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555 recordsLinked to original sources
arXiv2026

LitCurate: A Configuration-Driven AI-Assisted Framework for Scientific Database Construction with an Application to Lower-Mantle Equation-of-State Data

The growing scientific literature contains decades of experimental and computational results that could support data-driven and physics-based modeling, yet much of this infor- mation remains locked in publications and is not readily usable for large-scale analysis or sci- entific software. Building structured databases from the literature is particularly challenging whenrelevantstudiesmustfirstbediscoveredamonglargecollectionsofpapersandreported quantities must be extracted with enough scientific context to remain usable. We present LitCurate, an open-source framework for building scientific databases from the literature using large language models within an auditable, stage-wise curation workflow. LitCurate integratesliteraturediscovery, relevancescreening, full-textprocessing, andstructuredinfor- mation extraction while retaining intermediate results and provenance, allowing researchers to inspect and revise individual stages rather than treating automated curation as a black- box process. We apply LitCurate to construct an equation-of-state database of lower-mantle and lower-mantle-relevant high-pressure mineral phases from experimental and theoretical studies, comprising 1,334 entries from 205 papers. The resulting dataset links reported equation-of-state parameters to mineral phases, compositions, equation formulations, meth- ods, and parameter constraints, and labels values as source-reported or citation-reported when provenance can be determined. The records are available through a searchable web application. By connecting scientific literature to traceable, machine-readable data, LitCu- rate provides a reusable approach for transforming accumulated literature into resources for scientific analysis and computational modeling.

cs.IR↗
arXiv2026

A Reproducible Method for Mapping Electricity Transmission Infrastructure for Space Weather Risk Assessment

Space weather risk assessment is constrained by the lack of available asset information needed to model geomagnetically induced currents (GICs) in electricity transmission infrastructure. We propose a systematic method that enables risk analysts to collect their own open-source substation data. Using a web browser platform for annotation, we convert OpenStreetMap (OSM) substation locations into high-resolution, component-level mappings of electricity transmission assets. We convert an initial 1,313 high-voltage (>=230 kV) substations to 52,273 components using low-altitude, satellite, and Street View imagery accessed through Google Earth, identifying 7,949 transformers. Compared to the OSM baseline, this approach provides detailed insights on voltage levels and substation configurations. We then construct a geospatial GIC network for the Tennessee Valley Authority (TVA) region, comparing May 2024 results with the University of Illinois Urbana-Champaign 150-bus (UIUC150) synthetic network and with measured ground GICs at 13 monitoring devices. The transformer types at unannotated substations and the grounding resistances are unknown, so we sample both across a Monte Carlo ensemble. This gives a median TVA 95th-percentile peak ground GIC of 29.1 A, with a 90 percent confidence interval of 23.9-36.1 A. The UIUC150 network yields a 95th-percentile peak ground GIC of 35.8 A under the same forcing, falling within this interval, and the modeled time series broadly capture the temporal morphology of the geomagnetic storm at the monitoring sites. This method shows promise for spatially explicit, screening-level GIC assessment without requiring access to operator data.

physics.geo-ph↗
arXiv2026

GAFT: Geo-Anchored Fine-Tuning for Hazard Identification from Rare Failures

Off-road navigation can fail when physical structures induce irrecoverable states such as high-centering or entrapment, requiring human interventions. Identifying these structures is crucial, yet challenging. Such failure events are rare and costly to collect, resulting in limited training data. Moreover, the collected data associate frames with outcomes, but do not indicate the visual cues responsible for the failure. Learning directly from these data can therefore exploit scenario-specific visual cues, leading to poor generalization. We propose \textbf{Geo-Anchored Fine-Tuning (GAFT)}, a parameter-efficient method that adapts a vision foundation model with a geometry-derived prior. It guides LoRA adaptation by aligning a spatial attention-rollout map with the geometry prior, while preserving pretrained representations. On an intervention-verified forest hazard benchmark, across ten independently trained adaptations, GAFT consistently outperforms frozen DINOv2 and supervised PEFT baselines, improving the repeated leave-one-scenario-out mean $F_2$ from 0.0607 to 0.3757 with statistical significance under paired analysis. Within these independently trained models, the best-performing GAFT model achieves a repeated-LOSO $F_2$ of 0.570. Code and benchmark: https://github.com/Xu-Yanran/geo_anchored_fine_tuning

cs.RO↗
arXiv2026

Geometric integrators for adiabatically closed simple thermodynamic systems

A variational formulation for non-equilibrium thermodynamics was developed by Gay-Balmaz and Yoshimura. In a recent article, the first two authors of the present paper introduced partially cosymplectic structures as a geometric framework for thermodynamic systems, recovering the evolution equations obtained variationally. In this paper, we develop a discrete variational principle for adiabatically closed simple thermodynamic systems, which can be utilised to construct numerical integrators for the dynamics of such systems. The effectiveness of our method is illustrated with several examples.

math-ph↗
arXiv2026

Why Multi-Layer Message Passing Works: Completeness Theory for Graph Neural Network Interatomic Potentials

We prove that the Hypergraph Neural Network, an invariant architecture with 3-body message passing, is a universal approximator for potential energy surfaces. Our main contribution is a multi-layer completeness theory. We show that $L$ layers of message passing on sparse, cutoff-based graphs achieve the same representational power as having access to the full $L$-hop neighborhood, provided the configurations are generic, satisfy an overlap condition and a connectivity condition. This provides the first rigorous justification for the common practice of using multi-layer message passing with a per-layer cutoff smaller than the physical interaction range, the setting used by virtually all practical graph neural network based machine-learned interatomic potentials. As immediate consequences, we show that both DPA3 and CHGNet architectures inherit universal approximation.

cs.LG↗
arXiv2026

Counter-GEO-Bench: Evaluating Defenses Against Information-Distorting Generative Engine Optimization

Generative engine optimization (GEO) enables content producers to increase the visibility of their web pages in generative search engines, but the same techniques can deliver targeted misinformation when adversaries publish ordinary-looking GEO-optimized documents that victim large language models (LLMs) retrieve and synthesize into distorted answers. No existing benchmark evaluates defenses against this threat under controlled conditions. Therefore, we present Counter-GEO-Bench, a defense benchmark that pairs 247 human-verified, quality-gated queries with information-preserving and information-distorting GEO rewrites, and evaluates defenses on attack success rate (ASR), false positive rate, and answer quality across three victim LLMs. Under Counter-GEO-Bench, three off-the-shelf defenses (Granite Guardian, Llama Guard 3, and NeMo Self-Check Fact-Checking) reduce ASR by at most 5.7% relative, while Granite Guardian's reduction is not statistically significant. Safety-taxonomy guardrails target policy violations, while GEO misinformation passes through them as fluent informational content. To this end, a lightweight benchmark baseline, C-GEO Guard, is proposed, reducing ASR by 47.6% relative with near-zero utility loss, which proves threat tractable.

cs.IR↗
arXiv2026

Pixel-wise Geo-registration of Drone and Satellite Images

Pixel-level cross-view geo-registration aims to align a query image (e.g., drone) to a geo-referenced satellite map so that every query pixel can be mapped to real-world GPS coordinates. Despite strong progress in cross-view geo-localization, existing benchmarks largely provide only GPS labels, limiting evaluation to a single coordinate per image and leaving dense geodetic alignment underexplored. We introduce SkyReg, a dataset and standardized benchmark for pixel-level drone-to-satellite geo-registration, providing dense per-pixel geo-location supervision across diverse settings (orthographic and perspective), scene types (urban, landmark-centric, suburban/rural), and camera configurations. Using SkyReg, we evaluate a broad set of baselines spanning retrieval, feature matching, homography-based alignment, and feed-forward 3D reconstruction. Finally, cross-view pairs from SkyReg, we train a geometry-aware reconstruction pipeline that achieves state-of-the-art results,improving performance by a significant margin.

cs.CV↗
arXiv2026

Perceive to Hypothesize, Verify to Ground: An Agentic Reasoning Framework for Open-World Geo-Localization

Open-world geo-localization requires models to reason over ambiguous visual cues through multi-step reasoning and external knowledge grounding. While recent large vision-language models exhibit strong multimodal reasoning capabilities, existing approaches still suffer from perceptual hallucination and context drift due to the lack of explicit evidence-grounded verification. In this work, we reformulate geo-localization as a human-like perceive-then-verify reasoning problem and propose GeoPAVE (Geo-localization Perception-and-Verification-Engine), a bi-level agentic framework that contains perception-based hypothesis generation via single-pass rollouts and verification-based evidence grounding for decision actions: support, refute, and refine. To support rigorous evaluation, we further introduce PAVED, a novel dataset derived from real-world user check-in data, equipped with comprehensive reasoning trajectories featuring multi-hop queries, multi-round tool invocations, and structured perception-verification traces. The dataset and code are available at https://github.com/Arandinglv/GeoPAVE.

cs.AI↗
arXiv2026

Physics-informed learning for the inverse problem in resonant ultrasound spectroscopy

Inferring elastic constants from resonant ultrasound spectra is a nonlinear and typically overdetermined inverse problem based on finite spectral data. We formulate the Rayleigh-Ritz inverse problem as a constrained inverse-isospectral problem on the set of physically admissible elasticity tensors. This induces effective low-dimensional variables for the inverse map on the admissible elasticity manifold: length and elastic scales, aspect-ratio coordinates, scale-free spectral features, and stability-respecting elastic ratios. We use these variables to construct a physics-informed learning pipeline in which a regression model acts only on reduced spectral and geometric features, while scale recovery and final elastic-constant reconstruction are imposed analytically. For the full cubic benchmark, the reconstructed constants have MAE values of $20.37(35.15)$, $24.30(41.33)$, and $2.13(3.66)~\mathrm{GPa}$ for $C_{11}$, $C_{12}$, and $C_{44}$. In the fixed-geometry benchmark, the corresponding cubic MAPE values are $4.14(3.87)\%$, $8.31(8.50)\%$, and $2.44(2.86)\%$, while the isotropic values are $4.0(3.6)\%$ and $0.4(0.3)\%$ for the bulk and shear moduli. The inverse problem then becomes a constrained regression problem in variables adapted to the geometry, scaling, crystal symmetry, and thermodynamic stability of Hookean elasticity.

cond-mat.mtrl-sci↗
arXiv2026

A brief history of quantum vs classical computational advantage

In this review article we summarize all experiments claiming quantum computational advantage to date. Our review highlights challenges, loopholes, and refutations appearing in subsequent work to provide a complete picture of the current statuses of these experiments. In addition, we also discuss theoretical computational advantage in example problems such as approximate optimization and recommendation systems. Finally, we review recent experiments in quantum error correction -- the biggest frontier to reach experimental quantum advantage in Shor's algorithm.

quant-ph↗
arXiv2026

Coordinate-Residual Physics-Driven Neural Network for Inverse Scattering Imaging

Electromagnetic inverse scattering is a nonlinear and ill-posed computational imaging problem, where accurate reconstruction is challenging due to measurement limitations, noise, and high computational costs, especially for 3-D imaging. Although physics-driven neural networks (PDNNs) reduce the dependence on labeled training data, existing accelerated PDNN frameworks often rely on preliminary reconstruction-based region selection, which may introduce instability when the selected region is inaccurate. In this paper, a coordinate-residual physics-driven neural network (CRPDNN) is proposed for 3-D electromagnetic inverse scattering. CRPDNN represents the unknown complex contrast distribution using normalized spatial coordinates and a residual convolutional network, whose parameters are optimized by enforcing consistency between the measured and model-predicted scattered fields. Unlike existing subregion-accelerated PDNN approaches, CRPDNN does not require a preliminary reconstruction, thereby avoiding dependence on its accuracy. For the reported noise-free 3-D synthetic cases, CRPDNN achieves an average relative error of 2.10\%, compared with 7.97\% for CSI and 3.99\% for $L_{2/3}$-FBE-WCIE, while providing approximately 5.5- and 12.1-fold speedups over the two baselines, respectively. Additional 2-D comparisons further demonstrate its stability and computational efficiency relative to existing PDNN frameworks. CRPDNN also maintains reliable reconstruction performance under noisy measurements, and the 3-D Fresnel experiments further indicate its potential for practical imaging applications.

physics.comp-ph↗
arXiv2026

Physics-Guided Concentration Inference from Resistance Transients in a Mixed-Phase SnO-SnO$_2$ Carbon Monoxide Sensor with p-n Switching

This work presents a physics-guided machine-learning framework for carbon monoxide concentration inference from experimentally measured resistance transients of a mixed-phase SnO-SnO$_2$ material gas sensor exhibiting temperature-dependent p-n switching behavior. Cycle-level transient responses are represented through physically interpretable descriptors and complemented by compact fast Fourier transform (FFT) and discrete wavelet transform (DWT)-based summaries. Using leakage-aware grouped cross-validation, we study both multi-class concentration classification and continuous concentration regression for the p-type and n-type sensing regimes separately. Across both regimes, fused features provide the strongest overall performance, while the physics-guided descriptor block remains highly competitive, indicating that the dominant concentration information is already encoded in physically meaningful transient dynamics. The p-type branch shows the best concentration-class discrimination, with the fused Random Forest classifier reaching approximately $96.5\%$ accuracy, whereas the n-type branch yields the best quantitative concentration estimation, with the fused Random Forest regressor achieving an MAE$\approx 1.48$ ppm and an R$^2$ $\approx 0.992$. These results reveal a clear dual-regime behavior: p-type sensing is particularly favorable for classification, whereas n-type sensing is more favorable for high-fidelity regression. More broadly, the study demonstrates that leakage-aware, cycle-level, physics-guided machine learning can extend conventional gas-sensing analysis beyond single-response metrics while preserving physical interpretability

physics.chem-ph↗
arXiv2026

Convergence and efficiency proof of quantum imaginary time evolution for bounded order systems

Many current and near-future applications of quantum computing utilise parametric families of quantum circuits and variational methods that can suffer from obstacles including non-convergence to the global minimum due to local minima, critical slowing down, or exponential resource scaling. Here we show that quantum imaginary time evolution can overcome these obstacles if the underlying physical system satisfies a set of conditions. This includes many relevant applications such as ground state preparation for local theories in physics or chemistry, combinatorial optimisation problems, or quantum machine learning. In particular, we analyse the quantum imaginary time evolution showing convergence guarantees to the global minimum without critical slowing down and providing a priori estimates on the required evolution time which scale linearly in system size and inverse energy gap. Furthermore, a provided complexity analysis shows that quantum imaginary time evolution can be efficiently compiled into a parametric quantum circuit, finding the optimal parameters included, for a large class of physically relevant problems.

quant-ph↗
arXiv2026

Constrained dynamics for searching saddle points on embedded Riemannian submanifolds of Euclidean space

Finding constrained saddle points on embedded Riemannian submanifolds of Euclidean space is significant for analyzing energy landscapes arising in physics and chemistry. Existing works exploit explicit global/local regular level-set representations of manifolds, which may be unavailable or computationally inconvenient for manifolds represented through, e.g., projectors, factorizations, or rank constraints. In this paper, we develop a constrained saddle dynamic based on embedded-submanifold geometric primitives, completely avoiding the use of explicit representations. In particular, our dynamic is formulated compactly on the Grassmann bundle of the tangent bundle. By analyzing the Grassmann bundle geometry, we rigorously establish the local linear stability of the dynamic and the local linear convergence of the resulting algorithms. Remarkably, our analysis provides the first iterate convergence result for discretized algorithms to saddle points of prescribed indices in embedded-submanifold settings. Moreover, by virtue of the Grassmann bundle formulation, we remove unnecessary nondegeneracy assumptions on the eigenvalues of the Riemannian Hessian that are present in existing works. We also point out that locating saddle points can be more ill-conditioned than finding local minimizers, and requires using nonredundant parametrizations. Finally, numerical experiments on linear eigenvalue problems and electronic excited-state calculations showcase the effectiveness of the proposed algorithms and corroborate the established local theory.

math.NA↗
arXiv2026

Polarizable atomic multipoles for learning long-range electrostatics

Long-range electrostatics and polarization remain central obstacles to extending machine learning interatomic potentials (MLIPs) to ionic, polar, and interfacial systems. Here we introduce a semi-local framework for learning electrostatics from energies and forces using polarizable atomic multipoles. Local equivariant descriptors predict environment-dependent latent monopoles, dipoles, and quadrupoles, while residual non-local charge transfer and polarization are captured by non-self-consistent linear response in induced charges and dipoles. Across four diverse benchmarks and four short-range MLIP architectures, the multipole hierarchy and response terms systematically improve potential energy surface accuracy, with the largest gains in systems where long-range effects are essential. More importantly, physically meaningful electrical responses emerge without direct supervision. The learned latent multipoles yield accurate Born effective charge tensors and infrared spectra in close agreement with experiments. The induced-dipole extension introduces new capabilities: it predicts polarizabilities and thereby enables semi-quantitative Raman spectra for bulk water and hybrid MAPbI$_3$ perovskite, as well as the essential features of the surface-specific vibrational sum-frequency generation spectrum at the water-air interface. In ferroelectric HfO$_2$, the predicted electrical response also captures LO-TO splitting and polarization switching. This systematically improvable, physically transparent framework enables MLIPs trained on standard energy and force labels to predict polarization-sensitive observables.

cond-mat.mtrl-sci↗
arXiv2026

Diffusion-Based Inverse Design of Dielectric Resonator Metasurfaces for Shaping Smart Electromagnetic Environments

Future wireless systems are expected to transform the surrounding space from a passive propagation medium into a smart electromagnetic environment, where engineered surfaces control wave propagation, support wireless sensing, and create programmable electromagnetic fingerprints. A key challenge in realizing this vision is the inverse design of metasurfaces for tailored electromagnetic propagation. While forward analysis evaluates the response of a known geometry, the inverse task starts from a prescribed scattering signature and seeks a physically realizable structure that produces it. This inverse task is inherently nonlinear and often high-dimensional, while candidate solutions may be non-unique and provide no direct indication of practical realizability. Here, we introduce a conditional diffusion framework for inverse design of dielectric resonator metasurfaces from target angular scattering patterns. Trained on T-matrix simulated geometry-response pairs, the model learns a conditional distribution of geometries instead of a deterministic mapping, enabling multiple candidate designs for the ill-posed inverse problem. The best generated metasurface achieves a mean percentage error of 1.39%, outperforming CMA-ES optimization (4.1% after 10 h) while requiring only about one minute for after-training inference. The model also produces lower error distributions than deterministic neural baselines for out-of-distribution spectra, highlighting the potential of diffusion models for efficient metasurface design.

cs.LG↗
arXiv2026

Classification Drives Geographic Bias in Street Scene Segmentation

Previous studies showed that image datasets lacking geographic diversity can lead to biased performance in models trained on them. While earlier work studied general-purpose image datasets (e.g., ImageNet) and simple tasks like image recognition, we investigated geo-biases in real-world driving datasets on a more complex task: instance segmentation. We examined if instance segmentation models trained on European driving scenes (Eurocentric models) are geo-biased. Consistent with previous work, we found that Eurocentric models were geo-biased. Interestingly, we found that geo-biases came from classification errors rather than localization errors, with classification errors alone contributing 10-90% of the geo-biases in segmentation and 19-88% of the geo-biases in detection. This showed that while classification is geo-biased, localization (including detection and segmentation) is geographically robust. Our findings show that in region-specific models (e.g., Eurocentric models), geo-biases from classification errors can be significantly mitigated by using coarser classes (e.g., grouping car, bus, and truck as 4-wheeler).

cs.CV↗