbations of finite spatial extent within the first Born approximation, whereas the second considers optically small dielectric perturbations of finite contrast. In each construction, an admissible realization exists that produces a nonzero leading-order backward-scattering amplitude. We trace the fundamental origin of this limitation to the absence in photons of the intrinsic spin-1{2} and fermionic time-reversal structure underlying Kramers protection in electronic systems. Consequently, any mechanism that enforces photonic backscattering suppression throughout a prescribed class of disorder must instead be engineered into the underlying electromagnetic structure and its constitutive response, which can itself be modified by generic reciprocal perturbations. Numerical examples in representative reciprocal topological waveguides further illustrate these limitations for random defects and sharp bends. We further identify several constructive strategies for suppressing back-reflection within certain prescribed classes of disorder.

Within the paradigm of metamaterials and metasurfaces, electromagnetic properties of composite materials can be engineered by shaping or modulating their constituents, so-called meta-atoms. Synthesis and analysis of complex-shape meta-atoms with general polarization properties is a challenging task. In this paper, we demonstrate that the most general response can be conceptually decomposed into a set of basic, fundamental polarization phenomena, which enables immediate all-direction characterization of electromagnetic properties of arbitrary linear metamaterials and metasurfaces. The proposed platform of modular characterization (called "materiatronics") is tested on several examples of bianisotropic and nonreciprocal meta-atoms. As a demonstration of the potential of the modular analysis, we use it to design a single-layer metasurface of vanishing thickness with unitary circular dichroism. The analysis approach developed in this paper is supported by a ready-to-use computational code and can be further extended to meta-atoms engineered for other types of wave interactions, such as acoustics and mechanics.

Conventional acoustic beamformers assume that noise is stationary within short time frames. This assumption prevents them from exploiting correlations between frequencies in almost-periodic noise sources such as musical instruments, fans, and engines. These signals exhibit periodically varying statistics and are better modeled as cyclostationary processes. This paper introduces the cyclic MVDR (cMVDR) beamformer, an extension of the conventional MVDR that leverages both spatial and spectral correlations to improve noise reduction, particularly in low-SNR scenarios. The method builds on frequency-shifted (FRESH) filtering, where shifted versions of the input are combined to attenuate or amplify components that are coherent across frequency. To address inharmonicity, where harmonic partials deviate from exact integer multiples of the fundamental frequency, we propose a data-driven strategy that estimates resonant frequencies via periodogram analysis and computes the frequency shifts from their spacing. Analytical and experimental results demonstrate that performance improves with increasing spectral correlation. On real recordings, the cMVDR achieves up to 5 dB gain in scale-invariant signal-to-distortion ratio (SI-SDR) over the MVDR and remains effective even with a single microphone. Code is available at https://github.com/Screeen/cMVDR.

Partial differential equations (PDEs) are important tools to model physical systems, and including them into machine learning models is an important way of incorporating physical knowledge. Given any system of linear PDEs with constant coefficients, we propose a family of Gaussian process (GP) priors, which we call EPGP, such that all realizations are exact solutions of this system. We apply the Ehrenpreis-Palamodov fundamental principle, which works like a non-linear Fourier transform, to construct GP kernels mirroring standard spectral methods for GPs. Our approach can infer probable solutions of linear PDE systems from any data such as noisy measurements, or pointwise defined initial and boundary conditions. Constructing EPGP-priors is algorithmic, generally applicable, and comes with a sparse version (S-EPGP) that learns the relevant spectral frequencies and works better for big data sets. We demonstrate our approach on three families of systems of PDE, the heat equation, wave equation, and Maxwell's equations, where we improve upon the state of the art in computation time and precision, in some experiments by several orders of magnitude.

Near-field radar imaging systems are recently used in a wide range of applications, such as medical diagnosis, through-wall imaging, concealed weapon detection, and nondestructive evaluation. In this paper, we consider the problem of reconstructing the three-dimensional (3D) complex-valued reflectivity distribution of the near-field scene from sparse multiple-input multiple-output (MIMO) array measurements. Using the alternating direction method of multipliers (ADMM) framework, we solve this inverse problem by enforcing regularization on the magnitude of the complex-valued reflectivity distribution. For this, we provide a general expression for the proximal mapping associated with such regularization functionals. This equivalently corresponds to the solution of a complex-valued denoising problem which involves regularization on the magnitude. By utilizing this expression, we develop a novel and efficient plug-and-play (PnP) reconstruction method that consists of simple update steps. Due to the success of data-adaptive deep priors in various imaging problems, we also train a 3D deep denoiser to exploit within the developed PnP framework for MIMO imaging. The effectiveness of the developed learning-based PnP approach is illustrated under various compressive and noisy observation scenarios using both simulated data and experimental measurements. The performance is also compared with sparsity priors and the commonly used analytical approaches such as back-projection and Kirchhoff migration. The results demonstrate that the developed technique not only provides state-of-the-art reconstruction performance for 3D real-world targets, but also enables fast computation. Our approach provides a unified general framework to effectively handle arbitrary regularization on the magnitude of a complex-valued unknown and is equally applicable to other radar image formation problems (including SAR).

Audio mixing style encompasses the artistic and technical decisions a mix engineer makes, including level balancing, spatialization, and the choice, ordering, and parameterization of audio effects (FX) on each stem. FX chains are a key determinant of this style, yet existing approaches to modeling them remain limited. Some operate on stereo mixtures without explicit per-stem FX chain modeling, others fix the number or type of effects per track, and many require differentiable effect implementations or scarce multitrack datasets. We present StemFX, a framework that learns mixing style representations by autoregressively predicting variable-length FX chains on source-separated stems. A Transformer decoder predicts tokenized FX chains autoregressively, while a band-split multi-band CNN encoder with FiLM conditioning captures per-stem spectral structure. To enable large-scale paired training, we extract pseudo-stems from about 105K songs via source separation and augment them using MultiAFx, a toolkit unifying 85 audio effects from 7 Python libraries. Evaluated on mixing style retrieval, StemFX outperforms all baseline models across all tested chain lengths. On paired mixing style transfer, StemFX achieves the best spectral fidelity and the highest listener preference, over 4000 times faster than iterative optimization.

We study the bi-parameter local linearization of the one-dimensional nonlinear stochastic wave equation driven by a Gaussian noise, which is white in time and has a spatially homogeneous covariance structure of Riesz-kernel type. We establish that the second-order increments of the solution can be approximated by those of the corresponding linearized wave equation, modulated by the diffusion coefficient. These findings extend the previous results of Huang et al. HOO2024, which addressed the case of space-time white noise. As applications, we analyze the quadratic variation of the solution and construct a consistent estimator for the diffusion parameter.

We present the first complete machine learning method for accelerating plane-wave density functional theory (DFT) in materials under the projector augmented wave (PAW) formalism. We formalize seven criteria that a Complete Neural Electronic Initializer must satisfy for practical end-to-end PAW DFT acceleration. Applying these criteria to prior work reveals two missing structure-dependent components, augmentation occupancies and spin initialization, that prevent existing methods from providing complete reference-free initialization. Controlled ablations show that omitting these components can eliminate or reverse the acceleration obtained via models that only predict the smooth valence density. We satisfy these missing requirements by introducing AugNet, the first general equivariant model for PAW augmentation occupancies, and the first general spin density model for materials, which predicts the smooth spin-difference density and spin-difference PAW augmentation occupancies using predicted magnetic moments to constrain the global magnetic state. Combined with existing valence density models, these components satisfy all seven criteria and form a fully reference-free electronic initializer for materials DFT, requiring no electronic quantities from a converged target calculation. Our method reduces end-to-end DFT wall time by up to ~25% on unseen structures while preserving converged energies.

We give an overview of recent developments in the modeling of radiowave propagation, based on machine learning algorithms. We identify the input and output specification and the architecture of the model as the main challenges associated with machine learning-driven propagation models. Relevant papers are discussed and categorized based on their approach to each of these challenges. Emphasis is given on presenting the prospects and open problems in this promising and rapidly evolving area.

We construct explicit algebraic finite Gabor windows that are simultaneously full spark and phase retrievable, with quantitative control of the self-ambiguity function. In every cyclic dimension, a constant--Chu window has an exactly computable ambiguity minimum of order N^{-3/2}; for Nge25, a two-site Chu repair has margin comparable to dN^{-3/2} for every divisor dlesqrt N. A quantitative algebraic regularization, based on the high-degree specialization principle used in explicit full-spark Gabor constructions, imposes full spark while retaining a fixed proportion of a seed's ambiguity margin. These ingredients give explicit simultaneous constructions in every cyclic dimension and a factor-sensitive improvement when N has a divisor near sqrt N. Further consequences include exact Chinese-remainder tensorization, optimal-order squarefree families, near-SIC prime regularization, lifted stability, and a finite cyclic Schrödinger construction.

Acoustic beamforming models typically assume wide-sense stationarity of speech signals within short time frames. However, voiced speech is better modeled as a cyclostationary (CS) process, a random process whose mean and autocorrelation are T_1-periodic, where alpha_1=1/T_1 corresponds to the fundamental frequency of vowels. Higher harmonic frequencies are found at integer multiples of the fundamental. This work introduces a cyclic multichannel Wiener filter (cMWF) for speech enhancement derived from a cyclostationary model. This beamformer exploits spectral correlation across the harmonic frequencies of the signal to further reduce the mean-squared error (MSE) between the target and the processed input. The proposed cMWF is optimal in the MSE sense and reduces to the MWF when the target is wide-sense stationary. Experiments on simulated data demonstrate considerable improvements in scale-invariant signal-to-distortion ratio (SI-SDR) on synthetic data but also indicate high sensitivity to the accuracy of the estimated fundamental frequency alpha_1, which limits effectiveness on real data.

Millimeter-wave (mmWave) and Terahertz (THz)-band communications hold great promise in meeting the growing data-rate demands of next-generation wireless networks, offering abundant bandwidth. To mitigate the severe path loss inherent to these high frequencies and reduce hardware costs, ultra-massive multiple-input multiple-output (UM-MIMO) systems with hybrid beamforming architectures can deliver substantial beamforming gains and enhanced spectral efficiency. However, accurate channel estimation (CE) in mmWave and THz UM-MIMO systems is challenging due to high channel dimensionality and compressed observations from a limited number of RF chains, while the hybrid near- and far-field radiation patterns, arising from large array apertures and high carrier frequencies, further complicate CE. Conventional compressive sensing based frameworks rely on predefined sparsifying matrices, which cannot faithfully capture the hybrid near-field and far-field channel structures, leading to degraded estimation performance. This paper introduces DiffPace, a diffusion-based plug-and-play method for channel estimation. DiffPace uses a diffusion model (DM) to capture the channel distribution based on the hybrid spherical and planar-wave (HPSM) model. By applying the plug-and-play approach, it leverages the DM as prior knowledge, improving CE accuracy. Moreover, DM performs inference by solving an ordinary differential equation, minimizing the number of required inference steps compared with stochastic sampling method. Experimental results show that DiffPace achieves competitive CE performance, attaining -15 dB normalized mean square error (NMSE) at a signal-to-noise ratio (SNR) of 10 dB, with 90\% fewer inference steps compared to state-of-the-art schemes, simultaneously providing high estimation precision and enhanced computational efficiency.

Crystal symmetry plays a fundamental role in determining its physical, chemical, and electronic properties such as electrical and thermal conductivity, optical and polarization behavior, and mechanical strength. Almost all known crystalline materials have internal symmetry. However, this is often inadequately addressed by existing generative models, making the consistent generation of stable and symmetrically valid crystal structures a significant challenge. We introduce WyFormer, a generative model that directly tackles this by formally conditioning on space group symmetry. It achieves this by using Wyckoff positions as the basis for an elegant, compressed, and discrete structure representation. To model the distribution, we develop a permutation-invariant autoregressive model based on the Transformer encoder and an absence of positional encoding. Extensive experimentation demonstrates WyFormer's compelling combination of attributes: it achieves best-in-class symmetry-conditioned generation, incorporates a physics-motivated inductive bias, produces structures with competitive stability, predicts material properties with competitive accuracy even without atomic coordinates, and exhibits unparalleled inference speed.

The use of mmWave frequencies is one of the key strategies to achieve the fascinating 1000x increase in the capacity of future 5G wireless systems. While for traditional sub-6 GHz cellular frequencies several well-developed statistical channel models are available for system simulation, similar tools are not available for mmWave frequencies, thus preventing a fair comparison of independently developed transmission and reception schemes. In this paper we provide a simple albeit accurate statistical procedure for the generation of a clustered MIMO channel model operating at mmWaves, for both the cases of slowly and rapidly time-varying channels. Matlab scripts for channel generation are also provided, along with an example of their use.

This paper proposes a deep neural network for estimating the directions of arrival (DOA) of multiple sound sources. The proposed stacked convolutional and recurrent neural network (DOAnet) generates a spatial pseudo-spectrum (SPS) along with the DOA estimates in both azimuth and elevation. We avoid any explicit feature extraction step by using the magnitudes and phases of the spectrograms of all the channels as input to the network. The proposed DOAnet is evaluated by estimating the DOAs of multiple concurrently present sources in anechoic, matched and unmatched reverberant conditions. The results show that the proposed DOAnet is capable of estimating the number of sources and their respective DOAs with good precision and generate SPS with high signal-to-noise ratio.

In this paper, a mathematical model is developed to describe the evolution of the concentration of compounds through a gas chromatography column. The model couples mass balances and kinetic equations for all components. Both single and multiple-component cases are considered with constant or variable velocity. Non-dimensionalisation indicates the small effect of diffusion. The system where diffusion is neglected is analysed using Laplace transforms. In the multiple-component case, it is demonstrated that the competition between the compounds is negligible and the equations may be decoupled. This reduces the problem to solving a single integral equation to determine the concentration profile for all components (since they are scaled versions of each other). For a given analyte, we then only two parameters need to be fitted to the data. To verify this approach, the full governing equations are also solved numerically using the finite difference method and a global adaptive quadrature method to integrate the Laplace transformation. Comparison with the Laplace solution verifies the high degree of accuracy of the simpler Laplace form. The Laplace solution is then verified against experimental data from BTEX chromatography. This novel method, which involves solving a single equation and fitting parameters in pairs for individual components, is highly efficient. It is significantly faster and simpler than the full numerical solution and avoids the computationally expensive methods that would normally be used to fit all curves at the same time.

A mixed Gaussian fractional process {Y(t)}_{t Bbb R} = {PX(t)}_{t Bbb R} is a multivariate stochastic process obtained by pre-multiplying a vector of independent, Gaussian fractional process entries X by a nonsingular matrix P. It is interpreted that Y is observable, while X is a hidden process occurring in an (unknown) system of coordinates P. Mixed processes naturally arise as approximations to solutions of physically relevant classes of multivariate fractional SDEs under aggregation. We propose a semiparametric two-step wavelet-based method for estimating both the demixing matrix P^{-1} and the memory parameters of X. The asymptotic normality of the estimators is established both in continuous and discrete time. Monte Carlo experiments show that the finite sample estimation performance is comparable to that of parametric methods, while being very computationally efficient. As applications, we model a bivariate time series of annual tree ring width measurements, and establish the asymptotic normality of the eigenstructure of sample wavelet matrices.

Learning PDE dynamics with neural solvers can significantly improve wall-clock efficiency and accuracy compared with classical numerical solvers. In recent years, foundation models for PDEs have largely adopted multi-scale windowed self-attention, with the scOT backbone in Poseidon serving as a representative example. However, because of their locality, truly globally consistent spectral coupling can only be propagated gradually through deep stacking and window shifting. This weakens global coupling and leads to error accumulation and drift during closed-loop rollouts. To address this, we propose DRIFT-Net. It employs a dual-branch design comprising a spectral branch and an image branch. The spectral branch is responsible for capturing global, large-scale low-frequency information, whereas the image branch focuses on local details and nonstationary structures. Specifically, we first perform controlled, lightweight mixing within the low-frequency range. Then we fuse the spectral and image paths at each layer via bandwise weighting, which avoids the width inflation and training instability caused by naive concatenation. The fused result is transformed back into the spatial domain and added to the image branch, thereby preserving both global structure and high-frequency details across scales. Compared with strong attention-based baselines, DRIFT-Net achieves lower error and higher throughput with fewer parameters under identical training settings and budget. On Navier--Stokes benchmarks, the relative L_{1} error is reduced by 7\%--54\%, the parameter count decreases by about 15\%, and the throughput remains higher than scOT. Ablation studies and theoretical analyses further demonstrate the stability and effectiveness of this design. The code is available at https://github.com/cruiseresearchgroup/DRIFT-Net.

Optimizers that exploit the matrix structure of gradients are central to modern LLM pre-training, with two distinct frontiers: explicit Kronecker-factored preconditioning -- most recently KL-Shampoo, which estimates the preconditioner via KL divergence minimization -- and orthogonalization of the gradient momentum, exemplified by Muon and analyzed as steepest descent under the spectral norm. The two routes are typically developed in isolation. We make a structural observation about KL-Shampoo's Kronecker preconditioners: their eigenvalue spectra exhibit a spike-and-flat shape -- a few dominant eigenvalues followed by an approximately uniform tail -- across layers and training stages, holding exactly under a rank-ρ signal-plus-noise gradient model. We exploit this structure by restricting one of KL-Shampoo's Kronecker factors to a parametric family aligned with the spike-and-flat shape: full spectral structure on a tracked r-dimensional subspace, single shared eigenvalue across the remaining n-r directions. On these directions, we apply orthogonalization. An identity shows that this orthogonalization recovers the algebraic form of full KL-Shampoo's preconditioner. On four pre-training scales (GPT-2 124M / 350M, LLaMA 134M / 450M), Pro-KLShampoo consistently outperforms KL-Shampoo at every subspace rank we test in validation loss, peak per-GPU memory, and wallclock time to reach each loss level.

In metrology, Fisher information is an important metric that quantifies the precision that can be achieved in a measurement. For optical measurements using coherent light it has been shown that Fisher information can be expressed simply using the scattering matrix of the system. Fisher information can be maximized over the input modes to achieve maximum information states, which produce optimally precise estimates for a parameter when the system is limited by photon noise. Here, we extend this approach to multiparameter estimation, in which case Fisher information takes the form of a matrix. We consider several scalar functions of the Fisher matrix to optimize the precision in multiple parameters at the same time. We also consider strategies for dealing with nuisance parameters, which can degrade the achievable precision of other parameters but are not of interest to measure. We corroborate our findings numerically using a scattering system of 2D coupled dipoles.

We address the computational challenges of solving parametric PDEs with non parametrized geometric variations and non-reducible problems, such as those involving shocks and discontinuities of variable positions. Traditional dimensionality reduction methods like POD struggle with these scenarios due to slowly decaying Kolmogorov widths. To overcome this, we propose a novel non-linear dimensionality reduction technique to reduce the required modes for representation. The non-linear reduction is obtained through a POD after applying a transformation on the fields, which we call optimal mappings, and is a solution to an optimization problem in infinite dimension. The proposed learning framework combines morphing techniques, non-linear dimensionality reduction, and Gaussian Process Regression (GPR). The problem is reformulated on a reference geometry before applying the dimensionality reduction. Our method learns both the optimal mapping, and the solution fields, using a series of GPR models, enabling efficient and accurate modeling of complex parametric PDEs with geometrical variability. The results obtained concur with current state-of-the-art models. We mainly compare our method with the winning solution of the ML4CFD NeurIPS 2024 competition.

Efficient numerical solvers for partial differential equations empower science and engineering. One of the commonly employed numerical solvers is the preconditioned conjugate gradient (PCG) algorithm which can solve large systems to a given precision level. One challenge in PCG solvers is the selection of preconditioners, as different problem-dependent systems can benefit from different preconditioners. We present a new method to introduce inductive bias in preconditioning conjugate gradient algorithm. Given a system matrix and a set of solution vectors arise from an underlying distribution, we train a graph neural network to obtain an approximate decomposition to the system matrix to be used as a preconditioner in the context of PCG solvers. We conduct extensive experiments to demonstrate the efficacy and generalizability of our proposed approach in solving various 2D and 3D linear second-order PDEs.

Model merging combines several independently fine-tuned experts into a single multi-task model without any training data, reducing the storage, serving, and decentralized-development costs of large foundation models. State-of-the-art merging methods formulate merging as a layer-wise quadratic interference minimization problem. Although this problem admits an exact closed-form pseudoinverse solution, that solution underperforms hundreds of iterations of gradient descent in practice. The iterative loop dominates the cost of the pipeline, yet its effectiveness has remained unexplained. We revisit this regime and show that the iterative solver does not primarily act as an optimizer; rather, it serves as an implicit spectral regularizer for an ill-posed normal equation, where small-eigenvalue directions of the per-layer interference operator amplify proxy noise. Building on this finding, we formalize multi-task model merging as a noisy linear inverse problem and propose a spectral filtering estimator parameterized by a per-direction filter. We instantiate this estimator with SWUDI, a closed-form method that combines a soft exponential filter, which matches the gradient-flow trajectory of iterative descent, with a hard top-K truncation that suppresses noise-amplifying small-eigenvalue directions. Furthermore, we propose SWUDI-A, an adaptive variant that replaces the global rank hyperparameter with per-layer rank rules, further improving robustness across architectures. Both variants share a single symmetric eigendecomposition per linear layer and require no training data or optimizer state. Across four general benchmarks and a multimodal merging benchmark spanning VQA, Geometry, Chart, OCR, Grounding, and modality merging, our proposed spectral solvers match or outperform state-of-the-art merging methods. Crucially, they reduce wall-clock time by 28-72x and peak GPU memory by up to 50%.

We present Symphony, an E(3)-equivariant autoregressive generative model for 3D molecular geometries that iteratively builds a molecule from molecular fragments. Existing autoregressive models such as G-SchNet and G-SphereNet for molecules utilize rotationally invariant features to respect the 3D symmetries of molecules. In contrast, Symphony uses message-passing with higher-degree E(3)-equivariant features. This allows a novel representation of probability distributions via spherical harmonic signals to efficiently model the 3D geometry of molecules. We show that Symphony is able to accurately generate small molecules from the QM9 dataset, outperforming existing autoregressive models and approaching the performance of diffusion models.

This study investigates the possibility of increasing the radiation efficiency of printed antennas and arrays by suppressing their inherent surface waves using a metasurface made of quad-split rings (QSR). A symmetrical resonant microstrip dipole and a four-element series-fed dipole array printed on an infinite grounded dielectric layer (layer thickness: 0.2 mm; relative permittivity: 9.4; tan delta: 0.0005) were simulated with FEKO 2022 software. Conducted at 100-116 GHz, the numerical results revealed extremely low radiation efficiencies of approximately 31% and 40% for the studied dipole and dipole array, respectively, which resulted from the presence of surface waves in the dielectric. However, placing only one QSR near each dipole arm triggered an increase in radiation efficiency by 2.5 times (up to 75%). The use of a metasurface in the form of two small QSR arrays triggered a pronounced improvement in radiation efficiency, reaching 93.6% and 96.5% for the studied dipole and dipole array, respectively. Analysis of the electric field distribution images showed that this enhancement resulted from surface wave suppression.

The Gauge-Including Projector Augmented Wave (GIPAW) method, within the Density Functional Theory (DFT) Generalized Gradient Approximation (GGA) framework, is applied to compute solid state NMR parameters for ^{27}Al in the α, θ, and κ aluminium oxide phases and their gibbsite and boehmite precursors. The results for well-established crystalline phases compare very well with available experimental data and provide confidence in the accuracy of the method. For γ-alumina, four structural models proposed in the literature are discussed in terms of their ability to reproduce the experimental spectra also reported in the literature. Among the considered models, the Fd3m structure proposed by Paglia {\it et al.} [Phys. Rev. B {\bf 71}, 224115 (2005)] shows the best agreement. We attempt to link the theoretical NMR parameters to the local geometry. Chemical shifts depend on coordination number but no further correlation is found with geometrical parameters. Instead our calculations reveal that, within a given coordination number, a linear correlation exists between chemical shifts and Born effective charges.

In a previous paper it was shown that a machine learning regression problem can be solved within the framework of random function theory, with the optimal kernel analytically derived from symmetry and indifference principles and coinciding with a polyharmonic spline. However, a direct application of that solution is limited by O(N^3) computational cost and by a breakdown of the original theoretical assumptions when the input space has excessive dimensionality. This paper proposes a cascade architecture built from packages of polyharmonic splines that simultaneously addresses scalability and is theoretically justified for problems with unknown intrinsic low dimensionality. Efficient matrix procedures are presented for forward computation and end-to-end differentiation through the cascade.

This paper investigates a Stacked Intelligent Metasurfaces (SIM)-assisted Integrated Sensing and Communications (ISAC) system. An extended target model is considered, where the BS aims to estimate the complete target response matrix relative to the SIM. Under the constraints of minimum Signal-to-Interference-plus-Noise Ratio (SINR) for the communication users (CUs) and maximum transmit power, we jointly optimize the transmit beamforming at the base station (BS) and the end-to-end transmission matrix of the SIM, to minimize the Cramér-Rao Bound (CRB) for target estimation. Effective algorithms such as the alternating optimization (AO) and semidefinite relaxation (SDR) are employed to solve the non-convex SINR-constrained CRB minimization problem. Finally, we design and build an experimental platform for SIM, and evaluate the performance of the proposed algorithms for communication and sensing tasks.

Neural vocoders often struggle with aliasing in latent feature spaces, caused by time-domain nonlinear operations and resampling layers. Aliasing folds high-frequency components into the low-frequency range, making aliased and original frequency components indistinguishable and introducing two practical issues. First, aliasing complicates the waveform generation process, as the subsequent layers must address these aliasing effects, increasing the computational complexity. Second, it limits extrapolation performance, particularly in handling high fundamental frequencies, which degrades the perceptual quality of generated speech waveforms. This paper demonstrates that 1) time-domain nonlinear operations inevitably introduce aliasing but provide a strong inductive bias for harmonic generation, and 2) time-frequency-domain processing can achieve aliasing-free waveform synthesis but lacks the inductive bias for effective harmonic generation. Building on this insight, we propose Wavehax, an aliasing-free neural WAVEform generator that integrates 2D convolution and a HArmonic prior for reliable Complex Spectrogram estimation. Experimental results show that Wavehax achieves speech quality comparable to existing high-fidelity neural vocoders and exhibits exceptional robustness in scenarios requiring high fundamental frequency extrapolation, where aliasing effects become typically severe. Moreover, Wavehax requires less than 5% of the multiply-accumulate operations and model parameters compared to HiFi-GAN V1, while achieving over four times faster CPU inference speed.

Neural Radiance Field (NeRF) has shown impressive performance in novel view synthesis via implicit scene representation. However, it usually suffers from poor scalability as requiring densely sampled images for each new scene. Several studies have attempted to mitigate this problem by integrating Multi-View Stereo (MVS) technique into NeRF while they still entail a cumbersome fine-tuning process for new scenes. Notably, the rendering quality will drop severely without this fine-tuning process and the errors mainly appear around the high-frequency features. In the light of this observation, we design WaveNeRF, which integrates wavelet frequency decomposition into MVS and NeRF to achieve generalizable yet high-quality synthesis without any per-scene optimization. To preserve high-frequency information when generating 3D feature volumes, WaveNeRF builds Multi-View Stereo in the Wavelet domain by integrating the discrete wavelet transform into the classical cascade MVS, which disentangles high-frequency information explicitly. With that, disentangled frequency features can be injected into classic NeRF via a novel hybrid neural renderer to yield faithful high-frequency details, and an intuitive frequency-guided sampling strategy can be designed to suppress artifacts around high-frequency regions. Extensive experiments over three widely studied benchmarks show that WaveNeRF achieves superior generalizable radiance field modeling when only given three images as input.

Source separation involves the ill-posed problem of retrieving a set of source signals that have been observed through a mixing operator. Solving this problem requires prior knowledge, which is commonly incorporated by imposing regularity conditions on the source signals, or implicitly learned through supervised or unsupervised methods from existing data. While data-driven methods have shown great promise in source separation, they often require large amounts of data, which rarely exists in planetary space missions. To address this challenge, we propose an unsupervised source separation scheme for domains with limited data access that involves solving an optimization problem in the wavelet scattering covariance representation spacex2014an interpretable, low-dimensional representation of stationary processes. We present a real-data example in which we remove transient, thermally-induced microtiltsx2014known as glitchesx2014from data recorded by a seismometer during NASA's InSight mission on Mars. Thanks to the wavelet scattering covariances' ability to capture non-Gaussian properties of stochastic processes, we are able to separate glitches using only a few glitch-free data snippets.

Hidden-state probes effectively detect LLM hallucinations, but the geometry of the signal remains poorly characterized, driving increasingly complex probe architectures. Across three 7B-scale models and three datasets in a paired-example paradigm, we find the signal overwhelmingly dominated by a single mean-shift component, and removing this direction collapses detection to chance. Shrinkage linear discriminant analysis closes about 73% of the gap between 1D and full-dimensional classifiers, so apparent architectural complexity largely reflects high-dimensional covariance estimation difficulty rather than exploitable non-linearity. A simple L2-regularized logistic regression (0.952 AUROC) bounds or outperforms twelve controlled architectural alternatives, and our multi-layer aggregation exceeds CLAP cross-layer attention probing under matched paradigm. Because the signal spans a contiguous layer band, LayerMix aggregates it to match oracle-layer performance without oracle access. Our claims characterize the geometry within the controlled paired-example paradigm. Our code is available at https://github.com/js-lee-AI/LayerMix.

The SIML (abbreviation of Separating Information Maximal Likelihood) method, has been introduced by N. Kunitomo and S. Sato and their collaborators to estimate the integrated volatility of high-frequency data that is assumed to be an It\^o process but with so-called microstructure noise. The SIML estimator turned out to share many properties with the estimator introduced by P. Malliavin and M.E. Mancino. The present paper establishes the consistency and the asymptotic normality under a general sampling scheme but without microstructure noise. Specifically, a fast convergence shown for Malliavin--Mancino estimator by E. Clement and A. Gloter is also established for the SIML estimator.

Orthogonal frequency-division multiplexing (OFDM) is widely adopted in frequency-selective channels for its ability to simplify equalization, yet it also causes large signal peaks, out-of-band (OOB) emissions, and spectral leakage. We study downlink precoding/combining for multi-user multiple-input multiple-output (MU-MIMO)--OFDM systems by minimizing the sum of the users' mean-squared errors (MSEs) under per-subcarrier transmit-power limits, per-antenna OOB spectral-mask constraints, and per-antenna peak-amplitude (clipping) constraints, which confine the emitted spectrum and limit waveform peaks to reduce power-amplifier saturation, nonlinear distortion, and spectral regrowth. The resulting nonconvex problem is handled by a minimum mean-squared error (MMSE) based block coordinate descent (BCD), with a closed-form combiner update and an alternating direction method of multipliers (ADMM) algorithm with closed-form updates for the precoder subproblem. Simulations show clear gains over well-known benchmark schemes.

We study the degree of reliability of extrapolation of complex electromagnetic permittivity functions based on their analyticity properties. Given two analytic functions, representing extrapolants of the same experimental data, we examine how much they can differ at an extrapolation point outside of the experimentally accessible frequency band. We give a sharp upper bound on the worst case extrapolation error, in terms of a solution of an integral equation of Fredholm type. We conjecture and give numerical evidence that this bound exhibits a power law precision deterioration as one moves further away from the frequency band containing measurement data.

There is a growing gap between the impressive results of deep image generative models and classical algorithms that offer theoretical guarantees. The former suffer from mode collapse or memorization issues, limiting their application to scientific data. The latter require restrictive assumptions such as log-concavity to escape the curse of dimensionality. We partially bridge this gap by introducing conditionally strongly log-concave (CSLC) models, which factorize the data distribution into a product of conditional probability distributions that are strongly log-concave. This factorization is obtained with orthogonal projectors adapted to the data distribution. It leads to efficient parameter estimation and sampling algorithms, with theoretical guarantees, although the data distribution is not globally log-concave. We show that several challenging multiscale processes are conditionally log-concave using wavelet packet orthogonal projectors. Numerical results are shown for physical fields such as the varphi^4 model and weak lensing convergence maps with higher resolution than in previous works.

Solving partial differential equations (PDEs) with machine learning has recently attracted great attention, as PDEs are fundamental tools for modeling real-world systems that range from fundamental physical science to advanced engineering disciplines. Most real-world physical systems across various disciplines are actually involved in multiple coupled physical fields rather than a single field. However, previous machine learning studies mainly focused on solving single-field problems, but overlooked the importance and characteristics of multiphysics problems in real world. Multiphysics PDEs typically entail multiple strongly coupled variables, thereby introducing additional complexity and challenges, such as inter-field coupling. Both benchmarking and solving multiphysics problems with machine learning remain largely unexamined. To identify and address the emerging challenges in multiphysics problems, we mainly made three contributions in this work. First, we collect the first general multiphysics dataset, the Multiphysics Bench, that focuses on multiphysics PDE solving with machine learning. Multiphysics Bench is also the most comprehensive PDE dataset to date, featuring the broadest range of coupling types, the greatest diversity of PDE formulations, and the largest dataset scale. Second, we conduct the first systematic investigation on multiple representative learning-based PDE solvers, such as PINNs, FNO, DeepONet, and DiffusionPDE solvers, on multiphysics problems. Unfortunately, naively applying these existing solvers usually show very poor performance for solving multiphysics. Third, through extensive experiments and discussions, we report multiple insights and a bag of useful tricks for solving multiphysics with machine learning, motivating future directions in the study and simulation of complex, coupled physical systems.

The reduced basis method is a model reduction technique yielding substantial savings of computational time when a solution to a parametrized equation has to be computed for many values of the parameter. Certification of the approximation is possible by means of an a posteriori error bound. Under appropriate assumptions, this error bound is computed with an algorithm of complexity independent of the size of the full problem. In practice, the evaluation of the error bound can become very sensitive to round-off errors. We propose herein an explanation of this fact. A first remedy has been proposed in [F. Casenave, Accurate a posteriori error evaluation in the reduced basis method. C. R. Math. Acad. Sci. Paris 350 (2012) 539--542.]. Herein, we improve this remedy by proposing a new approximation of the error bound using the Empirical Interpolation Method (EIM). This method achieves higher levels of accuracy and requires potentially less precomputations than the usual formula. A version of the EIM stabilized with respect to round-off errors is also derived. The method is illustrated on a simple one-dimensional diffusion problem and a three-dimensional acoustic scattering problem solved by a boundary element method.

Modeling long-range dependencies in time series generation poses a fundamental trade-off between representational capacity and computational efficiency. Traditional temporal diffusion models suffer from local entanglement and the O(L^2) cost of attention mechanisms. We address these limitations by introducing PaCoDi (Parallel Complex Diffusion), a spectral-native architecture that decouples generative modeling in the frequency domain. PaCoDi fundamentally alters the problem topology: the Fourier Transform acts as a diagonalizing operator, converting locally coupled temporal signals into globally decorrelated spectral components. Theoretically, we prove the Quadrature Forward Diffusion and Conditional Reverse Factorization theorem, demonstrating that the complex diffusion process can be split into independent real and imaginary branches. We bridge the gap between this decoupled theory and data reality using a Mean Field Theory (MFT) approximation reinforced by an interactive correction mechanism. Furthermore, we generalize this discrete DDPM to continuous-time Frequency SDEs, rigorously deriving the Spectral Wiener Process describe the differential spectral Brownian motion limit. Crucially, PaCoDi exploits the Hermitian Symmetry of real-valued signals to compress the sequence length by half, achieving a 50% reduction in attention FLOPs without information loss. We further derive a rigorous Heteroscedastic Loss to handle the non-isotropic noise distribution on the compressed manifold. Extensive experiments show that PaCoDi outperforms existing baselines in both generation quality and inference speed, offering a theoretically grounded and computationally efficient solution for time series modeling.

We present PixCell, a neurosymbolic system in which multimodal agents convert a visually presented photonic component into a parametric program over a small domain-specific language (DSL) of geometric primitives. A system enabling deterministic visual verification renders evaluation asymmetrically cheaper than the generation attempt. While models using multi-seed sampling and iterative revision reach a mean best-turn IoU of only 0.416, multimodal agents through PixCell's interface and verifier consistently exceed 0.9 mean IoU, with scores reaching 0.974 and 0.955 across eight component targets while also satisfying source contracts. These results demonstrate that frontier multimodal agents can reliably understand and render executable parametric representations from visual targets. Using these live parameters, cross-stack studies on an interferometer reconstruct primitive programs that satisfy an 8.0 nm free spectral range target and the original footprint constraint on modeled 220-nm SOI, 400-nm SiN, and 400-nm TFLN stacks. PixCell further carries a paper-derived splitter from visual reconstruction through SOI full-wave simulation, producing symmetric propagation and balanced outputs. Finally, the same executable verifier supplies a training reward and dataset used to train a Qwen3.6-35B-A3B model with LoRA and GRPO without supervised demonstrations. On eight training-excluded paper figures, its mean champion IoU rises from 0.422 after eight initial attempts to 0.491 after three verifier-guided revision rounds. These results therefore establish a controlled framework for measuring, retargeting, and improving visual-to-parametric photonic component design.

Time-series data augmentation mitigates the issue of insufficient training data for deep learning models. Yet, existing augmentation methods are mainly designed for classification, where class labels can be preserved even if augmentation alters the temporal dynamics. We note that augmentation designed for forecasting requires diversity as well as coherence with the original temporal dynamics. As time-series data generated by real-life physical processes exhibit characteristics in both the time and frequency domains, we propose to combine Spectral and Time Augmentation (STAug) for generating more diverse and coherent samples. Specifically, in the frequency domain, we use the Empirical Mode Decomposition to decompose a time series and reassemble the subcomponents with random weights. This way, we generate diverse samples while being coherent with the original temporal relationships as they contain the same set of base components. In the time domain, we adapt a mix-up strategy that generates diverse as well as linearly in-between coherent samples. Experiments on five real-world time-series datasets demonstrate that STAug outperforms the base models without data augmentation as well as state-of-the-art augmentation methods.

The 3D Gaussian Splatting (3DGS) gained its popularity recently by combining the advantages of both primitive-based and volumetric 3D representations, resulting in improved quality and efficiency for 3D scene rendering. However, 3DGS is not alias-free, and its rendering at varying resolutions could produce severe blurring or jaggies. This is because 3DGS treats each pixel as an isolated, single point rather than as an area, causing insensitivity to changes in the footprints of pixels. Consequently, this discrete sampling scheme inevitably results in aliasing, owing to the restricted sampling bandwidth. In this paper, we derive an analytical solution to address this issue. More specifically, we use a conditioned logistic function as the analytic approximation of the cumulative distribution function (CDF) in a one-dimensional Gaussian signal and calculate the Gaussian integral by subtracting the CDFs. We then introduce this approximation in the two-dimensional pixel shading, and present Analytic-Splatting, which analytically approximates the Gaussian integral within the 2D-pixel window area to better capture the intensity response of each pixel. Moreover, we use the approximated response of the pixel window integral area to participate in the transmittance calculation of volume rendering, making Analytic-Splatting sensitive to the changes in pixel footprint at different resolutions. Experiments on various datasets validate that our approach has better anti-aliasing capability that gives more details and better fidelity.

We study the joint image of lines incident to points, meaning the set of image tuples obtained from fixed cameras observing a varying 3D point-line incidence. We prove a formula for the number of complex critical points of the triangulation problem that aims to compute a 3D point-line incidence from noisy images. Our formula works for an arbitrary number of images and measures the intrinsic difficulty of this triangulation. Additionally, we conduct numerical experiments using homotopy continuation methods, comparing different approaches of triangulation of such incidences. In our setup, exploiting the incidence relations gives both a faster point reconstruction and in three views more accurate.

Advancements in 3D Gaussian Splatting have significantly accelerated 3D reconstruction and generation. However, it may require a large number of Gaussians, which creates a substantial memory footprint. This paper introduces GES (Generalized Exponential Splatting), a novel representation that employs Generalized Exponential Function (GEF) to model 3D scenes, requiring far fewer particles to represent a scene and thus significantly outperforming Gaussian Splatting methods in efficiency with a plug-and-play replacement ability for Gaussian-based utilities. GES is validated theoretically and empirically in both principled 1D setup and realistic 3D scenes. It is shown to represent signals with sharp edges more accurately, which are typically challenging for Gaussians due to their inherent low-pass characteristics. Our empirical analysis demonstrates that GEF outperforms Gaussians in fitting natural-occurring signals (e.g. squares, triangles, and parabolic signals), thereby reducing the need for extensive splitting operations that increase the memory footprint of Gaussian Splatting. With the aid of a frequency-modulated loss, GES achieves competitive performance in novel-view synthesis benchmarks while requiring less than half the memory storage of Gaussian Splatting and increasing the rendering speed by up to 39%. The code is available on the project website https://abdullahamdi.com/ges .

We present an open-source Python implementation of an idealized high-order pseudo-spectral solver for the one-dimensional nonlinear Schr\"odinger equation (NLSE). The solver combines Fourier spectral spatial discretization with an adaptive eighth-order Dormand-Prince time integration scheme to achieve machine-precision conservation of mass and near-perfect preservation of momentum and energy for smooth solutions. The implementation accurately reproduces fundamental NLSE phenomena including soliton collisions with analytically predicted phase shifts, Akhmediev breather dynamics, and the development of modulation instability from noisy initial conditions. Four canonical test cases validate the numerical scheme: single soliton propagation, two-soliton elastic collision, breather evolution, and noise-seeded modulation instability. The solver employs a 2/3 dealiasing rule with exponential filtering to prevent aliasing errors from the cubic nonlinearity. Statistical analysis using Shannon, R\'enyi, and Tsallis entropies quantifies the spatio-temporal complexity of solutions, while phase space representations reveal the underlying coherence structure. The implementation prioritizes code transparency and educational accessibility over computational performance, providing a valuable pedagogical tool for exploring nonlinear wave dynamics. Complete source code, documentation, and example configurations are freely available, enabling reproducible computational experiments across diverse physical contexts where the NLSE governs wave evolution, including nonlinear optics, Bose-Einstein condensates, and ocean surface waves.

Pinching-antenna systems attach dielectric pinches to a waveguide, creating line-of-sight radiation points within a few meters of any user. The pinches on one waveguide, however, radiate the same signal, unlike a conventional array, where each element transmits a dedicated signal. Separating the signals of multiple users therefore becomes challenging and requires a new perspective on multiple access. Most existing studies rest on an idealized model, and no survey examines the access schemes under realistic impairments. This article surveys multiple access in pinching-antenna systems and organizes fifty-six works into a unified taxonomy by spatial degrees of freedom. The users of one waveguide can be separated only in time, frequency, power, or guided mode, while multiple waveguides add the space domain. The article then identifies the impairments critical to this separation, which perturb the effective channel, leak interference across orthogonal resources, or couple the pinches on the uplink, and summarizes them in an impairment-versus-method map. A unified evaluation of time-, frequency-, power-, and space-domain access under identical channel and impairment models reveals that the degradation is method specific. The analytical and numerical results give insight into multiple access in these systems and provide a basis for its impairment-aware design, a necessary step toward their adoption in practical networks.

Reverse engineering of music mixes aims to uncover how dry source signals are processed and combined to produce a final mix. We extend the prior works to reflect the compositional nature of mixing and search for a graph of audio processors. First, we construct a mixing console, applying all available processors to every track and subgroup. With differentiable processor implementations, we optimize their parameters with gradient descent. Then, we repeat the process of removing negligible processors and fine-tuning the remaining ones. This way, the quality of the full mixing console can be preserved while removing approximately two-thirds of the processors. The proposed method can be used not only to analyze individual music mixes but also to collect large-scale graph data that can be used for downstream tasks, e.g., automatic mixing. Especially for the latter purpose, efficient implementation of the search is crucial. To this end, we present an efficient batch-processing method that computes multiple processors in parallel. We also exploit the "dry/wet" parameter of the processors to accelerate the search. Extensive quantitative and qualitative analyses are conducted to evaluate the proposed method's performance, behavior, and computational cost.

We present a novel type of neural fields that uses general radial bases for signal representation. State-of-the-art neural fields typically rely on grid-based representations for storing local neural features and N-dimensional linear kernels for interpolating features at continuous query points. The spatial positions of their neural features are fixed on grid nodes and cannot well adapt to target signals. Our method instead builds upon general radial bases with flexible kernel position and shape, which have higher spatial adaptivity and can more closely fit target signals. To further improve the channel-wise capacity of radial basis functions, we propose to compose them with multi-frequency sinusoid functions. This technique extends a radial basis to multiple Fourier radial bases of different frequency bands without requiring extra parameters, facilitating the representation of details. Moreover, by marrying adaptive radial bases with grid-based ones, our hybrid combination inherits both adaptivity and interpolation smoothness. We carefully designed weighting schemes to let radial bases adapt to different types of signals effectively. Our experiments on 2D image and 3D signed distance field representation demonstrate the higher accuracy and compactness of our method than prior arts. When applied to neural radiance field reconstruction, our method achieves state-of-the-art rendering quality, with small model size and comparable training speed.

Recent advancements in Spectral Graph Convolutional Networks (SpecGCNs) have led to state-of-the-art performance in various graph representation learning tasks. To exploit the potential of SpecGCNs, we analyze corresponding graph filters via polynomial interpolation, the cornerstone of graph signal processing. Different polynomial bases, such as Bernstein, Chebyshev, and monomial basis, have various convergence rates that will affect the error in polynomial interpolation. Although adopting Chebyshev basis for interpolation can minimize maximum error, the performance of ChebNet is still weaker than GPR-GNN and BernNet. We point out it is caused by the Gibbs phenomenon, which occurs when the graph frequency response function approximates the target function. It reduces the approximation ability of a truncated polynomial interpolation. In order to mitigate the Gibbs phenomenon, we propose to add the Gibbs damping factor with each term of Chebyshev polynomials on ChebNet. As a result, our lightweight approach leads to a significant performance boost. Afterwards, we reorganize ChebNet via decoupling feature propagation and transformation. We name this variant as ChebGibbsNet. Our experiments indicate that ChebGibbsNet is superior to other advanced SpecGCNs, such as GPR-GNN and BernNet, in both homogeneous graphs and heterogeneous graphs.

For the large and chemically diverse GMTKN55 benchmark suite, we have studied the performance of density-corrected density functional theory (HF-DFT), compared to self-consistent DFT, for several pure and hybrid GGA and meta-GGA exchange-correlation (XC) functionals (PBE, BLYP, TPSS, SCAN) as a function of the percentage of HF exchange in the hybrid. The D4 empirical dispersion correction has been added throughout. For subsets dominated by dynamical correlation -- particularly noncovalent interaction subsets -- HF-DFT is highly beneficial, particularly at low HF exchange percentages. For subsets with significant static correlation (i.e., where a Hartree-Fock determinant is not a good zero-order wavefunction), HF-DFT may do more harm than good. While the self-consistent series show optima at or near 37.5% (i.e., 3/8) for all four XC functionals -- consistent with Grimme's proposal of the PBE38 functional -- HF-BnLYP-D4, HF-PBEn-D4, and HF-TPSSn-D4 all exhibit minima nearer 25% (i.e., 1/4). Intriguingly, for HF-SCANn-D4, the minimum is near 10%, but the weighted mean absolute error (WTMAD2) for GMTKN55 is only barely lower than that of HF-SCAN-D4 (i.e., where the post-HF step is a pure meta-GGA). The latter becomes an attractive option, only slightly more costly than pure Hartree-Fock, and devoid of adjustable parameters other than the three in the dispersion correction. Moreover, its WTMAD2 is only surpassed by the highly empirical M06-2X and by the combinatorically optimized empirical range-separated hybrids wB97X-V and wB97M-V.

In time series forecasting, effectively disentangling intricate temporal patterns is crucial. While recent works endeavor to combine decomposition techniques with deep learning, multiple frequencies may still be mixed in the decomposed components, e.g., trend and seasonal. Furthermore, frequency domain analysis methods, e.g., Fourier and wavelet transforms, have limitations in resolution in the time domain and adaptability. In this paper, we propose D-PAD, a deep-shallow multi-frequency patterns disentangling neural network for time series forecasting. Specifically, a multi-component decomposing (MCD) block is introduced to decompose the series into components with different frequency ranges, corresponding to the "shallow" aspect. A decomposition-reconstruction-decomposition (D-R-D) module is proposed to progressively extract the information of frequencies mixed in the components, corresponding to the "deep" aspect. After that, an interaction and fusion (IF) module is used to further analyze the components. Extensive experiments on seven real-world datasets demonstrate that D-PAD achieves the state-of-the-art performance, outperforming the best baseline by an average of 9.48% and 7.15% in MSE and MAE, respectively.

Trit-plane coding enables deep progressive image compression, but it cannot use autoregressive context models. In this paper, we propose the context-based trit-plane coding (CTC) algorithm to achieve progressive compression more compactly. First, we develop the context-based rate reduction module to estimate trit probabilities of latent elements accurately and thus encode the trit-planes compactly. Second, we develop the context-based distortion reduction module to refine partial latent tensors from the trit-planes and improve the reconstructed image quality. Third, we propose a retraining scheme for the decoder to attain better rate-distortion tradeoffs. Extensive experiments show that CTC outperforms the baseline trit-plane codec significantly in BD-rate on the Kodak lossless dataset, while increasing the time complexity only marginally. Our codes are available at https://github.com/seungminjeon-github/CTC.

Diffusion models have emerged as the leading approach for image synthesis, demonstrating exceptional photorealism and diversity. However, training diffusion models at high resolutions remains computationally prohibitive, and existing zero-shot generation techniques for synthesizing images beyond training resolutions often produce artifacts, including object duplication and spatial incoherence. In this paper, we introduce HiWave, a training-free, zero-shot approach that substantially enhances visual fidelity and structural coherence in ultra-high-resolution image synthesis using pretrained diffusion models. Our method employs a two-stage pipeline: generating a base image from the pretrained model followed by a patch-wise DDIM inversion step and a novel wavelet-based detail enhancer module. Specifically, we first utilize inversion methods to derive initial noise vectors that preserve global coherence from the base image. Subsequently, during sampling, our wavelet-domain detail enhancer retains low-frequency components from the base image to ensure structural consistency, while selectively guiding high-frequency components to enrich fine details and textures. Extensive evaluations using Stable Diffusion XL demonstrate that HiWave effectively mitigates common visual artifacts seen in prior methods, achieving superior perceptual quality. A user study confirmed HiWave's performance, where it was preferred over the state-of-the-art alternative in more than 80% of comparisons, highlighting its effectiveness for high-quality, ultra-high-resolution image synthesis without requiring retraining or architectural modifications.

This paper presents a deep machine learning architecture, the "polyharmonic cascade" -- a sequence of packages of polyharmonic splines, where each layer is rigorously derived from the theory of random functions and the principles of indifference. This makes it possible to approximate nonlinear functions of arbitrary complexity while preserving global smoothness and a probabilistic interpretation. For the polyharmonic cascade, a training method alternative to gradient descent is proposed: instead of directly optimizing the coefficients, one solves a single global linear system on each batch with respect to the function values at fixed "constellations" of nodes. This yields synchronized updates of all layers, preserves the probabilistic interpretation of individual layers and theoretical consistency with the original model, and scales well: all computations reduce to 2D matrix operations efficiently executed on a GPU. Fast learning without overfitting on MNIST is demonstrated.

Driven by the appealing properties of neural fields for storing and communicating 3D data, the problem of directly processing them to address tasks such as classification and part segmentation has emerged and has been investigated in recent works. Early approaches employ neural fields parameterized by shared networks trained on the whole dataset, achieving good task performance but sacrificing reconstruction quality. To improve the latter, later methods focus on individual neural fields parameterized as large Multi-Layer Perceptrons (MLPs), which are, however, challenging to process due to the high dimensionality of the weight space, intrinsic weight space symmetries, and sensitivity to random initialization. Hence, results turn out significantly inferior to those achieved by processing explicit representations, e.g., point clouds or meshes. In the meantime, hybrid representations, in particular based on tri-planes, have emerged as a more effective and efficient alternative to realize neural fields, but their direct processing has not been investigated yet. In this paper, we show that the tri-plane discrete data structure encodes rich information, which can be effectively processed by standard deep-learning machinery. We define an extensive benchmark covering a diverse set of fields such as occupancy, signed/unsigned distance, and, for the first time, radiance fields. While processing a field with the same reconstruction quality, we achieve task performance far superior to frameworks that process large MLPs and, for the first time, almost on par with architectures handling explicit representations.

An experimental demonstration of directivities exceeding the fundamental Kildal limit, a phenomenon called superdirectivity, is provided for spherical high-index dielectric antennas with an electric dipole excitation. A directivity factor of about 10 with a total efficiency of more than 80\% for an antenna having a size of a third of the wavelength was measured. High directivities are shown to be associated with constructive interference of particular electric and magnetic modes of an open spherical resonator. Both analytic solution for a point dipole and a full-wave rigorous simulation for a realistic dipole antenna were employed for optimization and analysis, yielding an excellent agreement between experimentally measured and numerically predicted directivities. The use of high-index low-loss ceramics can significantly reduce the physical size of such antennas while maintaining their overall high radiation efficiency. Such antennas can be attractive for various high-frequency applications, such as antennas for the Internet of things, smart city systems, 5G network systems, and others. The demonstrated concept can be scaled in frequency.

To meet the challenges of high-resolution molecular spectroscopy, increasingly sophisticated spectroscopic techniques were developed. For a long time FTIR and laser-based spectroscopies were used for these studies. The recent development of dual-comb spectroscopy at high-resolution makes this technique a powerful tool for gas phase studies. We report on the use and characterization of the IRis-F1, a tabletop mid-infrared dual-comb spectrometer, in the newly developed step-sweep mode. The resolution of the wavenumber axis is increased by step-wise tuning (interleaving) and accurate measurement of the laser center wavelength and repetition frequency. Doppler limited measurements of N2O and CH4 reveal a wavenumber accuracy of 1E-4 cm-1 on the covered range of > 50 cm-1. Measured half-widths of absorption lines show no systematic broadening, indicating a negligible instrument response function. Finally, measurements of nitrogen pressure broadening coefficients in the v4 band of methane show that quantum cascade laser dual-comb spectroscopy in step-sweep mode is well adapted for measurements of precision spectroscopic data, in particular line shape parameters.

We introduce BeepBank-500, a compact, fully synthetic earcon/alert dataset (300-500 clips) designed for rapid, rights-clean experimentation in human-computer interaction and audio machine learning. Each clip is generated from a parametric recipe controlling waveform family (sine, square, triangle, FM), fundamental frequency, duration, amplitude envelope, amplitude modulation (AM), and lightweight Schroeder-style reverberation. We use three reverberation settings: dry, and two synthetic rooms denoted 'rir small' ('small') and 'rir medium' ('medium') throughout the paper and in the metadata. We release mono 48 kHz WAV audio (16-bit), a rich metadata table (signal/spectral features), and tiny reproducible baselines for (i) waveform-family classification and (ii) f0 regression on single tones. The corpus targets tasks such as earcon classification, timbre analyses, and onset detection, with clearly stated licensing and limitations. Audio is dedicated to the public domain via CC0-1.0; code is under MIT. Data DOI: https://doi.org/10.5281/zenodo.17172015. Code: https://github.com/mandip42/earcons-mini-500.

Standard diffusion corrupts data using Gaussian noise whose Fourier coefficients have random magnitudes and random phases. While effective for unconditional or text-to-image generation, corrupting phase components destroys spatial structure, making it ill-suited for tasks requiring geometric consistency, such as re-rendering, simulation enhancement, and image-to-image translation. We introduce Phase-Preserving Diffusion φ-PD, a model-agnostic reformulation of the diffusion process that preserves input phase while randomizing magnitude, enabling structure-aligned generation without architectural changes or additional parameters. We further propose Frequency-Selective Structured (FSS) noise, which provides continuous control over structural rigidity via a single frequency-cutoff parameter. φ-PD adds no inference-time cost and is compatible with any diffusion model for images or videos. Across photorealistic and stylized re-rendering, as well as sim-to-real enhancement for driving planners, φ-PD produces controllable, spatially aligned results. When applied to the CARLA simulator, φ-PD improves CARLA-to-Waymo planner performance by 50\%. The method is complementary to existing conditioning approaches and broadly applicable to image-to-image and video-to-video generation. Videos, additional examples, and code are available on our https://yuzeng-at-tri.github.io/ppd-page/{project page}.

CNet is a C++/CUDA framework for building deep complex-valued neural networks (CVNNs) and optimizing complex functions by gradient descent with Wirtinger derivatives. Complex models are underexplored yet natural where data is intrinsically complex -- RF/IQ communications, MRI k-space, radar/SAR, audio spectra -- and phase carries information real networks discard. CNet is physics-native: a network is a cascade of complex (often unitary) operations on an amplitude vector, and classification is a Born-rule measurement p_k = |z_k|^2/||z||^2 rather than a softmax over real logits. Its library of complex layers makes conv(x,k) = IFFT(FFT(x).FFT(k)) learnable via signal-processing primitives -- spectral-padding local kernels (Pad), the inverse DFT, a magnitude nonlinearity |z|^2 (CModulus2), holomorphic powers z^M (CPower), and mean pooling (MeanPool) -- with GPU kernels for every layer, a GPU true-Adam optimizer, and a reduced-memory inference mode. Three studies. (1) A fully complex FNet-style causal language model, built on a new O(N log N) causal Fourier mixer, matches a param-matched real-valued causal FNet on tiny-shakespeare in under half the steps. We introduce Born-rule attention: a content-based causal mixer whose weights are quantum-measurement probabilities |<Q_k,K_j>|^2 of one token against another -- the first attention mechanism built on the Born rule. With rotary position embeddings and per-token complex normalization, a fully complex Born-rule model reaches 1.52 nats/char on tiny-shakespeare, matching softmax attention and beating the Fourier mixer by 0.23. (2,3) Two bottleneck analyses -- radio-modulation classification (RML2016.10a) and the Fourier phase problem of coherent-diffraction imaging -- isolate where CVNNs need new operators. The complex machinery learns the correct structure; open problems are concrete and operator-level. Code: https://github.com/crasmarum/CNet

Channel state information (CSI) is essential for adaptive beamforming and maintaining robust links in wireless communication systems. However, acquiring CSI incurs significant overhead, consuming up to 25% of spectrum resources in 5G networks due to frequent pilot transmissions at millisecond-scale intervals. Recent approaches aim to reduce this burden by reconstructing CSI from spatiotemporal RF measurements, such as signal strength and direction-of-arrival. While effective in offline settings, these methods often suffer from inference latencies in the 5-100 ms range, making them impractical for real-time systems. We present GSpaRC: Gaussian Splatting for Real-time Reconstruction of RF Channels, a method that achieves accurate channel reconstruction with latency in the low-millisecond regime or below. GSpaRC represents the RF environment using a compact set of 3D Gaussian primitives, each parameterized by a lightweight neural model augmented with physics-informed features such as distance-based attenuation. Unlike traditional vision-based splatting pipelines, GSpaRC is tailored for RF reception: it employs an equirectangular projection onto a hemispherical surface centered at the receiver to reflect omnidirectional antenna behavior. A custom CUDA pipeline enables fully parallelized directional sorting, splatting, and rendering across frequency and spatial dimensions. Evaluated on multiple RF datasets, GSpaRC achieves similar CSI reconstruction fidelity to recent state-of-the-art methods while reducing training and inference time by over an order of magnitude. These results illustrate that modest GPU computation can substantially reduce pilot overhead, making GSpaRC a scalable low-latency approach for channel estimation in 5G and future wireless systems.

Many machine learning algorithms rely on the Fourier transform, which is also the inner core of many analog computing devices and, specifically, of optical computing. The square of the modulus of the Fourier spectrum naturally maps onto pairwise interactions, as in the renowned Ising model, making it applicable to combinatorial optimization. Here we show how the nonlinear Fourier transform, related to integrable nonlinear partial differential equations, significantly widens the computational capability and also enables a wide variety of computing gates. We study specifically the case of the nonlinear Schrödinger equation; we introduce an input composed by ``tokens'', i.e., batches of information encoded in a multi-step potential, and we show how the nonlinear spectral computing arising in the wave propagation not only generalizes combinatorial optimization to higher order problems, but also realizes boolean gates. In the weakly nonlinear regime, nonlinearity generates higher-order interactions as perturbative corrections to the pairwise terms. In the solitonic regime, the discrete nonlinear spectrum performs digital computation through soliton generation. By using four input tokens, we demonstrate the programmability of all 256 Boolean functions of three variables, including 3-SAT instances. Our results show that integrable nonlinear propagation provides an unprecedented single physical platform for higher-order and logical computation, opening the way to a rich variety of new algorithms for analog computing, machine learning, and classical and quantum information processing.

Developing equivariant neural networks for the E(3) group plays an important role in modeling 3D data across real-world applications. Enforcing this equivariance primarily involves the tensor products of irreducible representations (irreps). However, the computational complexity of such operations increases significantly as higher-order tensors are used. In this work, we propose a systematic approach to substantially accelerate the computation of the tensor products of irreps. We mathematically connect the commonly used Clebsch-Gordan coefficients to the Gaunt coefficients, which are integrals of products of three spherical harmonics. Through Gaunt coefficients, the tensor product of irreps becomes equivalent to the multiplication between spherical functions represented by spherical harmonics. This perspective further allows us to change the basis for the equivariant operations from spherical harmonics to a 2D Fourier basis. Consequently, the multiplication between spherical functions represented by a 2D Fourier basis can be efficiently computed via the convolution theorem and Fast Fourier Transforms. This transformation reduces the complexity of full tensor products of irreps from O(L^6) to O(L^3), where L is the max degree of irreps. Leveraging this approach, we introduce the Gaunt Tensor Product, which serves as a new method to construct efficient equivariant operations across different model architectures. Our experiments on the Open Catalyst Project and 3BPA datasets demonstrate both the increased efficiency and improved performance of our approach.

We present a new method for generating emission spectra from polycyclic aromatic hydrocarbons (PAHs) in arbitrary radiation fields. We utilize the single-photon limit for PAH heating and emission to treat individual photon absorptions as independent events. This allows the construction of a set of single-photon emission "basis spectra" that can be scaled to produce an output emission spectrum given any input heating spectrum. We find that this method produces agreement with PAH emission spectra computed accounting for multi-photon effects to within simeq10% in the 3-20~{rm mu m} wavelength range for radiation fields with intensity U<100. We use this framework to explore the dependence of PAH band ratios on the radiation field spectrum across grain sizes, finding in particular a strong dependence of the 3.3 to 11.2~mum band ratio on radiation field hardness. A Python-based tool and a set of basis spectra that can be used to generate these emission spectra are made publicly available.

This paper makes a formal connection between two families of widely used matrix factorization algorithms in numerical linear algebra. One family consists of the Jacobi eigenvalue algorithm and its variants for computing the Hermitian eigendecomposition and singular value decomposition. The other consists of Gaussian elimination and the Gram-Schmidt procedure with various pivoting rules for computing the Cholesky decomposition and QR decomposition respectively. Both families are cast as special cases of a more general class of factorization algorithms. We provide a randomized pivoting rule that applies to this general class (which differs substantially from the usual pivoting rules for Gaussian elimination / Gram-Schmidt) which results in the same linear rate of convergence for each algorithm, irrespective of which factorization it computes. A second important consequence of this randomized pivoting rule is a provable, effective bound on the numerical stability of the Jacobi eigenvalue algorithm, which addresses a longstanding open problem of Demmel and Veseli\'c `92.

Speech processing algorithms often rely on statistical knowledge of the underlying process. Despite many years of research, however, the debate on the most appropriate statistical model for speech still continues. Speech is commonly modeled as a wide-sense stationary (WSS) process. However, the use of the WSS model for spectrally correlated processes is fundamentally wrong, as WSS implies spectral uncorrelation. In this paper, we demonstrate that voiced speech can be more accurately represented as a cyclostationary (CS) process. By employing the CS rather than the WSS model for processes that are inherently correlated across frequency, it is possible to improve the estimation of cross-power spectral densities (PSDs), source separation, and beamforming. We illustrate how the correlation between harmonic frequencies of CS processes can enhance system identification, and validate our findings using both simulated and real speech data.