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Large Language Models (LLMs) create exciting possibilities for powerful language processing tools to accelerate research in materials science. While LLMs have great potential to accelerate materials understanding and discovery, they…

材料科学 · 物理学 2024-09-26 Santiago Miret , N M Anoop Krishnan

Discovering new materials can have significant scientific and technological implications but remains a challenging problem today due to the enormity of the chemical space. Recent advances in machine learning have enabled data-driven methods…

材料科学 · 物理学 2024-06-21 Shuyi Jia , Chao Zhang , Victor Fung

Pre-trained Large Language Models (LLMs) are beginning to dominate the discourse around automatic code generation with natural language specifications. In contrast, the best-performing synthesizers in the domain of formal synthesis with…

人工智能 · 计算机科学 2024-05-28 Yixuan Li , Julian Parsert , Elizabeth Polgreen

To retrieve and compare scientific data of simulations and experiments in materials science, data needs to be easily accessible and machine readable to qualify and quantify various materials science phenomena. The recent progress in open…

材料科学 · 物理学 2025-03-25 Balduin Katzer , Steffen Klinder , Katrin Schulz

The creation of systematic literature reviews (SLR) is critical for analyzing the landscape of a research field and guiding future research directions. However, retrieving and filtering the literature corpus for an SLR is highly…

机器学习 · 计算机科学 2026-02-18 Lucas Joos , Daniel A. Keim , Maximilian T. Fischer

Enabling Large Language Models (LLMs) to generate citations in Question-Answering (QA) tasks is an emerging paradigm aimed at enhancing the verifiability of their responses when LLMs are utilizing external references to generate an answer.…

计算与语言 · 计算机科学 2024-12-18 Jiajun Shen , Tong Zhou , Yubo Chen , Kang Liu

A long standing goal of the data management community is to develop general, automated systems that ingest semi-structured documents and output queryable tables without human effort or domain specific customization. Given the sheer variety…

计算与语言 · 计算机科学 2025-03-10 Simran Arora , Brandon Yang , Sabri Eyuboglu , Avanika Narayan , Andrew Hojel , Immanuel Trummer , Christopher Ré

Large Language Models (LLMs) are increasingly utilized for large-scale extraction and organization of unstructured data owing to their exceptional Natural Language Processing (NLP) capabilities. Empowering materials design, vast amounts of…

数字图书馆 · 计算机科学 2025-12-11 Wenkai Ning , Musen Li , Jeffrey R. Reimers , Rika Kobayashi

The synthesis of inorganic crystalline materials is essential for modern technology, especially in quantum materials development. However, designing efficient synthesis workflows remains a significant challenge due to the precise…

A major barrier to developing vision large language models (LLMs) in dermatology is the lack of large image--text pairs dataset. We introduce DermaSynth, a dataset comprising of 92,020 synthetic image--text pairs curated from 45,205 images…

Enhancing the mathematical reasoning of large language models (LLMs) demands high-quality training data, yet conventional methods face critical challenges in scalability, cost, and data reliability. To address these limitations, we propose…

计算与语言 · 计算机科学 2025-08-27 Sirui Chen , Changxin Tian , Binbin Hu , Kunlong Chen , Ziqi Liu , Zhiqiang Zhang , Jun Zhou

Scientific literature understanding is crucial for extracting targeted information and garnering insights, thereby significantly advancing scientific discovery. Despite the remarkable success of Large Language Models (LLMs), they face…

机器学习 · 计算机科学 2025-04-21 Sihang Li , Jin Huang , Jiaxi Zhuang , Yaorui Shi , Xiaochen Cai , Mingjun Xu , Xiang Wang , Linfeng Zhang , Guolin Ke , Hengxing Cai

Objective: This study aims to summarize the usage of Large Language Models (LLMs) in the process of creating a scientific review. We look at the range of stages in a review that can be automated and assess the current state-of-the-art…

数字图书馆 · 计算机科学 2025-05-16 Dmitry Scherbakov , Nina Hubig , Vinita Jansari , Alexander Bakumenko , Leslie A. Lenert

Large language models (LLMs) offer new opportunities for automated data extraction and property prediction across materials science, yet their use in superconductivity research remains limited. Here we construct a large experimental…

材料科学 · 物理学 2025-12-12 Suman Itani , Yibo Zhang , Ranjit Itani , Jiadong Zang

Large language models (LLMs) have demonstrated remarkable capabilities in text analysis tasks, yet their evaluation on complex, real-world applications remains challenging. We define a set of tasks, Multi-Insight Multi-Document Extraction…

计算与语言 · 计算机科学 2024-12-02 John Francis , Saba Esnaashari , Anton Poletaev , Sukankana Chakraborty , Youmna Hashem , Jonathan Bright

This paper presents a specialized methodology for digitizing and segmenting mathematical documents from zbMATH Open, a comprehensive database of mathematical literature, to enhance machine processing capabilities. Currently, approximately…

数字图书馆 · 计算机科学 2026-04-02 Ivan Pluzhnikov , Ankit Satpute , Moritz Schubotz , Olaf Teschke , Bela Gipp

This research explores the application of large language models (LLMs) to generate synthetic datasets for Product Desirability Toolkit (PDT) testing, a key component in evaluating user sentiment and product experience. Utilizing…

计算与语言 · 计算机科学 2025-03-11 John D. Hastings , Sherri Weitl-Harms , Joseph Doty , Zachary J. Myers , Warren Thompson

Large Language Models (LLMs) have emerged as powerful tools for generating data across various modalities. By transforming data from a scarce resource into a controllable asset, LLMs mitigate the bottlenecks imposed by the acquisition costs…

Chemputation is the process of programming chemical robots to do experiments using a universal symbolic language, but the literature can be error prone and hard to read due to ambiguities. Large Language Models (LLMs) have demonstrated…

人工智能 · 计算机科学 2024-10-10 Sebastian Pagel , Michael Jirasek , Leroy Cronin

Large language models (LLMs) are rapidly transforming materials science. This review examines recent LLM applications across the materials discovery pipeline, focusing on three key areas: mining scientific literature , predictive modelling,…

计算与语言 · 计算机科学 2025-11-17 Fengxu Yang , Weitong Chen , Jack D. Evans