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In this work we explore the performance and behavior of reasoning large language models to autonomously optimize atomic layer deposition (ALD) processes. In the ALD process optimization task, an agent built on top of a reasoning LLM has to…

Materials Science · Physics 2026-01-16 Angel Yanguas-Gil

Although recent tool-augmented benchmarks involve complex requests, evaluation remains limited to answer matching, neglecting critical trajectory aspects like efficiency, hallucination, and adaptivity. The most straightforward method for…

Artificial Intelligence · Computer Science 2026-05-26 Wonjoong Kim , Sangwu Park , Yeonjun In , Sein Kim , Dongha Lee , Chanyoung Park

As language models (LMs) are used to build autonomous agents in real environments, ensuring their adversarial robustness becomes a critical challenge. Unlike chatbots, agents are compound systems with multiple components taking actions,…

Machine Learning · Computer Science 2025-02-06 Chen Henry Wu , Rishi Shah , Jing Yu Koh , Ruslan Salakhutdinov , Daniel Fried , Aditi Raghunathan

We present Attentive Reasoning Queries (ARQs), a novel structured reasoning approach that significantly improves instruction-following in Large Language Models through domain-specialized reasoning blueprints. While LLMs demonstrate…

Computation and Language · Computer Science 2025-03-06 Bar Karov , Dor Zohar , Yam Marcovitz

A critical bottleneck in automating AI research is the execution of complex machine learning engineering (MLE) tasks. MLE differs from general software engineering due to computationally expensive evaluation (e.g., model training) and…

Artificial Intelligence · Computer Science 2026-05-21 Jiefeng Chen , Bhavana Dalvi Mishra , Jaehyun Nam , Rui Meng , Tomas Pfister , Jinsung Yoon

Large Language Model (LLM) based agents excel at general reasoning but often fail in specialized domains where success hinges on long-tail knowledge absent from their training data. While human experts can provide this missing knowledge,…

Artificial Intelligence · Computer Science 2026-02-27 Zhiming Wang , Jinwei He , Feng Lu

The growing adoption of Large Language Models (LLMs) across various domains has driven the demand for efficient and scalable AI-serving solutions. Deploying LLMs requires optimizations to manage their significant computational and data…

Hardware Architecture · Computer Science 2025-03-07 Junsoo Kim , Hunjong Lee , Geonwoo Ko , Gyubin Choi , Seri Ham , Seongmin Hong , Joo-Young Kim

Existing research has identified three structural performance bottlenecks in AI research agents: (1) synchronous single-GPU execution constrains sample throughput, limiting the benefit of search; (2) a generalization gap where…

Large language models (LLMs) often struggle with context fidelity, producing inconsistent answers when responding to questions based on provided information. Existing approaches either rely on expensive supervised fine-tuning to generate…

Computation and Language · Computer Science 2025-09-18 Suyuchen Wang , Jinlin Wang , Xinyu Wang , Shiqi Li , Xiangru Tang , Sirui Hong , Xiao-Wen Chang , Chenglin Wu , Bang Liu

Bargaining, a critical aspect of real-world interactions, presents challenges for large language models (LLMs) due to limitations in strategic depth and adaptation to complex human factors. Existing benchmarks often fail to capture this…

Machine Learning · Computer Science 2025-07-15 Jihwan Oh

Retrieval-Augmented Generation (RAG) lifts the factuality of Large Language Models (LLMs) by injecting external knowledge, yet it falls short on problems that demand multi-step inference; conversely, purely reasoning-oriented approaches…

Advances in multi-agent reinforcement learning (MARL) enable sequential decision making for a range of exciting multi-agent applications such as cooperative AI and autonomous driving. Explaining agent decisions is crucial for improving…

Artificial Intelligence · Computer Science 2022-05-24 Kayla Boggess , Sarit Kraus , Lu Feng

With the advancement of Agentic AI, researchers are increasingly leveraging autonomous agents to address challenges in software engineering (SE). However, the large language models (LLMs) that underpin these agents often function as black…

Software Engineering · Computer Science 2026-04-03 Jingyue Li , André Storhaug

Credit assignment, the process of attributing credit or blame to individual agents for their contributions to a team's success or failure, remains a fundamental challenge in multi-agent reinforcement learning (MARL), particularly in…

End-to-end autonomous driving has emerged as a promising approach to unify perception, prediction, and planning within a single framework, reducing information loss and improving adaptability. However, existing methods often rely on fixed…

Robotics · Computer Science 2025-07-18 Yuhang Lu , Jiadong Tu , Yuexin Ma , Xinge Zhu

Automated Program Repair (APR) agents leverage Large Language Models (LLMs) to autonomously diagnose and fix software bugs through reasoning, planning, and tool use. Despite impressive leaderboard gains on benchmarks such as SWE-bench,…

Software Engineering · Computer Science 2026-05-28 Ira Ceka , Hailie Mitchell , Saurabh Pujar , Luca Buratti , Shyam Ramji , Junfeng Yang , Gail Kaiser , Baishakhi Ray

Large language models (LLMs) are increasingly used in scientific domains. While they can produce reasoning-like content via methods such as chain-of-thought prompting, these outputs are typically unstructured and informal, obscuring whether…

Artificial Intelligence · Computer Science 2025-11-18 Pengze Li , Jiaqi Liu , Junchi Yu , Lihao Liu , Mingyu Ding , Wanli Ouyang , Shixiang Tang , Xi Chen

Large language models (LLMs) can already identify patterns and reason effectively, yet their variable accuracy hampers adoption in high-stakes decision-making applications. In this paper, we study this issue from a venture capital…

Artificial Intelligence · Computer Science 2025-10-28 Rick Chen , Joseph Ternasky , Aaron Ontoyin Yin , Xianling Mu , Fuat Alican , Yigit Ihlamur

Software architecture design is a fundamental part of creating every software system. Despite its importance, producing a C4 software architecture model, the preferred notation for such architecture, remains manual and time-consuming. We…

Software Engineering · Computer Science 2025-10-28 Kamil Szczepanik , Jarosław A. Chudziak

Performance evaluation of Retrieval-Augmented Generation (RAG) systems within enterprise environments is governed by multi-dimensional and composite factors extending far beyond simple final accuracy checks. These factors include reasoning…

Computation and Language · Computer Science 2026-04-06 Kenichirou Narita , Siqi Peng , Taku Fukui , Moyuru Yamada , Satoshi Munakata , Satoru Takahashi
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