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Large language models (LLMs) and agentic systems have recently demonstrated potential for automating scientific workflows, including atomistic simulations. However, their deployment in high-performance computing (HPC) environments remains…

Computational Physics · Physics 2026-04-27 William Dawson , Louis Beal , Yoann Curé , Giuseppe Fisicaro , Dorian Rolland , Luigi Genovese

Multi-agent systems (MAS) decompose complex tasks and delegate subtasks to different large language model (LLM) agents and tools. Prior studies have reported the superior accuracy performance of MAS across diverse domains, enabled by…

Multiagent Systems · Computer Science 2025-05-27 Mingyan Gao , Yanzi Li , Banruo Liu , Yifan Yu , Phillip Wang , Ching-Yu Lin , Fan Lai

Autonomous agents powered by large language models (LLMs) have shown impressive capabilities in tool manipulation for complex task-solving. However, existing paradigms such as ReAct rely on sequential reasoning and execution, failing to…

Artificial Intelligence · Computer Science 2025-10-30 Jiaqi Wu , Qinlao Zhao , Zefeng Chen , Kai Qin , Yifei Zhao , Xueqian Wang , Yuhang Yao

Recent advancements in large language models (LLMs) have led to the creation of intelligent agents capable of performing complex tasks. This paper introduces a novel LLM-based multimodal agent framework designed to operate smartphone…

Computer Vision and Pattern Recognition · Computer Science 2023-12-25 Chi Zhang , Zhao Yang , Jiaxuan Liu , Yucheng Han , Xin Chen , Zebiao Huang , Bin Fu , Gang Yu

Large language models (LLMs) are increasingly deployed as the execution core of autonomous agents rather than as standalone text generators. Agentic workloads induce a temporal shift from single-turn inference to multi-turn LLM-tool loops,…

Operating Systems · Computer Science 2026-05-01 Yifei Wang , Hancheng Ye , Yechen Xu , Cong Guo , Chiyue Wei , Qinsi Wang , Dongting Li , Tingjun Chen , Hai "Helen" Li , Danyang Zhuo , Yiran Chen

Modern AI systems increasingly rely on workflows composed of multiple interacting agents, some powered by large language models (LLMs) and others by conventional computational modules. This paper analyzes the fundamental tradeoffs between…

Artificial Intelligence · Computer Science 2026-05-26 Ya-Ting Yang , Quanyan Zhu

The emergence of agentic AI, powered by Large Language Models (LLMs), marks a paradigm shift from reactive generative systems to proactive, goal-oriented autonomous agents capable of sophisticated planning, memory, and tool use. This…

Artificial Intelligence · Computer Science 2025-09-05 Yineng Yan , Xidong Wang , Jin Seng Cheng , Ran Hu , Wentao Guan , Nahid Farahmand , Hengte Lin , Yue Li

The ongoing evolution of AI paradigms has propelled AI research into the agentic AI stage. Consequently, the focus of research has shifted from single agents and simple applications towards multi-agent autonomous decision-making and task…

Artificial Intelligence · Computer Science 2025-08-08 Wei Zeng , Hengshu Zhu , Chuan Qin , Han Wu , Yihang Cheng , Sirui Zhang , Xiaowei Jin , Yinuo Shen , Zhenxing Wang , Feimin Zhong , Hui Xiong

Today's scientific challenges, from climate modeling to Inertial Confinement Fusion design to novel material design, require exploring huge design spaces. In order to enable high-impact scientific discovery, we need to scale up our ability…

LLM agents are increasingly expected to carry out end-to-end workflows, producing complete artifacts from high-level user instructions. To meet enterprise needs, frontier AI labs have developed agents that can construct entire spreadsheets…

Multi-agent systems based on large language models (LLMs) for financial trading have grown rapidly since 2023, yet the field lacks a shared framework for understanding what drives performance or for evaluating claims credibly. This survey…

Multiagent Systems · Computer Science 2026-03-31 Phat Nguyen , Thang Pham

Multi-agent systems (MAS) extend large language models (LLMs) from independent single-model reasoning to coordinative system-level intelligence. While existing LLM agents depend on text-based mediation for reasoning and communication, we…

Computation and Language · Computer Science 2025-12-09 Jiaru Zou , Xiyuan Yang , Ruizhong Qiu , Gaotang Li , Katherine Tieu , Pan Lu , Ke Shen , Hanghang Tong , Yejin Choi , Jingrui He , James Zou , Mengdi Wang , Ling Yang

Many workflows in high-energy-physics (HEP) stand to benefit from recent advances in transformer-based large language models (LLMs). While early applications of LLMs focused on text generation and code completion, modern LLMs now support…

High Energy Physics - Phenomenology · Physics 2025-12-19 Tony Menzo , Alexander Roman , Sergei Gleyzer , Konstantin Matchev , George T. Fleming , Stefan Höche , Stephen Mrenna , Prasanth Shyamsundar

The rise of Agent AI and Large Language Model-powered Multi-Agent Systems (LLM-MAS) has underscored the need for responsible and dependable system operation. Tools like LangChain and Retrieval-Augmented Generation have expanded LLM…

Multiagent Systems · Computer Science 2025-02-05 Jinwei Hu , Yi Dong , Shuang Ao , Zhuoyun Li , Boxuan Wang , Lokesh Singh , Guangliang Cheng , Sarvapali D. Ramchurn , Xiaowei Huang

Autonomous multi-agent systems based on large language models (LLMs) have demonstrated remarkable abilities in independently solving complex tasks in a wide breadth of application domains. However, these systems hit critical reasoning,…

Artificial Intelligence · Computer Science 2026-05-15 Evan Rose , Tushin Mallick , Matthew D. Laws , Cristina Nita-Rotaru , Alina Oprea

LLM-driven agents, particularly those using general frameworks like ReAct or human-inspired role-playing, often struggle in specialized domains that necessitate rigorously structured workflows. Fields such as remote sensing, requiring…

Artificial Intelligence · Computer Science 2025-11-24 Kaiyu Li , Jiayu Wang , Zhi Wang , Hui Qiao , Weizhan Zhang , Deyu Meng , Xiangyong Cao

Large language models (LLMs) are versatile, yet their deployment in complex real-world settings is limited by static knowledge cutoffs and the difficulty of producing controllable behavior within a single inference. Multi-agent search…

Machine Learning · Computer Science 2026-04-21 Guanzhong Chen , Shaoxiong Yang , Chao Li , Wei Liu , Jian Luan , Zenglin Xu

The growing complexity of power systems has made accurate load forecasting more important than ever. An increasing number of advanced load forecasting methods have been developed. However, the static design of current methods offers no…

Machine Learning · Computer Science 2025-05-23 Yu Zuo , Dalin Qin , Yi Wang

Agentic AI systems, powered by Large Language Models (LLMs), offer transformative potential for value co-creation in technical services. However, persistent challenges like hallucinations and operational brittleness limit their autonomous…

Human-Computer Interaction · Computer Science 2025-07-21 Jochen Wulf , Jurg Meierhofer , Frank Hannich

The rapid advancement of Large Language Models (LLMs) is catalyzing a shift towards autonomous AI Agents capable of executing complex, multi-step tasks. However, these agents remain brittle when faced with real-world exceptions, making…

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