arXiv subjects

Yuxuan Gu

Publications and source records attributed to Yuxuan Gu.

At least 37 records · Page 2Linked to original sources

arXiv2026

Learning Pore-scale Multiphase Flow from 4D Velocimetry

Multiphase flow in porous media underpins subsurface energy and environmental technologies, including geological CO$_2$ storage and underground hydrogen storage, yet pore-scale dynamics in realistic three-dimensional materials remain difficult to characterize and predict. Here we introduce a multimodal learning framework that infers multiphase pore-scale flow directly from time-resolved four-dimensional (4D) micro-velocimetry measurements. The model couples a graph network simulator for Lagrangian tracer-particle motion with a 3D U-Net for voxelized interface evolution. The imaged pore geometry serves as a boundary constraint to the flow velocity and the multiphase interface predictions, which are coupled and updated iteratively at each time step. Trained autoregressively on experimental sequences in capillary-dominated conditions ($Ca\approx10^{-6}$), the learned surrogate captures transient, nonlocal flow perturbations and abrupt interface rearrangements (Haines jumps) over rollouts spanning seconds of physical time, while reducing hour-to-day--scale direct numerical simulations to seconds of inference. By providing rapid, experimentally informed predictions, the framework opens a route to ''digital experiments'' to replicate pore-scale physics observed in multiphase flow experiments, offering an efficient tool for exploring injection conditions and pore-geometry effects relevant to subsurface carbon and hydrogen storage.

cs.LG↗

arXiv2026

Bootstrapping Exploration with Group-Level Natural Language Feedback in Reinforcement Learning

Large language models (LLMs) typically receive diverse natural language (NL) feedback through interaction with the environment. However, current reinforcement learning (RL) algorithms rely solely on scalar rewards, leaving the rich information in NL feedback underutilized and leading to inefficient exploration. In this work, we propose GOLF, an RL framework that explicitly exploits group-level language feedback to guide targeted exploration through actionable refinements. GOLF aggregates two complementary feedback sources: (i) external critiques that pinpoint errors or propose targeted fixes, and (ii) intra-group attempts that supply alternative partial ideas and diverse failure patterns. These group-level feedbacks are aggregated to produce high-quality refinements, which are adaptively injected into training as off-policy scaffolds to provide targeted guidance in sparse-reward regions. Meanwhile, GOLF jointly optimizes generation and refinement within a unified RL loop, creating a virtuous cycle that continuously improves both capabilities. Experiments on both verifiable and non-verifiable benchmarks show that GOLF achieves superior performance and exploration efficiency, achieving 2.2$\times$ improvements in sample efficiency compared to RL methods trained solely on scalar rewards. Code is available at https://github.com/LuckyyySTA/GOLF.

cs.CL↗

arXiv2026

PERSONA: Dynamic and Compositional Inference-Time Personality Control via Activation Vector Algebra

Current methods for personality control in Large Language Models rely on static prompting or expensive fine-tuning, failing to capture the dynamic and compositional nature of human traits. We introduce PERSONA, a training-free framework that achieves fine-tuning level performance through direct manipulation of personality vectors in activation space. Our key insight is that personality traits appear as extractable, approximately orthogonal directions in the model's representation space that support algebraic operations. The framework operates through three stages: Persona-Base extracts orthogonal trait vectors via contrastive activation analysis; Persona-Algebra enables precise control through vector arithmetic (scalar multiplication for intensity, addition for composition, subtraction for suppression); and Persona-Flow achieves context-aware adaptation by dynamically composing these vectors during inference. On PersonalityBench, our approach achieves a mean score of 9.60, nearly matching the supervised fine-tuning upper bound of 9.61 without any gradient updates. On our proposed Persona-Evolve benchmark for dynamic personality adaptation, we achieve up to 91% win rates across diverse model families. These results provide evidence that aspects of LLM personality are mathematically tractable, opening new directions for interpretable and efficient behavioral control.

cs.AI↗

arXiv2025

From Hypothesis to Publication: A Comprehensive Survey of AI-Driven Research Support Systems

Research is a fundamental process driving the advancement of human civilization, yet it demands substantial time and effort from researchers. In recent years, the rapid development of artificial intelligence (AI) technologies has inspired researchers to explore how AI can accelerate and enhance research. To monitor relevant advancements, this paper presents a systematic review of the progress in this domain. Specifically, we organize the relevant studies into three main categories: hypothesis formulation, hypothesis validation, and manuscript publication. Hypothesis formulation involves knowledge synthesis and hypothesis generation. Hypothesis validation includes the verification of scientific claims, theorem proving, and experiment validation. Manuscript publication encompasses manuscript writing and the peer review process. Furthermore, we identify and discuss the current challenges faced in these areas, as well as potential future directions for research. Finally, we also offer a comprehensive overview of existing benchmarks and tools across various domains that support the integration of AI into the research process. We hope this paper serves as an introduction for beginners and fosters future research. Resources have been made publicly available at https://github.com/zkzhou126/AI-for-Research.

cs.AI↗

arXiv2025

Context-Aware Hierarchical Taxonomy Generation for Scientific Papers via LLM-Guided Multi-Aspect Clustering

The rapid growth of scientific literature demands efficient methods to organize and synthesize research findings. Existing taxonomy construction methods, leveraging unsupervised clustering or direct prompting of large language models (LLMs), often lack coherence and granularity. We propose a novel context-aware hierarchical taxonomy generation framework that integrates LLM-guided multi-aspect encoding with dynamic clustering. Our method leverages LLMs to identify key aspects of each paper (e.g., methodology, dataset, evaluation) and generates aspect-specific paper summaries, which are then encoded and clustered along each aspect to form a coherent hierarchy. In addition, we introduce a new evaluation benchmark of 156 expert-crafted taxonomies encompassing 11.6k papers, providing the first naturally annotated dataset for this task. Experimental results demonstrate that our method significantly outperforms prior approaches, achieving state-of-the-art performance in taxonomy coherence, granularity, and interpretability.

cs.CL↗

arXiv2025

Adaptive Backtracking for Privacy Protection in Large Language Models

The preservation of privacy has emerged as a critical topic in the era of artificial intelligence. However, current work focuses on user-oriented privacy, overlooking severe enterprise data leakage risks exacerbated by the Retrieval-Augmented Generation paradigm. To address this gap, our paper introduces a novel objective: enterprise-oriented privacy concerns. Achieving this objective requires overcoming two fundamental challenges: existing methods such as data sanitization severely degrade model performance, and the field lacks public datasets for evaluation. We address these challenges with several solutions. (1) To prevent performance degradation, we propose ABack, a training-free mechanism that leverages a Hidden State Model to pinpoint the origin of a leakage intention and rewrite the output safely. (2) To solve the lack of datasets, we construct PriGenQA, a new benchmark for enterprise privacy scenarios in healthcare and finance. To ensure a rigorous evaluation, we move beyond simple static attacks by developing a powerful adaptive attacker with Group Relative Policy Optimization. Experiments show that against this superior adversary, ABack improves the overall privacy utility score by up to 15\% over strong baselines, avoiding the performance trade-offs of prior methods.

cs.CR↗

arXiv2025

TensorLLM: Tensorising Multi-Head Attention for Enhanced Reasoning and Compression in LLMs

The reasoning abilities of Large Language Models (LLMs) can be improved by structurally denoising their weights, yet existing techniques primarily focus on denoising the feed-forward network (FFN) of the transformer block, and can not efficiently utilise the Multi-head Attention (MHA) block, which is the core of transformer architectures. To address this issue, we propose a novel intuitive framework that, at its very core, performs MHA compression through a multi-head tensorisation process and the Tucker decomposition. This enables both higher-dimensional structured denoising and compression of the MHA weights, by enforcing a shared higher-dimensional subspace across the weights of the multiple attention heads. We demonstrate that this approach consistently enhances the reasoning capabilities of LLMs across multiple benchmark datasets, and for both encoder-only and decoder-only architectures, while achieving compression rates of up to $\sim 250$ times in the MHA weights, all without requiring any additional data, training, or fine-tuning. Furthermore, we show that the proposed method can be seamlessly combined with existing FFN-only-based denoising techniques to achieve further improvements in LLM reasoning performance.

cs.CL↗

arXiv2025

FACT-AUDIT: An Adaptive Multi-Agent Framework for Dynamic Fact-Checking Evaluation of Large Language Models

Large Language Models (LLMs) have significantly advanced the fact-checking studies. However, existing automated fact-checking evaluation methods rely on static datasets and classification metrics, which fail to automatically evaluate the justification production and uncover the nuanced limitations of LLMs in fact-checking. In this work, we introduce FACT-AUDIT, an agent-driven framework that adaptively and dynamically assesses LLMs' fact-checking capabilities. Leveraging importance sampling principles and multi-agent collaboration, FACT-AUDIT generates adaptive and scalable datasets, performs iterative model-centric evaluations, and updates assessments based on model-specific responses. By incorporating justification production alongside verdict prediction, this framework provides a comprehensive and evolving audit of LLMs' factual reasoning capabilities, to investigate their trustworthiness. Extensive experiments demonstrate that FACT-AUDIT effectively differentiates among state-of-the-art LLMs, providing valuable insights into model strengths and limitations in model-centric fact-checking analysis.

cs.CL↗

arXiv2025

Improving Contextual Faithfulness of Large Language Models via Retrieval Heads-Induced Optimization

Ensuring contextual faithfulness in retrieval-augmented large language models (LLMs) is crucial for building trustworthy information-seeking systems, particularly in long-form question-answering (LFQA) scenarios. In this work, we identify a salient correlation between LFQA faithfulness and retrieval heads, a set of attention heads responsible for retrieving contextual information. Leveraging this insight, we propose RHIO, a framework designed to teach LLMs to explicitly discriminate between faithful and unfaithful generations. RHIO first augments unfaithful samples that simulate realistic model-intrinsic errors by selectively masking retrieval heads. Then, these samples are incorporated into joint training, enabling the model to distinguish unfaithful outputs from faithful ones conditioned on control tokens. Furthermore, these control tokens are leveraged to self-induce contrastive outputs, amplifying their difference through contrastive decoding. Additionally, to facilitate the evaluation of contextual faithfulness, we also introduce GroundBench, a comprehensive benchmark compiled from five existing LFQA datasets. Extensive experimental results on GroundBench demonstrate that RHIO significantly improves faithfulness, even outperforming GPT-4o.

cs.CL↗

arXiv2024

Length Controlled Generation for Black-box LLMs

Large language models (LLMs) have demonstrated impressive instruction following capabilities, while still struggling to accurately manage the length of the generated text, which is a fundamental requirement in many real-world applications. Existing length control methods involve fine-tuning the parameters of LLMs, which is inefficient and suboptimal for practical use. In this paper, we propose a novel iterative sampling framework for text length control, integrating the Metropolis-Hastings algorithm with an importance sampling acceleration strategy. This framework efficiently and reliably regulates LLMs to generate length-constrained text without modifying the underlying parameters, thereby preserving the original capabilities of LLMs. Experimental results demonstrate that our framework achieves almost 100\% success rates of length control on Llama3.1 for tasks such as length-controlled abstractive summarization and length-constrained instruction following, with minimal additional computational overhead. This also highlights the significant potential of our method for precise length control across a broader range of applications, without compromising the versatility of LLMs.

cs.CL↗

arXiv2024

Optimal Energy Dispatch of Grid-Connected Electric Vehicle Considering Lithium Battery Electrochemical Model

The grid-connected electric vehicles (EVs) serve as a promising regulating resource in the distribution grid with Vehicle-to-Grid (V2G) facilities. In the day-ahead stage, electric vehicle batteries (EVBs) need to be precisely dispatched and controlled to ensure high efficiency and prevent degradation. This article focuses on considering a refined battery model, i.e. the electrochemical model (EM), in the optimal dispatch of the local energy system with high penetration of EVs which replenish energy through V2G-equipped charge station and battery swapping station (BSS). In this paper, to utilize the EM efficiently, recursive EVB constraints and a corresponding matrix-based state update method are proposed based on EM power characterization. The charging EV state distribution is profiled and a multi-layer BSS model along with binary aggregation is proposed, in order to overcome the computation complexity of combining the refined battery constraints with the mixed integer optimization. Finally, a local energy system scenario is investigated for evaluation. The efficiency and effectiveness of EM consideration are assessed from the perspective of both the system and battery.

eess.SY↗

arXiv2024

Learning Pore-scale Multi-phase Flow from Experimental Data with Graph Neural Network

Understanding the process of multiphase fluid flow through porous media is crucial for many climate change mitigation technologies, including CO$_2$ geological storage, hydrogen storage, and fuel cells. However, current numerical models are often incapable of accurately capturing the complex pore-scale physics observed in experiments. In this study, we address this challenge using a graph neural network-based approach and directly learn pore-scale fluid flow using micro-CT experimental data. We propose a Long-Short-Edge MeshGraphNet (LSE-MGN) that predicts the state of each node in the pore space at each time step. During inference, given an initial state, the model can autoregressively predict the evolution of the multiphase flow process over time. This approach successfully captures the physics from the high-resolution experimental data while maintaining computational efficiency, providing a promising direction for accurate and efficient pore-scale modeling of complex multiphase fluid flow dynamics.

physics.flu-dyn↗

arXiv2024

Discrete Modeling via Boundary Conditional Diffusion Processes

We present an novel framework for efficiently and effectively extending the powerful continuous diffusion processes to discrete modeling. Previous approaches have suffered from the discrepancy between discrete data and continuous modeling. Our study reveals that the absence of guidance from discrete boundaries in learning probability contours is one of the main reasons. To address this issue, we propose a two-step forward process that first estimates the boundary as a prior distribution and then rescales the forward trajectory to construct a boundary conditional diffusion model. The reverse process is proportionally adjusted to guarantee that the learned contours yield more precise discrete data. Experimental results indicate that our approach achieves strong performance in both language modeling and discrete image generation tasks. In language modeling, our approach surpasses previous state-of-the-art continuous diffusion language models in three translation tasks and a summarization task, while also demonstrating competitive performance compared to auto-regressive transformers. Moreover, our method achieves comparable results to continuous diffusion models when using discrete ordinal pixels and establishes a new state-of-the-art for categorical image generation on the Cifar-10 dataset.

cs.LG↗

arXiv2024

Extending Context Window of Large Language Models from a Distributional Perspective

Scaling the rotary position embedding (RoPE) has become a common method for extending the context window of RoPE-based large language models (LLMs). However, existing scaling methods often rely on empirical approaches and lack a profound understanding of the internal distribution within RoPE, resulting in suboptimal performance in extending the context window length. In this paper, we propose to optimize the context window extending task from the view of rotary angle distribution. Specifically, we first estimate the distribution of the rotary angles within the model and analyze the extent to which length extension perturbs this distribution. Then, we present a novel extension strategy that minimizes the disturbance between rotary angle distributions to maintain consistency with the pre-training phase, enhancing the model's capability to generalize to longer sequences. Experimental results compared to the strong baseline methods demonstrate that our approach reduces by up to 72% of the distributional disturbance when extending LLaMA2's context window to 8k, and reduces by up to 32% when extending to 16k. On the LongBench-E benchmark, our method achieves an average improvement of up to 4.33% over existing state-of-the-art methods. Furthermore, Our method maintains the model's performance on the Hugging Face Open LLM benchmark after context window extension, with only an average performance fluctuation ranging from -0.12 to +0.22.

cs.CL↗

arXiv2024

Learning Fine-Grained Grounded Citations for Attributed Large Language Models

Despite the impressive performance on information-seeking tasks, large language models (LLMs) still struggle with hallucinations. Attributed LLMs, which augment generated text with in-line citations, have shown potential in mitigating hallucinations and improving verifiability. However, current approaches suffer from suboptimal citation quality due to their reliance on in-context learning. Furthermore, the practice of citing only coarse document identifiers makes it challenging for users to perform fine-grained verification. In this work, we introduce FRONT, a training framework designed to teach LLMs to generate Fine-Grained Grounded Citations. By grounding model outputs in fine-grained supporting quotes, these quotes guide the generation of grounded and consistent responses, not only improving citation quality but also facilitating fine-grained verification. Experiments on the ALCE benchmark demonstrate the efficacy of FRONT in generating superior grounded responses and highly supportive citations. With LLaMA-2-7B, the framework significantly outperforms all the baselines, achieving an average of 14.21% improvement in citation quality across all datasets, even surpassing ChatGPT.

cs.CL↗

arXiv2024

Investigating and Mitigating the Multimodal Hallucination Snowballing in Large Vision-Language Models

Though advanced in understanding visual information with human languages, Large Vision-Language Models (LVLMs) still suffer from multimodal hallucinations. A natural concern is that during multimodal interaction, the generated hallucinations could influence the LVLMs' subsequent generation. Thus, we raise a question: When presented with a query relevant to the previously generated hallucination, will LVLMs be misled and respond incorrectly, even though the ground visual information exists? To answer this, we propose a framework called MMHalSnowball to evaluate LVLMs' behaviors when encountering generated hallucinations, where LVLMs are required to answer specific visual questions within a curated hallucinatory conversation. Crucially, our experiment shows that the performance of open-source LVLMs drops by at least $31\%$, indicating that LVLMs are prone to accept the generated hallucinations and make false claims that they would not have supported without distractions. We term this phenomenon Multimodal Hallucination Snowballing. To mitigate this, we further propose a training-free method called Residual Visual Decoding, where we revise the output distribution of LVLMs with the one derived from the residual visual input, providing models with direct access to the visual information. Experiments show that our method can mitigate more than $24\%$ of the snowballed multimodal hallucination while maintaining capabilities.

cs.CV↗

arXiv2024

An Information Bottleneck Perspective for Effective Noise Filtering on Retrieval-Augmented Generation

Retrieval-augmented generation integrates the capabilities of large language models with relevant information retrieved from an extensive corpus, yet encounters challenges when confronted with real-world noisy data. One recent solution is to train a filter module to find relevant content but only achieve suboptimal noise compression. In this paper, we propose to introduce the information bottleneck theory into retrieval-augmented generation. Our approach involves the filtration of noise by simultaneously maximizing the mutual information between compression and ground output, while minimizing the mutual information between compression and retrieved passage. In addition, we derive the formula of information bottleneck to facilitate its application in novel comprehensive evaluations, the selection of supervised fine-tuning data, and the construction of reinforcement learning rewards. Experimental results demonstrate that our approach achieves significant improvements across various question answering datasets, not only in terms of the correctness of answer generation but also in the conciseness with $2.5\%$ compression rate.

cs.CL↗

arXiv2024

Seed Optimization with Frozen Generator for Superior Zero-shot Low-light Enhancement

In this work, we observe that the generators, which are pre-trained on massive natural images, inherently hold the promising potential for superior low-light image enhancement against varying scenarios.Specifically, we embed a pre-trained generator to Retinex model to produce reflectance maps with enhanced detail and vividness, thereby recovering features degraded by low-light conditions.Taking one step further, we introduce a novel optimization strategy, which backpropagates the gradients to the input seeds rather than the parameters of the low-light enhancement model, thus intactly retaining the generative knowledge learned from natural images and achieving faster convergence speed. Benefiting from the pre-trained knowledge and seed-optimization strategy, the low-light enhancement model can significantly regularize the realness and fidelity of the enhanced result, thus rapidly generating high-quality images without training on any low-light dataset. Extensive experiments on various benchmarks demonstrate the superiority of the proposed method over numerous state-of-the-art methods qualitatively and quantitatively.

cs.CV↗