arXiv subjects

Xue Liu

Publications and source records attributed to Xue Liu.

At least 145 records · Page 8Linked to original sources

arXiv2025

Revealing nanoscale structural phase separation in La$_{3}$Ni$_{2}$O$_{7-δ}$ single crystal via scanning near-field optical microscopy

The discovery of superconductivity in La3Ni2O7-$δ$ under high pressure,with an onset critical temperature around 80 K, has sparked significant interest in the superconducting phases of Ruddlesden-Popper nickelates, Lan+1NinO3n+1. While La4Ni3O10 exhibits nearly 100% superconductivity with Tc~30 K under high pressure, magnetic susceptibility studies on La3Ni2O7-$δ$, however, reveal a more complex picture, indicating either filamentary superconductivity or that approximately 50% of crystal phase becomes superconducting in polycrystalline samples. In this study, we employed scattering-type scanning near-field optical microscopy to visualize nanoscale structural phase separation in La3Ni2O7-$δ$, identifying enhanced optical conductivity with stripes approximately 183 nm wide. These stripes run diagonally with respect to the Ni-O-Ni bond directions in the a-b plane, ruling out the possibility that they arise from impurity phases, like the '1313', '214' or '4310' structures. The dark regions and bright stripes exhibit optical conductivities ~ 22% and 29% of gold's, respectively. Additionally, we find that the bright stripes constitute about 38% of the total field of view, while the remainder consists of dark regions and the transitional region between dark regions and bright stripes. Our results suggest that optical conductivity stripes originate from nanoscale structural phase separation. In contrast, La4Ni3O10 exhibits uniform and higher optical conductivity with no observable evidence of phase separation. Thus, our study represents a pioneering effort to directly image nanoscale phase separation in Lan+1NinO3n+1 nickelates. This observation could provide crucial insights into the factors that limit the superconducting volume fraction of La3Ni2O7-$δ$, highlighting SNOM as a powerful probe for exploring nanoscale low-energy physics in correlated quantum materials.

cond-mat.supr-con↗

arXiv2025

Towards Edge General Intelligence via Large Language Models: Opportunities and Challenges

Edge Intelligence (EI) has been instrumental in delivering real-time, localized services by leveraging the computational capabilities of edge networks. The integration of Large Language Models (LLMs) empowers EI to evolve into the next stage: Edge General Intelligence (EGI), enabling more adaptive and versatile applications that require advanced understanding and reasoning capabilities. However, systematic exploration in this area remains insufficient. This survey delineates the distinctions between EGI and traditional EI, categorizing LLM-empowered EGI into three conceptual systems: centralized, hybrid, and decentralized. For each system, we detail the framework designs and review existing implementations. Furthermore, we evaluate the performance and throughput of various Small Language Models (SLMs) that are more suitable for development on edge devices. This survey provides researchers with a comprehensive vision of EGI, offering insights into its vast potential and establishing a foundation for future advancements in this rapidly evolving field.

cs.DC↗

arXiv2025

ParetoFlow: Guided Flows in Multi-Objective Optimization

In offline multi-objective optimization (MOO), we leverage an offline dataset of designs and their associated labels to simultaneously minimize multiple objectives. This setting more closely mirrors complex real-world problems compared to single-objective optimization. Recent works mainly employ evolutionary algorithms and Bayesian optimization, with limited attention given to the generative modeling capabilities inherent in such data. In this study, we explore generative modeling in offline MOO through flow matching, noted for its effectiveness and efficiency. We introduce ParetoFlow, specifically designed to guide flow sampling to approximate the Pareto front. Traditional predictor (classifier) guidance is inadequate for this purpose because it models only a single objective. In response, we propose a multi-objective predictor guidance module that assigns each sample a weight vector, representing a weighted distribution across multiple objective predictions. A local filtering scheme is introduced to address non-convex Pareto fronts. These weights uniformly cover the entire objective space, effectively directing sample generation towards the Pareto front. Since distributions with similar weights tend to generate similar samples, we introduce a neighboring evolution module to foster knowledge sharing among neighboring distributions. This module generates offspring from these distributions, and selects the most promising one for the next iteration. Our method achieves state-of-the-art performance across various tasks.

cs.CE↗

arXiv2025

Warmup Generations: A Task-Agnostic Approach for Guiding Sequence-to-Sequence Learning with Unsupervised Initial State Generation

Traditional supervised fine-tuning (SFT) strategies for sequence-to-sequence tasks often train models to directly generate the target output. Recent work has shown that guiding models with intermediate steps, such as keywords, outlines, or reasoning chains, can significantly improve performance, coherence, and interpretability. However, these methods often depend on predefined intermediate formats and annotated data, limiting their scalability and generalizability. In this work, we introduce a task-agnostic framework that enables models to generate intermediate "warmup" sequences. These warmup sequences, serving as an initial state for subsequent generation, are optimized to enhance the probability of generating the target sequence without relying on external supervision or human-designed structures. Drawing inspiration from reinforcement learning principles, our method iteratively refines these intermediate steps to maximize their contribution to the final output, similar to reward-driven optimization in reinforcement learning with human feedback. Experimental results across tasks such as translation, summarization, and multi-choice question answering for logical reasoning show that our approach outperforms traditional SFT methods, and offers a scalable and flexible solution for sequence-to-sequence tasks.

cs.CL↗

arXiv2025

3DMolFormer: A Dual-channel Framework for Structure-based Drug Discovery

Structure-based drug discovery, encompassing the tasks of protein-ligand docking and pocket-aware 3D drug design, represents a core challenge in drug discovery. However, no existing work can deal with both tasks to effectively leverage the duality between them, and current methods for each task are hindered by challenges in modeling 3D information and the limitations of available data. To address these issues, we propose 3DMolFormer, a unified dual-channel transformer-based framework applicable to both docking and 3D drug design tasks, which exploits their duality by utilizing docking functionalities within the drug design process. Specifically, we represent 3D pocket-ligand complexes using parallel sequences of discrete tokens and continuous numbers, and we design a corresponding dual-channel transformer model to handle this format, thereby overcoming the challenges of 3D information modeling. Additionally, we alleviate data limitations through large-scale pre-training on a mixed dataset, followed by supervised and reinforcement learning fine-tuning techniques respectively tailored for the two tasks. Experimental results demonstrate that 3DMolFormer outperforms previous approaches in both protein-ligand docking and pocket-aware 3D drug design, highlighting its promising application in structure-based drug discovery. The code is available at: https://github.com/HXYfighter/3DMolFormer .

cs.CE↗

arXiv2025

Hybrid LLM-DDQN based Joint Optimization of V2I Communication and Autonomous Driving

Large language models (LLMs) have received considerable interest recently due to their outstanding reasoning and comprehension capabilities. This work explores applying LLMs to vehicular networks, aiming to jointly optimize vehicle-to-infrastructure (V2I) communications and autonomous driving (AD) policies. We deploy LLMs for AD decision-making to maximize traffic flow and avoid collisions for road safety, and a double deep Q-learning algorithm (DDQN) is used for V2I optimization to maximize the received data rate and reduce frequent handovers. In particular, for LLM-enabled AD, we employ the Euclidean distance to identify previously explored AD experiences, and then LLMs can learn from past good and bad decisions for further improvement. Then, LLM-based AD decisions will become part of states in V2I problems, and DDQN will optimize the V2I decisions accordingly. After that, the AD and V2I decisions are iteratively optimized until convergence. Such an iterative optimization approach can better explore the interactions between LLMs and conventional reinforcement learning techniques, revealing the potential of using LLMs for network optimization and management. Finally, the simulations demonstrate that our proposed hybrid LLM-DDQN approach outperforms the conventional DDQN algorithm, showing faster convergence and higher average rewards.

cs.LG↗

arXiv2025

Optimizing Blockchain Analysis: Tackling Temporality and Scalability with an Incremental Approach with Metropolis-Hastings Random Walks

Blockchain technology, with implications in the financial domain, offers data in the form of large-scale transaction networks. Analyzing transaction networks facilitates fraud detection, market analysis, and supports government regulation. Despite many graph representation learning methods for transaction network analysis, we pinpoint two salient limitations that merit more investigation. Existing methods predominantly focus on the snapshots of transaction networks, sidelining the evolving nature of blockchain transaction networks. Existing methodologies may not sufficiently emphasize efficient, incremental learning capabilities, which are essential for addressing the scalability challenges in ever-expanding large-scale transaction networks. To address these challenges, we employed an incremental approach for random walk-based node representation learning in transaction networks. Further, we proposed a Metropolis-Hastings-based random walk mechanism for improved efficiency. The empirical evaluation conducted on blockchain transaction datasets reveals comparable performance in node classification tasks while reducing computational overhead. Potential applications include transaction network monitoring, the efficient classification of blockchain addresses for fraud detection or the identification of specialized address types within the network.

cs.CE↗

arXiv2025

CorrDiff: Adaptive Delay-aware Detector with Temporal Cue Inputs for Real-time Object Detection

Real-time object detection takes an essential part in the decision-making process of numerous real-world applications, including collision avoidance and path planning in autonomous driving systems. This paper presents a novel real-time streaming perception method named CorrDiff, designed to tackle the challenge of delays in real-time detection systems. The main contribution of CorrDiff lies in its adaptive delay-aware detector, which is able to utilize runtime-estimated temporal cues to predict objects' locations for multiple future frames, and selectively produce predictions that matches real-world time, effectively compensating for any communication and computational delays. The proposed model outperforms current state-of-the-art methods by leveraging motion estimation and feature enhancement, both for 1) single-frame detection for the current frame or the next frame, in terms of the metric mAP, and 2) the prediction for (multiple) future frame(s), in terms of the metric sAP (The sAP metric is to evaluate object detection algorithms in streaming scenarios, factoring in both latency and accuracy). It demonstrates robust performance across a range of devices, from powerful Tesla V100 to modest RTX 2080Ti, achieving the highest level of perceptual accuracy on all platforms. Unlike most state-of-the-art methods that struggle to complete computation within a single frame on less powerful devices, CorrDiff meets the stringent real-time processing requirements on all kinds of devices. The experimental results emphasize the system's adaptability and its potential to significantly improve the safety and reliability for many real-world systems, such as autonomous driving. Our code is completely open-sourced and is available at https://anonymous.4open.science/r/CorrDiff.

cs.CV↗

arXiv2024

Robust Guided Diffusion for Offline Black-Box Optimization

Offline black-box optimization aims to maximize a black-box function using an offline dataset of designs and their measured properties. Two main approaches have emerged: the forward approach, which learns a mapping from input to its value, thereby acting as a proxy to guide optimization, and the inverse approach, which learns a mapping from value to input for conditional generation. (a) Although proxy-free~(classifier-free) diffusion shows promise in robustly modeling the inverse mapping, it lacks explicit guidance from proxies, essential for generating high-performance samples beyond the training distribution. Therefore, we propose \textit{proxy-enhanced sampling} which utilizes the explicit guidance from a trained proxy to bolster proxy-free diffusion with enhanced sampling control. (b) Yet, the trained proxy is susceptible to out-of-distribution issues. To address this, we devise the module \textit{diffusion-based proxy refinement}, which seamlessly integrates insights from proxy-free diffusion back into the proxy for refinement. To sum up, we propose \textit{\textbf{R}obust \textbf{G}uided \textbf{D}iffusion for Offline Black-box Optimization}~(\textbf{RGD}), combining the advantages of proxy~(explicit guidance) and proxy-free diffusion~(robustness) for effective conditional generation. RGD achieves state-of-the-art results on various design-bench tasks, underscoring its efficacy. Our code is at https://github.com/GGchen1997/RGD.

cs.LG↗

arXiv2024

Large Language Models for Wireless Networks: An Overview from the Prompt Engineering Perspective

Recently, large language models (LLMs) have been successfully applied to many fields, showing outstanding comprehension and reasoning capabilities. Despite their great potential, LLMs usually require dedicated pre-training and fine-tuning for domain-specific applications such as wireless networks. These adaptations can be extremely demanding for computational resources and datasets, while most network devices have limited computation power, and there are a limited number of high-quality networking datasets. To this end, this work explores LLM-enabled wireless networks from the prompt engineering perspective, i.e., designing prompts to guide LLMs to generate desired output without updating LLM parameters. Compared with other LLM-driven methods, prompt engineering can better align with the demands of wireless network devices, e.g., higher deployment flexibility, rapid response time, and lower requirements on computation power. In particular, this work first introduces LLM fundamentals and compares different prompting techniques such as in-context learning, chain-of-thought, and self-refinement. Then we propose two novel prompting schemes for network applications: iterative prompting for network optimization, and self-refined prompting for network prediction. The case studies show that the proposed schemes can achieve comparable performance as conventional machine learning techniques, and our proposed prompting-based methods avoid the complexity of dedicated model training and fine-tuning, which is one of the key bottlenecks of existing machine learning techniques.

cs.NI↗

arXiv2024

From Capture to Display: A Survey on Volumetric Video

Volumetric video, which offers immersive viewing experiences, is gaining increasing prominence. With its six degrees of freedom, it provides viewers with greater immersion and interactivity compared to traditional videos. Despite their potential, volumetric video services pose significant challenges. This survey conducts a comprehensive review of the existing literature on volumetric video. We firstly provide a general framework of volumetric video services, followed by a discussion on prerequisites for volumetric video, encompassing representations, open datasets, and quality assessment metrics. Then we delve into the current methodologies for each stage of the volumetric video service pipeline, detailing capturing, compression, transmission, rendering, and display techniques. Lastly, we explore various applications enabled by this pioneering technology and we present an array of research challenges and opportunities in the domain of volumetric video services. This survey aspires to provide a holistic understanding of this burgeoning field and shed light on potential future research trajectories, aiming to bring the vision of volumetric video to fruition.

cs.MM↗

arXiv2024

GeneQuery: A General QA-based Framework for Spatial Gene Expression Predictions from Histology Images

Gene expression profiling provides profound insights into molecular mechanisms, but its time-consuming and costly nature often presents significant challenges. In contrast, whole-slide hematoxylin and eosin (H&E) stained histological images are readily accessible and allow for detailed examinations of tissue structure and composition at the microscopic level. Recent advancements have utilized these histological images to predict spatially resolved gene expression profiles. However, state-of-the-art works treat gene expression prediction as a multi-output regression problem, where each gene is learned independently with its own weights, failing to capture the shared dependencies and co-expression patterns between genes. Besides, existing works can only predict gene expression values for genes seen during training, limiting their ability to generalize to new, unseen genes. To address the above limitations, this paper presents GeneQuery, which aims to solve this gene expression prediction task in a question-answering (QA) manner for better generality and flexibility. Specifically, GeneQuery takes gene-related texts as queries and whole-slide images as contexts and then predicts the queried gene expression values. With such a transformation, GeneQuery can implicitly estimate the gene distribution by introducing the gene random variable. Besides, the proposed GeneQuery consists of two architecture implementations, i.e., spot-aware GeneQuery for capturing patterns between images and gene-aware GeneQuery for capturing patterns between genes. Comprehensive experiments on spatial transcriptomics datasets show that the proposed GeneQuery outperforms existing state-of-the-art methods on known and unseen genes. More results also demonstrate that GeneQuery can potentially analyze the tissue structure.

cs.CV↗

arXiv2024

Fusion Matters: Learning Fusion in Deep Click-through Rate Prediction Models

The evolution of previous Click-Through Rate (CTR) models has mainly been driven by proposing complex components, whether shallow or deep, that are adept at modeling feature interactions. However, there has been less focus on improving fusion design. Instead, two naive solutions, stacked and parallel fusion, are commonly used. Both solutions rely on pre-determined fusion connections and fixed fusion operations. It has been repetitively observed that changes in fusion design may result in different performances, highlighting the critical role that fusion plays in CTR models. While there have been attempts to refine these basic fusion strategies, these efforts have often been constrained to specific settings or dependent on specific components. Neural architecture search has also been introduced to partially deal with fusion design, but it comes with limitations. The complexity of the search space can lead to inefficient and ineffective results. To bridge this gap, we introduce OptFusion, a method that automates the learning of fusion, encompassing both the connection learning and the operation selection. We have proposed a one-shot learning algorithm tackling these tasks concurrently. Our experiments are conducted over three large-scale datasets. Extensive experiments prove both the effectiveness and efficiency of OptFusion in improving CTR model performance. Our code implementation is available here\url{https://github.com/kexin-kxzhang/OptFusion}.

cs.IR↗

arXiv2024

Modeling Multivariable High-resolution 3D Urban Microclimate Using Localized Fourier Neural Operator

Accurate urban microclimate analysis with wind velocity and temperature is vital for energy-efficient urban planning, supporting carbon reduction, enhancing public health and comfort, and advancing the low-altitude economy. However, traditional computational fluid dynamics (CFD) simulations that couple velocity and temperature are computationally expensive. Recent machine learning advancements offer promising alternatives for accelerating urban microclimate simulations. The Fourier neural operator (FNO) has shown efficiency and accuracy in predicting single-variable velocity magnitudes in urban wind fields. Yet, for multivariable high-resolution 3D urban microclimate prediction, FNO faces three key limitations: blurry output quality, high GPU memory demand, and substantial data requirements. To address these issues, we propose a novel localized Fourier neural operator (Local-FNO) model that employs local training, geometry encoding, and patch overlapping. Local-FNO provides accurate predictions for rapidly changing turbulence in urban microclimate over 60 seconds, four times the average turbulence integral time scale, with an average error of 0.35 m/s in velocity and 0.30 °C in temperature. It also accurately captures turbulent heat flux represented by the velocity-temperature correlation. In a 2 km by 2 km domain, Local-FNO resolves turbulence patterns down to a 10 m resolution. It provides high-resolution predictions with 150 million feature dimensions on a single 32 GB GPU at nearly 50 times the speed of a CFD solver. Compared to FNO, Local-FNO achieves a 23.9% reduction in prediction error and a 47.3% improvement in turbulent fluctuation correlation.

physics.flu-dyn↗

arXiv2024

Toward a Better Understanding of Fourier Neural Operators from a Spectral Perspective

In solving partial differential equations (PDEs), Fourier Neural Operators (FNOs) have exhibited notable effectiveness. However, FNO is observed to be ineffective with large Fourier kernels that parameterize more frequencies. Current solutions rely on setting small kernels, restricting FNO's ability to capture complex PDE data in real-world applications. This paper offers empirical insights into FNO's difficulty with large kernels through spectral analysis: FNO exhibits a unique Fourier parameterization bias, excelling at learning dominant frequencies in target data while struggling with non-dominant frequencies. To mitigate such a bias, we propose SpecB-FNO to enhance the capture of non-dominant frequencies by adopting additional residual modules to learn from the previous ones' prediction residuals iteratively. By effectively utilizing large Fourier kernels, SpecB-FNO achieves better prediction accuracy on diverse PDE applications, with an average improvement of 50%.

cs.LG↗

arXiv2024

Learning to Extract Structured Entities Using Language Models

Recent advances in machine learning have significantly impacted the field of information extraction, with Language Models (LMs) playing a pivotal role in extracting structured information from unstructured text. Prior works typically represent information extraction as triplet-centric and use classical metrics such as precision and recall for evaluation. We reformulate the task to be entity-centric, enabling the use of diverse metrics that can provide more insights from various perspectives. We contribute to the field by introducing Structured Entity Extraction and proposing the Approximate Entity Set OverlaP (AESOP) metric, designed to appropriately assess model performance. Later, we introduce a new Multistage Structured Entity Extraction (MuSEE) model that harnesses the power of LMs for enhanced effectiveness and efficiency by decomposing the extraction task into multiple stages. Quantitative and human side-by-side evaluations confirm that our model outperforms baselines, offering promising directions for future advancements in structured entity extraction. Our source code and datasets are available at https://github.com/microsoft/Structured-Entity-Extraction.

cs.CL↗

arXiv2024

Collaborative Performance Prediction for Large Language Models

Comprehensively understanding and accurately predicting the performance of large language models across diverse downstream tasks has emerged as a pivotal challenge in NLP research. The pioneering scaling law on downstream works demonstrated intrinsic similarities within model families and utilized such similarities for performance prediction. However, they tend to overlook the similarities between model families and only consider design factors listed in the original scaling law. To overcome these limitations, we introduce a novel framework, Collaborative Performance Prediction (CPP), which significantly enhances prediction accuracy by leveraging the historical performance of various models on downstream tasks and other design factors for both model and task. We also collect a collaborative data sourced from online platforms containing both historical performance and additional design factors. With the support of the collaborative data, CPP not only surpasses traditional scaling laws in predicting the performance of scaled LLMs but also facilitates a detailed analysis of factor importance, an area previously overlooked.

cs.CL↗

arXiv2024

An Overview of Machine Learning-Enabled Optimization for Reconfigurable Intelligent Surfaces-Aided 6G Networks: From Reinforcement Learning to Large Language Models

Reconfigurable intelligent surface (RIS) becomes a promising technique for 6G networks by reshaping signal propagation in smart radio environments. However, it also leads to significant complexity for network management due to the large number of elements and dedicated phase-shift optimization. In this work, we provide an overview of machine learning (ML)-enabled optimization for RIS-aided 6G networks. In particular, we focus on various reinforcement learning (RL) techniques, e.g., deep Q-learning, multi-agent reinforcement learning, transfer reinforcement learning, hierarchical reinforcement learning, and offline reinforcement learning. Different from existing studies, this work further discusses how large language models (LLMs) can be combined with RL to handle network optimization problems. It shows that LLM offers new opportunities to enhance the capabilities of RL algorithms in terms of generalization, reward function design, multi-modal information processing, etc. Finally, we identify the future challenges and directions of ML-enabled optimization for RIS-aided 6G networks.

cs.NI↗