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Yue Zhao

Publications and source records attributed to Yue Zhao.

At least 145 records · Page 8Linked to original sources

On the Block-Diagonalization and Multiplicative Equivalence of Quaternion $Z$-Block Circulant Matrices with their Applications

The motivation of this paper is twofold. First, we investigate the block-diagonalization of the $z$-block circulant matrix $\mathtt{bcirc_z}(\mathcal A)$, based on this block-diagonal structure, and develop the algorithm $\mathtt{bcirc_z}$-inv for computing the inverse of $\mathtt{bcirc_z}(\mathcal A)$. Second, we establish the equivalence between the QT-product of tensors and the product of the corresponding $z$-block circulant matrices. Based on this equivalence and in combination with the algorithm $\mathtt{bcirc_z}$-inv, large-scale tests and scalability analysis of the Tikhonov-regularized model are conducted. As a by-product of the analysis, some relevant and straightforward properties of the quaternion $z$-block circulant matrices are provided. As applications, a series of quaternion tensor decompositions under the QT-product and their corresponding $z$-block circulant matrices decompositions are obtained, including the QT-Polar decomposition, the QT-PLU decomposition, and the QT-LU decomposition. Meanwhile, the QT-SVD is rederived based on the relation between $\mathcal A$ and $\mathtt{bcirc_z}(\mathcal A)$. Furthermore, we develop corresponding algorithms and present several large-scale tests and scalability analysis. In addition, applications in video rotation are presented to evaluate several rotation strategies based on the QT-Polar decomposition, which shows the decomposition remains stable and inter-frame consistent while accurately maintaining color reproduction.

math.NA↗

OAT: Ordered Action Tokenization

Autoregressive policies offer a compelling foundation for scalable robot learning by enabling discrete abstraction, token-level reasoning, and flexible inference. However, applying autoregressive modeling to continuous robot actions requires an effective action tokenization scheme. Existing approaches either rely on analytical discretization methods that produce prohibitively long token sequences, or learned latent tokenizers that lack structure, limiting their compatibility with next-token prediction. In this work, we identify three desiderata for action tokenization - high compression, total decodability, and a left-to-right causally ordered token space - and introduce Ordered Action Tokenization (OAT), a learned action tokenizer that satisfies all three. OAT discretizes action chunks into an ordered sequence of tokens using transformer with registers, finite scalar quantization, and ordering-inducing training mechanisms. The resulting token space aligns naturally with autoregressive generation and enables prefix-based detokenization, yielding an anytime trade-off between inference cost and action fidelity. Across more than 20 tasks spanning four simulation benchmarks and real-world settings, autoregressive policies equipped with OAT consistently outperform prior tokenization schemes and diffusion-based baselines, while offering significantly greater flexibility at inference time.

cs.RO↗

DuoGen: Towards General Purpose Interleaved Multimodal Generation

Interleaved multimodal generation enables capabilities beyond unimodal generation models, such as step-by-step instructional guides, visual planning, and generating visual drafts for reasoning. However, the quality of existing interleaved generation models under general instructions remains limited by insufficient training data and base model capacity. We present DuoGen, a general-purpose interleaved generation framework that systematically addresses data curation, architecture design, and evaluation. On the data side, we build a large-scale, high-quality instruction-tuning dataset by combining multimodal conversations rewritten from curated raw websites, and diverse synthetic examples covering everyday scenarios. Architecturally, DuoGen leverages the strong visual understanding of a pretrained multimodal LLM and the visual generation capabilities of a diffusion transformer (DiT) pretrained on video generation, avoiding costly unimodal pretraining and enabling flexible base model selection. A two-stage decoupled strategy first instruction-tunes the MLLM, then aligns DiT with it using curated interleaved image-text sequences. Across public and newly proposed benchmarks, DuoGen outperforms prior open-source models in text quality, image fidelity, and image-context alignment, and also achieves state-of-the-art performance on text-to-image and image editing among unified generation models. Data and code will be released at https://research.nvidia.com/labs/dir/duogen/.

cs.CV↗

CMOOD: Concept-based Multi-label OOD Detection

How can models effectively detect out-of-distribution (OOD) samples in complex, multi-label settings without extensive retraining? Existing OOD detection methods struggle to capture the intricate semantic relationships and label co-occurrences inherent in multi-label settings, often requiring large amounts of training data and failing to generalize to unseen label combinations. While large language models have revolutionized zero-shot OOD detection, they primarily focus on single-label scenarios, leaving a critical gap in handling real-world tasks where samples can be associated with multiple interdependent labels. To address these challenges, we introduce COOD, a novel zero-shot multi-label OOD detection framework. COOD leverages pre-trained vision-language models, enhancing them with a concept-based label expansion strategy and a new scoring function. By enriching the semantic space with both positive and negative concepts for each label, our approach models complex label dependencies, precisely differentiating OOD samples without the need for additional training. Extensive experiments demonstrate that our method significantly outperforms existing approaches, achieving approximately 95% average AUROC on both VOC and COCO datasets, while maintaining robust performance across varying numbers of labels and different types of OOD samples.

cs.CV↗

Fairness or Fluency? An Investigation into Language Bias of Pairwise LLM-as-a-Judge

Recent advances in Large Language Models (LLMs) have incentivized the development of LLM-as-a-judge, an application of LLMs where they are used as judges to decide the quality of a certain piece of text given a certain context. However, previous studies have demonstrated that LLM-as-a-judge can be biased towards different aspects of the judged texts, which often do not align with human preference. One of the identified biases is language bias, which indicates that the decision of LLM-as-a-judge can differ based on the language of the judged texts. In this paper, we study two types of language bias in pairwise LLM-as-a-judge: (1) performance disparity between languages when the judge is prompted to compare options from the same language, and (2) bias towards options written in major languages when the judge is prompted to compare options of two different languages. We find that for same-language judging, there exist significant performance disparities across language families, with European languages consistently outperforming African languages, and this bias is more pronounced in culturally-related subjects. For inter-language judging, we observe that most models favor English answers, and that this preference is influenced more by answer language than question language. Finally, we investigate whether language bias is in fact caused by low-perplexity bias, a previously identified bias of LLM-as-a-judge, and we find that while perplexity is slightly correlated with language bias, language bias cannot be fully explained by perplexity only.

cs.CL↗

MyGram: Modality-aware Graph Transformer with Global Distribution for Multi-modal Entity Alignment

Multi-modal entity alignment aims to identify equivalent entities between two multi-modal Knowledge graphs by integrating multi-modal data, such as images and text, to enrich the semantic representations of entities. However, existing methods may overlook the structural contextual information within each modality, making them vulnerable to interference from shallow features. To address these challenges, we propose MyGram, a modality-aware graph transformer with global distribution for multi-modal entity alignment. Specifically, we develop a modality diffusion learning module to capture deep structural contextual information within modalities and enable fine-grained multi-modal fusion. In addition, we introduce a Gram Loss that acts as a regularization constraint by minimizing the volume of a 4-dimensional parallelotope formed by multi-modal features, thereby achieving global distribution consistency across modalities. We conduct experiments on five public datasets. Results show that MyGram outperforms baseline models, achieving a maximum improvement of 4.8% in Hits@1 on FBDB15K, 9.9% on FBYG15K, and 4.3% on DBP15K.

cs.AI↗

Defenses Against Prompt Attacks Learn Surface Heuristics

Large language models (LLMs) are increasingly deployed in security-sensitive applications, where they must follow system- or developer-specified instructions that define the intended task behavior, while completing benign user requests. When adversarial instructions appear in user queries or externally retrieved content, models may override intended logic. Recent defenses rely on supervised fine-tuning with benign and malicious labels. Although these methods achieve high attack rejection rates, we find that they rely on narrow correlations in defense data rather than harmful intent, leading to systematic rejection of safe inputs. We analyze three recurring shortcut behaviors induced by defense fine-tuning. \emph{Position bias} arises when benign content placed later in a prompt is rejected at much higher rates; across reasoning benchmarks, suffix-task rejection rises from below \textbf{10\%} to as high as \textbf{90\%}. \emph{Token trigger bias} occurs when strings common in attack data raise rejection probability even in benign contexts; inserting a single trigger token increases false refusals by up to \textbf{50\%}. \emph{Topic generalization bias} reflects poor generalization beyond the defense data distribution, with defended models suffering test-time accuracy drops of up to \textbf{40\%}. These findings suggest that current prompt-injection defenses frequently respond to attack-like surface patterns rather than the underlying intent. We introduce controlled diagnostic datasets and a systematic evaluation across two base models and multiple defense pipelines, highlighting limitations of supervised fine-tuning for reliable LLM security.

cs.CR↗

Pulsar Polarization Array Limits on Ultralight Axion-like Dark Matter

We conduct the first-ever Pulsar Polarization Array (PPA) analysis to detect the ultralight Axion-Like Dark Matter (ALDM) using the polarization data of 22 millisecond pulsars from the third data release of Parkes Pulsar Timing Array. As one of the major dark matter candidates, the ultralight ALDM exhibits a pronounced wave nature on astronomical scales and offers a promising solution to small-scale structure issues within local galaxies. While the linearly polarized pulsar light travels through the ALDM galactic halo, its position angle (PA) can be subject to an oscillation induced by the ALDM Chern-Simons coupling with electromagnetic field. The PPA is thus especially suited for detecting the ultralight ALDM by correlating polarization data across the arrayed pulsars. To accomplish this task, we develop an advanced Bayesian analysis framework that allows us to construct pulsar PA residual time series, model noise contributions properly and search for pulsar cross-correlations. We find that for an ALDM density of $ρ_0=0.4\,\textrm{GeV}/\textrm{cm}^3$, the Parkes PPA offers the best global limits on the ALDM Chern-Simons coupling, namely $\lesssim 10^{-13.5}-10^{-12.2}~{\rm GeV}^{-1}$, for the mass range of $10^{-22} - 10^{-21}~{\rm eV}$. The crucial role of pulsar cross-correlation in recognizing the nature of the derived limits is also highlighted.

astro-ph.HE↗

MacVQA: Adaptive Memory Allocation and Global Noise Filtering for Continual Visual Question Answering

Visual Question Answering (VQA) requires models to reason over multimodal information, combining visual and textual data. With the development of continual learning, significant progress has been made in retaining knowledge and adapting to new information in the VQA domain. However, current methods often struggle with balancing knowledge retention, adaptation, and robust feature representation. To address these challenges, we propose a novel framework with adaptive memory allocation and global noise filtering called MacVQA for visual question answering. MacVQA fuses visual and question information while filtering noise to ensure robust representations, and employs prototype-based memory allocation to optimize feature quality and memory usage. These designs enable MacVQA to balance knowledge acquisition, retention, and compositional generalization in continual VQA learning. Experiments on ten continual VQA tasks show that MacVQA outperforms existing baselines, achieving 43.38% average accuracy and 2.32% average forgetting on standard tasks, and 42.53% average accuracy and 3.60% average forgetting on novel composition tasks.

cs.CV↗

A comprehensive search for high-velocity X-ray sources: New compact object binary candidates in the Gaia era

We perform a comprehensive search for high-velocity X-ray sources with large X-ray/optical flux ratios ($F_\mathrm{X}/F_\mathrm{G}$), identifying candidates for interacting black hole or neutron star binaries potentially accelerated by supernova natal kicks. We cross-match X-ray points sources from a variety of catalogues (Chandra, XMM-Newton, Swift and eROSITA) with Gaia DR3. Using Gaia coordinates, parallaxes, and proper motions, we compute peculiar velocities ($\upsilon_\mathrm{pec}$) relative to Galactic disc rotation. Remaining agnostic about radial velocities (RVs), we vary RVs to find the minimum possible $\upsilon_\mathrm{pec}$ values ($\upsilon_\mathrm{pec, min}$). Uncertainties on $\upsilon_\mathrm{pec, min}$ are estimated via Monte Carlo resampling, and we select X-ray sources that have $1\,σ$ lower limits on $\upsilon_\mathrm{pec, min}\geq 200\,\mathrm{km~s^{-1}}$ and high $F_\mathrm{X}/F_\mathrm{G}$ values. We show that this velocity threshold excludes most contaminants (e.g., cataclysmic variables and active binaries) while retaining a sensible fraction of compact object binaries, demonstrating that $\upsilon_\mathrm{pec}$ could serve as an effective indicator for the presence of a neutron star or black hole companion. Our selection yields a sample of 2372 sources, from which we construct a gold sample of 7 sources that have relatively well-constrained astrometry and confident optical counterparts. Follow-up is necessary to confirm and characterise their high-energy emission, as well as a Galactic disc vs. halo origin.

astro-ph.HE↗

Stability for the inverse random potential scattering problem

This paper is concerned with an inverse random potential problem for the Schrödinger equation. The random potential is assumed to be a generalized Gaussian random function, whose covariance operator is a classical pseudo-differential operator. For the direct problem, the meromorphic continuation of the resolvent of the Schrödinger operator with rough potentials is investigated, which yields the well-posedness of the direct scattering problem and a Born series expansion. For the inverse problem, we derive a probabilistic stability estimate for determining the principle symbol of the covariance operator of the random potential. The stability result provides an estimate of the probability for an event when the principle symbol can be quantitatively determined by a single realization of the multi-frequency backscattered far-field pattern. The analysis employs the ergodicity theory and quantitative analytic continuation principle.

math.AP↗

KeenKT: Knowledge Mastery-State Disambiguation for Knowledge Tracing

Knowledge Tracing (KT) aims to dynamically model a student's mastery of knowledge concepts based on their historical learning interactions. Most current methods rely on single-point estimates, which cannot distinguish true ability from outburst or carelessness, creating ambiguity in judging mastery. To address this issue, we propose a Knowledge Mastery-State Disambiguation for Knowledge Tracing model (KeenKT), which represents a student's knowledge state at each interaction using a Normal-Inverse-Gaussian (NIG) distribution, thereby capturing the fluctuations in student learning behaviors. Furthermore, we design an NIG-distance-based attention mechanism to model the dynamic evolution of the knowledge state. In addition, we introduce a diffusion-based denoising reconstruction loss and a distributional contrastive learning loss to enhance the model's robustness. Extensive experiments on six public datasets demonstrate that KeenKT outperforms SOTA KT models in terms of prediction accuracy and sensitivity to behavioral fluctuations. The proposed method yields the maximum AUC improvement of 5.85% and the maximum ACC improvement of 6.89%.

cs.AI↗

Quantifying the Impact of Structured Output Format on Large Language Models through Causal Inference

Structured output from large language models (LLMs) has enhanced efficiency in processing generated information and is increasingly adopted in industrial applications. Prior studies have investigated the impact of structured output on LLMs' generation quality, often presenting one-way findings. Some suggest that structured format enhances completeness and factual accuracy, while others argue that it restricts the reasoning capacity of LLMs and leads to reductions in standard evaluation metrics. Potential limitations of these assessments include restricted testing scenarios, weakly controlled comparative settings, and reliance on coarse metrics. In this work, we present a refined analysis using causal inference. Based on one assumed and two guaranteed constraints, we derive five potential causal structures characterizing the influence of structured output on LLMs' generation: (1) collider without m-bias, (2) collider with m-bias, (3) single cause from instruction, (4) single cause from output format, and (5) independence. Across seven public and one developed reasoning tasks, we find that coarse metrics report positive, negative, or neutral effects of structured output on GPT-4o's generation. However, causal inference reveals no causal impact in 43 out of 48 scenarios. In the remaining 5, 3 involve multifaceted causal structures influenced by concrete instructions. Further experiments show that OpenAI-o3 are more resilient to output formats than general-purpose GPT-4o and GPT-4.1, highlighting an unaware advantage of reasoning models.

cs.CL↗

Spherical Leech Quantization for Visual Tokenization and Generation

Non-parametric quantization has received much attention due to its efficiency on parameters and scalability to a large codebook. In this paper, we present a unified formulation of different non-parametric quantization methods through the lens of lattice coding. The geometry of lattice codes explains the necessity of auxiliary loss terms when training auto-encoders with certain existing lookup-free quantization variants such as BSQ. As a step forward, we explore a few possible candidates, including random lattices, generalized Fibonacci lattices, and densest sphere packing lattices. Among all, we find the Leech lattice-based quantization method, which is dubbed as Spherical Leech Quantization ($Λ_{24}$-SQ), leads to both a simplified training recipe and an improved reconstruction-compression tradeoff thanks to its high symmetry and even distribution on the hypersphere. In image tokenization and compression tasks, this quantization approach achieves better reconstruction quality across all metrics than BSQ, the best prior art, while consuming slightly fewer bits. The improvement also extends to state-of-the-art auto-regressive image generation frameworks.

cs.CV↗

Parsimonious Generative Machine Learning for Non-Gaussian Tail Modeling

The presence of non-Gaussian tails is a prevalent characteristic in many financial modeling scenarios, necessitating the use of complex non-Gaussian distributions such as the generalized beta of the second kind (GB2) and the skewed generalized $t$ (SGT). The approach we propose for modeling heavy-tailed data differs significantly from traditional methods. We utilize generative machine learning, which offers an entirely different paradigm for modeling distributions. A parsimonious nonlinear transformation is applied to a simple base random variable such as Gaussian. The parameters can be estimated effectively, and the theoretical heavy-tail properties are derived. Robust performance is observed with this approach when compared to traditional distributions. More importantly, this method is broadly useful for machine learning due to its mathematical elegance and numerical convenience.

stat.AP↗

Generative Refinement:A New Paradigm for Determining Single Crystal Structures Directly from HKL Data

Single-crystal X-ray diffraction (SC-XRD) is the gold standard technique to characterize crystal structures in solid state. Despite significant advances in automation for structure solution, the refinement stage still depends heavily on expert intervention and subjective judgment, limiting accessibility and scalability. Herein, we introduce RefrActor, an end-to-end deep learning framework that enables crystal structure determination directly from HKL data. By coupling a physics-informed reciprocal-space encoder (ReciEncoder) with a symmetry-aware diffusion-based generator (StruDiffuser), RefrActor produces fully refined atomic models without requiring initial structural guesses or manual input. Comprehensive evaluations on the GenRef-10k benchmark demonstrates that RefrActor achieves low R1-factors across diverse systems, including low-symmetry, light-atom, and heavy-atom crystals. Case studies further confirm that RefrActor can correctly resolve hydrogen positions, elemental assignments, and moderate disorder. This work establishes a new data-driven paradigm for autonomous crystallographic analysis, offering a foundation for fully automated, high-throughput crystal structure determination.

cond-mat.mtrl-sci↗

Common Task Framework For a Critical Evaluation of Scientific Machine Learning Algorithms

Machine learning (ML) is transforming modeling and control in the physical, engineering, and biological sciences. However, rapid development has outpaced the creation of standardized, objective benchmarks - leading to weak baselines, reporting bias, and inconsistent evaluations across methods. This undermines reproducibility, misguides resource allocation, and obscures scientific progress. To address this, we propose a Common Task Framework (CTF) for scientific machine learning. The CTF features a curated set of datasets and task-specific metrics spanning forecasting, state reconstruction, and generalization under realistic constraints, including noise and limited data. Inspired by the success of CTFs in fields like natural language processing and computer vision, our framework provides a structured, rigorous foundation for head-to-head evaluation of diverse algorithms. As a first step, we benchmark methods on two canonical nonlinear systems: Kuramoto-Sivashinsky and Lorenz. These results illustrate the utility of the CTF in revealing method strengths, limitations, and suitability for specific classes of problems and diverse objectives. Next, we are launching a competition around a global real world sea surface temperature dataset with a true holdout dataset to foster community engagement. Our long-term vision is to replace ad hoc comparisons with standardized evaluations on hidden test sets that raise the bar for rigor and reproducibility in scientific ML.

cs.CE↗

Charts Are Not Images: On the Challenges of Scientific Chart Editing

Generative models, such as diffusion and autoregressive approaches, have demonstrated impressive capabilities in editing natural images. However, applying these tools to scientific charts rests on a flawed assumption: a chart is not merely an arrangement of pixels but a visual representation of structured data governed by a graphical grammar. Consequently, chart editing is not a pixel-manipulation task but a structured transformation problem. To address this fundamental mismatch, we introduce \textit{FigEdit}, a large-scale benchmark for scientific figure editing comprising over 30,000 samples. Grounded in real-world data, our benchmark is distinguished by its diversity, covering 10 distinct chart types and a rich vocabulary of complex editing instructions. The benchmark is organized into five distinct and progressively challenging tasks: single edits, multi edits, conversational edits, visual-guidance-based edits, and style transfer. Our evaluation of a range of state-of-the-art models on this benchmark reveals their poor performance on scientific figures, as they consistently fail to handle the underlying structured transformations required for valid edits. Furthermore, our analysis indicates that traditional evaluation metrics (e.g., SSIM, PSNR) have limitations in capturing the semantic correctness of chart edits. Our benchmark demonstrates the profound limitations of pixel-level manipulation and provides a robust foundation for developing and evaluating future structure-aware models. By releasing \textit{FigEdit} (https://github.com/adobe-research/figure-editing), we aim to enable systematic progress in structure-aware figure editing, provide a common ground for fair comparison, and encourage future research on models that understand both the visual and semantic layers of scientific charts.

cs.CV↗