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Related papers: LAMBench: A Benchmark for Large Atomistic Models

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Large Language Models (LLMs) have demonstrated impressive capabilities across a wide range of tasks. However, their proficiency and reliability in the specialized domain of financial data analysis, particularly focusing on data-driven…

Computation and Language · Computer Science 2024-06-17 Shu Liu , Shangqing Zhao , Chenghao Jia , Xinlin Zhuang , Zhaoguang Long , Jie Zhou , Aimin Zhou , Man Lan , Qingquan Wu , Chong Yang

The capacity of Large Language Models (LLMs) to generate valid scientific hypotheses for materials synthesis remains largely unquantified, hindered by the absence of benchmarks probing physicochemical logics reasoning. To address this, we…

Materials Science · Physics 2025-10-01 Yingming Pu , Tao Lin , Hongyu Chen

Scaling up data, parameters, and test-time computation has been the mainstream methods to improve LLM systems (LLMsys), but their upper bounds are almost reached due to the gradual depletion of high-quality data and marginal gains obtained…

Machine Learning · Computer Science 2026-05-12 Qingyao Ai , Yichen Tang , Changyue Wang , Jianming Long , Weihang Su , Yiqun Liu

Research on Artificial Intelligence (AI)-based Data Assimilation (DA) is expanding rapidly. However, the absence of an objective, comprehensive, and real-world benchmark hinders the fair comparison of diverse methods. Here, we introduce…

Machine Learning · Computer Science 2026-02-17 Wuxin Wang , Weicheng Ni , Ben Fei , Tao Han , Lilan Huang , Taikang Yuan , Xiaoyong Li , Lei Bai , Boheng Duan , Kaijun Ren

As models become increasingly sophisticated, conventional algorithm benchmarks are increasingly saturated, underscoring the need for more challenging benchmarks to guide future improvements in algorithmic reasoning. This paper introduces…

Artificial Intelligence · Computer Science 2025-06-13 Yaoming Zhu , Junxin Wang , Yiyang Li , Lin Qiu , ZongYu Wang , Jun Xu , Xuezhi Cao , Yuhuai Wei , Mingshi Wang , Xunliang Cai , Rong Ma

Large Multimodal Models (LMMs) exhibit major shortfalls when interpreting images and, by some measures, have poorer spatial cognition than small children or animals. Despite this, they attain high scores on many popular visual benchmarks,…

The emergence of Large Language Models (LLMs) has catalyzed a paradigm shift in programming, giving rise to "vibe coding", where users can build complete projects and even control computers using natural language instructions. This paradigm…

Software Engineering · Computer Science 2026-03-27 Fanheng Kong , Jingyuan Zhang , Yang Yue , Chenxi Sun , Yang Tian , Shi Feng , Xiaocui Yang , Daling Wang , Yu Tian , Jun Du , Wenchong Zeng , Han Li , Kun Gai

Uncovering hidden symbolic laws from time series data, as an aspiration dating back to Kepler's discovery of planetary motion, remains a core challenge in scientific discovery and artificial intelligence. While Large Language Models show…

Artificial Intelligence · Computer Science 2026-04-27 Zewen Liu , Juntong Ni , Xianfeng Tang , Max S. Y. Lau , Qi He , Wenpeng Yin , Wei Jin

There is an increasing body of work using Large Language Models (LLMs) as agents for orchestrating workflows and making decisions in domains that require planning and multi-step reasoning. As a result, it is imperative to evaluate LLMs on…

Artificial Intelligence · Computer Science 2026-03-03 Harsha Kokel , Michael Katz , Kavitha Srinivas , Shirin Sohrabi

Recently, there has been a growing interest among large language model (LLM) developers in LLM-based document reading systems, which enable users to upload their own documents and pose questions related to the document contents, going…

Computation and Language · Computer Science 2024-07-16 Anni Zou , Wenhao Yu , Hongming Zhang , Kaixin Ma , Deng Cai , Zhuosheng Zhang , Hai Zhao , Dong Yu

Large language models (LLMs) are increasingly applied to materials science questions, including literature comprehension, property prediction, materials discovery and alloy design. At the same time, a wide range of physics-based…

Materials Science · Physics 2025-12-17 Siyu Liu , Bo Hu , Beilin Ye , Jiamin Xu , David J. Srolovitz , Tongqi Wen

The advancement and extensive application of large language models (LLMs) have been remarkable, including their use in scientific research assistance. However, these models often generate scientifically incorrect or unsafe responses, and in…

Computation and Language · Computer Science 2024-11-28 Haochen Zhao , Xiangru Tang , Ziran Yang , Xiao Han , Xuanzhi Feng , Yueqing Fan , Senhao Cheng , Di Jin , Yilun Zhao , Arman Cohan , Mark Gerstein

By virtue of its great utility in solving real-world problems, optimization modeling has been widely employed for optimal decision-making across various sectors, but it requires substantial expertise from operations research professionals.…

The pursuit of leaderboard rankings in Large Language Models (LLMs) has created a fundamental paradox: models excel at standardized tests while failing to demonstrate genuine language understanding and adaptability. Our systematic analysis…

Computation and Language · Computer Science 2024-12-06 Sourav Banerjee , Ayushi Agarwal , Eishkaran Singh

Inspired by the success of Large Language Models (LLMs), the development of Large Atom Models (LAMs) has gained significant momentum in scientific computation. Since 2022, the Deep Potential team has been actively pretraining LAMs and…

Machine Learning · Computer Science 2025-01-29 Anyang Peng , Xinzijian Liu , Ming-Yu Guo , Linfeng Zhang , Han Wang

Model merging provides a scalable alternative to multi-task training by combining specialized finetuned models through parameter arithmetic, enabling efficient deployment without the need for joint training or access to all task data. While…

Machine Learning · Computer Science 2025-10-21 Yifei He , Siqi Zeng , Yuzheng Hu , Rui Yang , Tong Zhang , Han Zhao

Over the past decade, Artificial Intelligence (AI) has had great success recently and is being used in a wide range of academic and industrial fields. More recently, LLMs have made rapid advancements that have propelled AI to a new level,…

Machine Learning · Computer Science 2024-06-17 Da Song , Xuan Xie , Jiayang Song , Derui Zhu , Yuheng Huang , Felix Juefei-Xu , Lei Ma

Composable AI offers a scalable and effective paradigm for tackling complex AI tasks by decomposing them into sub-tasks and solving each sub-task using ready-to-use well-trained models. However, systematically evaluating methods under this…

Artificial Intelligence · Computer Science 2025-08-05 Tung-Thuy Pham , Duy-Quan Luong , Minh-Quan Duong , Trung-Hieu Nguyen , Thu-Trang Nguyen , Son Nguyen , Hieu Dinh Vo

Existing benchmarks for evaluating mathematical reasoning in large language models (LLMs) rely primarily on competition problems, formal proofs, or artificially challenging questions -- failing to capture the nature of mathematics…

Artificial Intelligence · Computer Science 2025-10-21 Jie Zhang , Cezara Petrui , Kristina Nikolić , Florian Tramèr

Jailbreak attacks cause large language models (LLMs) to generate harmful, unethical, or otherwise objectionable content. Evaluating these attacks presents a number of challenges, which the current collection of benchmarks and evaluation…