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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 integration of artificial intelligence into various domains is rapidly increasing, with Large Language Models (LLMs) becoming more prevalent in numerous applications. This work is included in an overall project which aims to train an…

Computational Physics · Physics 2025-01-09 Christophe Bajan , Guillaume Lambard

Although several methods were proposed to address the problem of automated essay scoring (AES) in the last 50 years, there is still much to desire in terms of effectiveness. Large Language Models (LLMs) are transformer-based models that…

Computation and Language · Computer Science 2024-04-17 Watheq Mansour , Salam Albatarni , Sohaila Eltanbouly , Tamer Elsayed

Large Language Model (LLM)-based agents have shown effectiveness across many applications. However, their use in data science scenarios requiring solving long-term interconnected tasks, dynamic data adjustments and domain expertise remains…

Large Language Models (LLMs) exhibit emerging in-context learning abilities through prompt engineering. The recent progress in large-scale generative models has further expanded their use in real-world language applications. However, the…

Computation and Language · Computer Science 2024-04-12 Linyi Yang , Shuibai Zhang , Zhuohao Yu , Guangsheng Bao , Yidong Wang , Jindong Wang , Ruochen Xu , Wei Ye , Xing Xie , Weizhu Chen , Yue Zhang

Large language models (LLMs) have demonstrated remarkable performance across a wide range of tasks and domains, with data playing a central role in enabling these advances. Despite this success, the preparation and effective utilization of…

Computation and Language · Computer Science 2026-03-17 Hao Liang , Zhengyang Zhao , Zhaoyang Han , Meiyi Qiang , Xiaochen Ma , Bohan Zeng , Qifeng Cai , Zhiyu Li , Linpeng Tang , Weinan E , Wentao Zhang

Synthetically-generated data plays an increasingly larger role in training large language models. However, while synthetic data has been found to be useful, studies have also shown that without proper curation it can cause LLM performance…

Machine Learning · Computer Science 2025-12-02 Kareem Amin , Sara Babakniya , Alex Bie , Weiwei Kong , Umar Syed , Sergei Vassilvitskii

As large language models (LLMs) become more advanced and impactful, it is increasingly important to scrutinize the data that they rely upon and produce. What is it to be a dataset practitioner doing this work? We approach this in two parts:…

Computation and Language · Computer Science 2024-04-03 Crystal Qian , Emily Reif , Minsuk Kahng

For researchers leveraging Large-Language Models (LLMs) in the generation of training datasets, especially for conversational recommender systems - the absence of robust evaluation frameworks has been a long-standing problem. The efficiency…

Computation and Language · Computer Science 2022-12-19 Harsh Lara , Manoj Tiwari

The reasoning capabilities of Large Language Models (LLMs) play a critical role in many downstream tasks, yet depend strongly on the quality of training data. Despite various proposed data construction methods, their practical utility in…

Computation and Language · Computer Science 2025-10-09 Yike Zhao , Simin Guo , Ziqing Yang , Shifan Han , Dahua Lin , Fei Tan

The adoption of Large Language Models (LLMs) for code generation in data science offers substantial potential for enhancing tasks such as data manipulation, statistical analysis, and visualization. However, the effectiveness of these models…

Software Engineering · Computer Science 2024-11-20 Nathalia Nascimento , Everton Guimaraes , Sai Sanjna Chintakunta , Santhosh Anitha Boominathan

Fine-tuning of Large Language Models (LLMs) for downstream tasks, performed on domain-specific data has shown significant promise. However, commercial use of such LLMs is limited by the high computational cost required for their deployment…

Computation and Language · Computer Science 2025-03-06 Boris Nazarov , Darya Frolova , Yackov Lubarsky , Alexei Gaissinski , Pavel Kisilev

Advances towards more faithful and traceable answers of Large Language Models (LLMs) are crucial for various research and practical endeavors. One avenue in reaching this goal is basing the answers on reliable sources. However, this…

Computation and Language · Computer Science 2024-06-04 Tobias Schimanski , Jingwei Ni , Mathias Kraus , Elliott Ash , Markus Leippold

Evaluations are critical for understanding the capabilities of large language models (LLMs). Fundamentally, evaluations are experiments; but the literature on evaluations has largely ignored the literature from other sciences on experiment…

Applications · Statistics 2024-11-04 Evan Miller

The advent of Large Language Models (LLM) has revolutionized the efficiency and speed with which tasks are completed, marking a significant leap in productivity through technological innovation. As these chatbots tackle increasingly complex…

Software Engineering · Computer Science 2024-05-24 Luc Bryan Heitz , Joun Chamas , Christopher Scherb

Task automation has been greatly empowered by the recent advances in Large Language Models (LLMs) via Python code, where the tasks ranging from software engineering development to general-purpose reasoning. While current benchmarks have…

Large-language models are capable of completing a variety of tasks, but remain unpredictable and intractable. Representation engineering seeks to resolve this problem through a new approach utilizing samples of contrasting inputs to detect…

Artificial Intelligence · Computer Science 2025-02-26 Lukasz Bartoszcze , Sarthak Munshi , Bryan Sukidi , Jennifer Yen , Zejia Yang , David Williams-King , Linh Le , Kosi Asuzu , Carsten Maple

The integration of large language models (LLMs) into automated algorithm design has shown promising potential. A prevalent approach embeds LLMs within search routines to iteratively generate and refine candidate algorithms. However, most…

Machine Learning · Computer Science 2026-05-20 Fei Liu , Rui Zhang , Xi Lin , Zhichao Lu , Qingfu Zhang

The emergence of large language models (LLMs) has sparked enormous interest due to their potential application across a range of educational tasks. For example, recent work in programming education has used LLMs to generate learning…

Software Engineering · Computer Science 2024-05-10 Charles Koutcheme , Nicola Dainese , Sami Sarsa , Juho Leinonen , Arto Hellas , Paul Denny
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