arXiv subjects

Yu Xie

Publications and source records attributed to Yu Xie.

At least 55 records · Page 3Linked to original sources

arXiv2025

Directed Link Prediction using GNN with Local and Global Feature Fusion

Link prediction is a classical problem in graph analysis with many practical applications. For directed graphs, recently developed deep learning approaches typically analyze node similarities through contrastive learning and aggregate neighborhood information through graph convolutions. In this work, we propose a novel graph neural network (GNN) framework to fuse feature embedding with community information. We theoretically demonstrate that such hybrid features can improve the performance of directed link prediction. To utilize such features efficiently, we also propose an approach to transform input graphs into directed line graphs so that nodes in the transformed graph can aggregate more information during graph convolutions. Experiments on benchmark datasets show that our approach outperforms the state-of-the-art in most cases when 30%, 40%, 50%, and 60% of the connected links are used as training data, respectively.

cs.LG↗

arXiv2025

RecLLM-R1: A Two-Stage Training Paradigm with Reinforcement Learning and Chain-of-Thought v1

Traditional recommendation systems often grapple with "filter bubbles", underutilization of external knowledge, and a disconnect between model optimization and business policy iteration. To address these limitations, this paper introduces RecLLM-R1, a novel recommendation framework leveraging Large Language Models (LLMs) and drawing inspiration from the DeepSeek R1 methodology. The framework initiates by transforming user profiles, historical interactions, and multi-faceted item attributes into LLM-interpretable natural language prompts through a carefully engineered data construction process. Subsequently, a two-stage training paradigm is employed: the initial stage involves Supervised Fine-Tuning (SFT) to imbue the LLM with fundamental recommendation capabilities. The subsequent stage utilizes Group Relative Policy Optimization (GRPO), a reinforcement learning technique, augmented with a Chain-of-Thought (CoT) mechanism. This stage guides the model through multi-step reasoning and holistic decision-making via a flexibly defined reward function, aiming to concurrently optimize recommendation accuracy, diversity, and other bespoke business objectives. Empirical evaluations on a real-world user behavior dataset from a large-scale social media platform demonstrate that RecLLM-R1 significantly surpasses existing baseline methods across a spectrum of evaluation metrics, including accuracy, diversity, and novelty. It effectively mitigates the filter bubble effect and presents a promising avenue for the integrated optimization of recommendation models and policies under intricate business goals.

cs.AI↗

arXiv2025

NSFW-Classifier Guided Prompt Sanitization for Safe Text-to-Image Generation

The rapid advancement of text-to-image (T2I) models, such as Stable Diffusion, has enhanced their capability to synthesize images from textual prompts. However, this progress also raises significant risks of misuse, including the generation of harmful content (e.g., pornography, violence, discrimination), which contradicts the ethical goals of T2I technology and hinders its sustainable development. Inspired by "jailbreak" attacks in large language models, which bypass restrictions through subtle prompt modifications, this paper proposes NSFW-Classifier Guided Prompt Sanitization (PromptSan), a novel approach to detoxify harmful prompts without altering model architecture or degrading generation capability. PromptSan includes two variants: PromptSan-Modify, which iteratively identifies and replaces harmful tokens in input prompts using text NSFW classifiers during inference, and PromptSan-Suffix, which trains an optimized suffix token sequence to neutralize harmful intent while passing both text and image NSFW classifier checks. Extensive experiments demonstrate that PromptSan achieves state-of-the-art performance in reducing harmful content generation across multiple metrics, effectively balancing safety and usability.

cs.CV↗

arXiv2025

Resource Allocation for Twin Maintenance and Computing Task Processing in Digital Twin Vehicular Edge Computing Network

As a promising technology, vehicular edge computing (VEC) can provide computing and caching services by deploying VEC servers near vehicles. However, VEC networks still face challenges such as high vehicle mobility. Digital twin (DT), an emerging technology, can predict, estimate, and analyze real-time states by digitally modeling objects in the physical world. By integrating DT with VEC, a virtual vehicle DT can be created in the VEC server to monitor the real-time operating status of vehicles. However, maintaining the vehicle DT model requires ongoing attention from the VEC server, which also needs to offer computing services for the vehicles. Therefore, effective allocation and scheduling of VEC server resources are crucial. This study focuses on a general VEC network with a single VEC service and multiple vehicles, examining the two types of delays caused by twin maintenance and computational processing within the network. By transforming the problem using satisfaction functions, we propose an optimization problem aimed at maximizing each vehicle's resource utility to determine the optimal resource allocation strategy. Given the non-convex nature of the issue, we employ multi-agent Markov decision processes to reformulate the problem. Subsequently, we propose the twin maintenance and computing task processing resource collaborative scheduling (MADRL-CSTC) algorithm, which leverages multi-agent deep reinforcement learning. Through experimental comparisons with alternative algorithms, it demonstrates that our proposed approach is effective in terms of resource allocation.

cs.LG↗

arXiv2025

Digital Twin Vehicular Edge Computing Network: Task Offloading and Resource Allocation

With the increasing demand for multiple applications on internet of vehicles. It requires vehicles to carry out multiple computing tasks in real time. However, due to the insufficient computing capability of vehicles themselves, offloading tasks to vehicular edge computing (VEC) servers and allocating computing resources to tasks becomes a challenge. In this paper, a multi task digital twin (DT) VEC network is established. By using DT to develop offloading strategies and resource allocation strategies for multiple tasks of each vehicle in a single slot, an optimization problem is constructed. To solve it, we propose a multi-agent reinforcement learning method on the task offloading and resource allocation. Numerous experiments demonstrate that our method is effective compared to other benchmark algorithms.

cs.LG↗

arXiv2025

DNTextSpotter: Arbitrary-Shaped Scene Text Spotting via Improved Denoising Training

More and more end-to-end text spotting methods based on Transformer architecture have demonstrated superior performance. These methods utilize a bipartite graph matching algorithm to perform one-to-one optimal matching between predicted objects and actual objects. However, the instability of bipartite graph matching can lead to inconsistent optimization targets, thereby affecting the training performance of the model. Existing literature applies denoising training to solve the problem of bipartite graph matching instability in object detection tasks. Unfortunately, this denoising training method cannot be directly applied to text spotting tasks, as these tasks need to perform irregular shape detection tasks and more complex text recognition tasks than classification. To address this issue, we propose a novel denoising training method (DNTextSpotter) for arbitrary-shaped text spotting. Specifically, we decompose the queries of the denoising part into noised positional queries and noised content queries. We use the four Bezier control points of the Bezier center curve to generate the noised positional queries. For the noised content queries, considering that the output of the text in a fixed positional order is not conducive to aligning position with content, we employ a masked character sliding method to initialize noised content queries, thereby assisting in the alignment of text content and position. To improve the model's perception of the background, we further utilize an additional loss function for background characters classification in the denoising training part.Although DNTextSpotter is conceptually simple, it outperforms the state-of-the-art methods on four benchmarks (Total-Text, SCUT-CTW1500, ICDAR15, and Inverse-Text), especially yielding an improvement of 11.3% against the best approach in Inverse-Text dataset.

cs.CV↗

arXiv2025

RoSMM: A Robust and Secure Multi-Modal Watermarking Framework for Diffusion Models

Current image watermarking technologies are predominantly categorized into text watermarking techniques and image steganography; however, few methods can simultaneously handle text and image-based watermark data, which limits their applicability in complex digital environments. This paper introduces an innovative multi-modal watermarking approach, drawing on the concept of vector discretization in encoder-based vector quantization. By constructing adjacency matrices, the proposed method enables the transformation of text watermarks into robust image-based representations, providing a novel multi-modal watermarking paradigm for image generation applications. Additionally, this study presents a newly designed image restoration module to mitigate image degradation caused by transmission losses and various noise interferences, thereby ensuring the reliability and integrity of the watermark. Experimental results validate the robustness of the method under multiple noise attacks, providing a secure, scalable, and efficient solution for digital image copyright protection.

cs.MM↗

arXiv2025

Revealing the proton slingshot mechanism in solid acid electrolytes through machine learning molecular dynamics

In solid acid solid electrolytes CsH$_2$PO$_4$ and CsHSO$_4$, mechanisms of fast proton conduction have long been debated and attributed to either local proton hopping or polyanion rotation. However, the precise role of polyanion rotation and its interplay with proton hopping remained unclear. Nanosecond-scale molecular dynamics simulations, driven by equivariant neural network force fields, reveal a nuanced proton slingshot mechanism: protons are initially carried by rotating polyanions, followed by O$-$H bond reorientation, and the combined motion enables long-range jumps. This challenges the conventional revolving paddlewheel model and reveals significant independent proton motion that is assisted by limited rotations. Despite structural similarities, we identify qualitative differences in transport mechanisms between CsH$_2$PO$_4$ and CsHSO$_4$, caused by different proton concentrations. CsH$_2$PO$_4$ exhibits two distinct rates of rotational motions with different activation energies, contrasting with CsHSO$_4$'s single-rate behavior. The higher proton concentration in CsH$_2$PO$_4$ correlates with frustrated PO$_4$ polyanion orientations and slower rotations compared to SO$_4$ in CsHSO$_4$. Additionally, we reveal a correlation between O-sharing and proton transport in CsH$_2$PO$_4$, a unique feature due to extra proton per polyanion compared to CsHSO$_4$. Our findings suggest that reducing proton concentration could accelerate rotations and enhance conductivity. This work provides a unified framework for understanding and optimizing ionic mobility in solid-acid compounds, offering new insights into the interplay between proton hopping and disordered dynamics in polyanion rotation.

cond-mat.mtrl-sci↗

arXiv2025

ARES-Phonon: Phonon Calculation Package using Nondiagonal Supercell Finite Displacement Method with Machine Learning

We have developed a phonon calculation software based on the supercell finite displacement method: ARES-Phonon. It can perform phonon and related property calculations using either non-diagonal or diagonal supercell approaches. Particularly for the non-diagonal supercell method, for phonons with wave vectors $(\frac{n_1}{m_1},\frac{n_2}{m_2},\frac{n_3}{m_3})$, only a non-diagonal supercell of size equal to the least common multiple of $m_1 m_2 m_3$ needs to be constructed, significantly reducing the computational burden. We have tested this method on Diamond, $MoS_2$, and $Si_3O_6$ systems, and the results indicate that this approach can achieve the same level of accuracy as density functional perturbation theory. Speed tests were conducted for systems of different sizes, varying symmetries, and sampling densities of Brillouin zone \textbf{\textit{q}} points, showing that compared to the diagonal supercell method, the non-diagonal approach is approximately an order of magnitude faster and becomes even more efficient with increasing system complexity. Combining this method with machine learning potentials based on synchronous learning techniques, a further reduction of approximately $90\%$ in computational cost can be achieved while maintaining reliable accuracy.

cond-mat.mtrl-sci↗

arXiv2025

Uncovering inequalities in new knowledge learning by large language models across different languages

As large language models (LLMs) gradually become integral tools for problem solving in daily life worldwide, understanding linguistic inequality is becoming increasingly important. Existing research has primarily focused on static analyses that assess the disparities in the existing knowledge and capabilities of LLMs across languages. However, LLMs are continuously evolving, acquiring new knowledge to generate up-to-date, domain-specific responses. Investigating linguistic inequalities within this dynamic process is, therefore, also essential. In this paper, we explore inequalities in new knowledge learning by LLMs across different languages and four key dimensions: effectiveness, transferability, prioritization, and robustness. Through extensive experiments under two settings (in-context learning and fine-tuning) using both proprietary and open-source models, we demonstrate that low-resource languages consistently face disadvantages across all four dimensions. By shedding light on these disparities, we aim to raise awareness of linguistic inequalities in LLMs' new knowledge learning, fostering the development of more inclusive and equitable future LLMs.

cs.CL↗

arXiv2025

Variance reduction in output from generative AI

Generative AI models, such as ChatGPT, will increasingly replace humans in producing output for a variety of important tasks. While much prior work has mostly focused on the improvement in the average performance of generative AI models relative to humans' performance, much less attention has been paid to the significant reduction of variance in output produced by generative AI models. In this Perspective, we demonstrate that generative AI models are inherently prone to the phenomenon of "regression toward the mean" whereby variance in output tends to shrink relative to that in real-world distributions. We discuss potential social implications of this phenomenon across three levels-societal, group, and individual-and two dimensions-material and non-material. Finally, we discuss interventions to mitigate negative effects, considering the roles of both service providers and users. Overall, this Perspective aims to raise awareness of the importance of output variance in generative AI and to foster collaborative efforts to meet the challenges posed by the reduction of variance in output generated by AI models.

cs.CY↗

arXiv2025

Room-temperature decomposition of the ethaline deep eutectic solvent

Environmentally-benign, non-toxic electrolytes with combinatorial design spaces are excellent candidates for green solvents, green leaching agents, and carbon capture sources. Here, we examine one particular green solvent, ethaline, a 2:1 molar ratio of ethylene glycol and choline chloride. Despite its touted green credentials, we find partial decomposition of ethaline into toxic chloromethane and dimethylaminoethanol at room temperature, limiting its sustainable advantage. We experimentally characterize these decomposition products and computationally develop a general, quantum chemically-accurate workflow to understand decomposition. We find that fluctuations of the hydrogen bonds bind chloride near reaction sites, initiating the reaction between choline cations and chloride anions. In summary, in the design of green solvents, we do not recommend the use of choline chloride due to its susceptibility to undergo decomposition in strongly hydrogen-bound mixtures.

physics.chem-ph↗

arXiv2025

InsQABench: Benchmarking Chinese Insurance Domain Question Answering with Large Language Models

The application of large language models (LLMs) has achieved remarkable success in various fields, but their effectiveness in specialized domains like the Chinese insurance industry remains underexplored. The complexity of insurance knowledge, encompassing specialized terminology and diverse data types, poses significant challenges for both models and users. To address this, we introduce InsQABench, a benchmark dataset for the Chinese insurance sector, structured into three categories: Insurance Commonsense Knowledge, Insurance Structured Database, and Insurance Unstructured Documents, reflecting real-world insurance question-answering tasks.We also propose two methods, SQL-ReAct and RAG-ReAct, to tackle challenges in structured and unstructured data tasks. Evaluations show that while LLMs struggle with domain-specific terminology and nuanced clause texts, fine-tuning on InsQABench significantly improves performance. Our benchmark establishes a solid foundation for advancing LLM applications in the insurance domain, with data and code available at https://github.com/HaileyFamo/InsQABench.git.

cs.CL↗

arXiv2025

Harnessing the Power of Vibration Motors to Develop Miniature Untethered Robotic Fishes

Miniature underwater robots play a crucial role in the exploration and development of marine resources, particularly in confined spaces and high-pressure deep-sea environments. This study presents the design, optimization, and performance of a miniature robotic fish, powered by the oscillation of bio-inspired fins. These fins feature a rigid-flexible hybrid structure and use an eccentric rotating mass (ERM) vibration motor as the excitation source to generate high-frequency unidirectional oscillations that induce acoustic streaming for propulsion. The drive mechanism, powered by miniature ERM vibration motors, eliminates the need for complex mechanical drive systems, enabling complete isolation of the entire drive system from the external environment and facilitating the miniaturization of the robotic fish. A compact, untethered robotic fish, measuring 85*60*45 mm^3, is equipped with three bio-inspired fins located at the pectoral and caudal positions. Experimental results demonstrate that the robotic fish achieves a maximum forward swimming speed of 1.36 body lengths (BL) per second powered by all fins and minimum turning radius of 0.6 BL when powered by a single fin. These results underscore the significance of employing the ERM vibration motor in advancing the development of highly maneuverable, miniature untethered underwater robots for various marine exploration tasks.

cs.RO↗

arXiv2024

Concept Replacer: Replacing Sensitive Concepts in Diffusion Models via Precision Localization

As large-scale diffusion models continue to advance, they excel at producing high-quality images but often generate unwanted content, such as sexually explicit or violent content. Existing methods for concept removal generally guide the image generation process but can unintentionally modify unrelated regions, leading to inconsistencies with the original model. We propose a novel approach for targeted concept replacing in diffusion models, enabling specific concepts to be removed without affecting non-target areas. Our method introduces a dedicated concept localizer for precisely identifying the target concept during the denoising process, trained with few-shot learning to require minimal labeled data. Within the identified region, we introduce a training-free Dual Prompts Cross-Attention (DPCA) module to substitute the target concept, ensuring minimal disruption to surrounding content. We evaluate our method on concept localization precision and replacement efficiency. Experimental results demonstrate that our method achieves superior precision in localizing target concepts and performs coherent concept replacement with minimal impact on non-target areas, outperforming existing approaches.

cs.CV↗

arXiv2024

Data-driven design of high-temperature superconductivity among ternary hydrides under pressure

Recently, ternary clathrate hydrides are promising candidates for high-temperature superconductor. However, it is a formidable challenge to effectively hunt high-temperature superconductivity among multinary hydrides due to the expensive computational cost associated with large unit cells and huge stoichiometric choices. Here we present an efficiently data-driven strategy, including generated clathrate frameworks, the quick estimation of stability for each framework and superconducting critical temperature (Tc) for each hydride structure, to accelerate the discovery of high-temperature superconducting hydrides. Our strategy was initialized with more than one million input structures via zeolite databases and our generated dataset. As a result, such a strategy hitherto uncovered 14 prototypical hydrogen frameworks for clathrate hydrides, which is 1.5 times greater than the number (9) of previously reported prototypes. Remarkably, eleven ternary clathrate structures were predicted to have Tcs above 250 K at 300 GPa. Further extensive global structure-searching simulations support that Li2NaH17 and ThY2H24 are thermodynamically stable at 220 and 150 GPa, respectively, with Tcs approaching room temperature of 297 K and 303 K, which are promising for future synthesis. These results offer a platform to explore high-temperature superconductors via a great number of databases.

cond-mat.supr-con↗

arXiv2024

Negative piezoelectricity in quasi-two/one-dimensional ferroelectrics

In recent years, the investigation of low-dimensional ferroelectrics has attracted great attention for their promising applications in nano devices. Piezoelectricity is one of the most core properties of ferroelectric materials, which plays the essential role in micro-electromechanical systems. Very recently, the anomalous negative piezoelectricity has been predicted/discovered in many quasi-two-dimensional layered ferroelectric materials. In this Topical Review, we will briefly introduce on the negative piezoelectricity in quasi-two/one-dimensional ferroelectrics, including its fundamental concept, typical materials, theoretical predictions, as well as experimental phenomena. The underlying physical mechanisms for negative piezoelectricity are divergent and varying from case by case, which can be categorized into four types. First, the soft van der Waals layer is responsible for the volume shrinking upon pressure while the electric dipoles is from non van der Waals layer. Second, the noncollinearity of local dipoles creates a ferrielectricity, which leads to orthogonal ferroelectric and antiferroelectric axes. Third, the electric dipoles come from interlayer/interchain couplings, which can be enhanced during the volume shrinking. Fourth, the special buckling structure contributes to local dipoles, which can be enhanced upon pressure. In real materials, more than one mechanism may work together. Finally, the future directions of negative piezoelectricity and their potential applications are outlooked.

cond-mat.mtrl-sci↗

arXiv2024

The Social Impact of Generative LLM-Based AI

Liking it or not, ready or not, we are likely to enter a new phase of human history in which Artificial Intelligence (AI) will dominate economic production and social life -- the AI Revolution. Before the actual arrival of the AI Revolution, it is time for us to speculate on how AI will impact the social world. In this article, we focus on the social impact of generative LLM-based AI (GELLMAI), discussing societal factors that contribute to its technological development and its potential roles in enhancing both between-country and within-country social inequality. There are good indications that the US and China will lead the field and will be the main competitors for domination of AI in the world. We conjecture the AI Revolution will likely give rise to a post-knowledge society in which knowledge per se will become less important than in today's world. Instead, individual relationships and social identity will become more important. So will soft skills.

cs.CY↗