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In the field of inorganic materials science, there is a growing demand to extract knowledge such as physical properties and synthesis processes of materials by machine-reading a large number of papers. This is because materials researchers…

Computation and Language · Computer Science 2021-06-29 Fusataka Kuniyoshi , Jun Ozawa , Makoto Miwa

The number of scientific journal articles and reports being published about energetic materials every year is growing exponentially, and therefore extracting relevant information and actionable insights from the latest research is becoming…

Computation and Language · Computer Science 2019-03-04 Daniel C. Elton , Dhruv Turakhia , Nischal Reddy , Zois Boukouvalas , Mark D. Fuge , Ruth M. Doherty , Peter W. Chung

The design of sustainable materials requires access to materials performance and sustainability data from literature corpus in an organized, structured and automated manner. Natural language processing approaches, particularly large…

The promise of data-driven materials discovery remains constrained by the scarcity of large, high-quality, and accessible experimental datasets. Here, we introduce a generalizable large language model (LLM)-powered pipeline for automated…

Materials Science · Physics 2026-04-28 Zhanzhao Li , Kengran Yang , Qiyao He , Kai Gong

We present a simulation of various active learning strategies for the discovery of polymer solar cell donor/acceptor pairs using data extracted from the literature spanning $\sim$20 years by a natural language processing pipeline. While…

Materials Science · Physics 2024-08-08 Pranav Shetty , Aishat Adeboye , Sonakshi Gupta , Chao Zhang , Rampi Ramprasad

In this paper, we present a novel approach to knowledge extraction and retrieval using Natural Language Processing (NLP) techniques for material science. Our goal is to automatically mine structured knowledge from millions of research…

Computation and Language · Computer Science 2023-02-14 Xianjun Yang , Stephen Wilson , Linda Petzold

Materials language processing (MLP) is one of the key facilitators of materials science research, as it enables the extraction of structured information from massive materials science literature. Prior works suggested high-performance MLP…

Computation and Language · Computer Science 2023-08-21 Jaewoong Choi , Byungju Lee

Polymers are a vital part of everyday life. Their chemical universe is so large that it presents unprecedented opportunities as well as significant challenges to identify suitable application-specific candidates. We present a complete…

Materials Science · Physics 2023-07-20 Christopher Kuenneth , Rampi Ramprasad

This study is dedicated to assessing the capabilities of large language models (LLMs) such as GPT-3.5-Turbo, GPT-4, and GPT-4-Turbo in extracting structured information from scientific documents in materials science. To this end, we…

Computation and Language · Computer Science 2024-06-03 Luca Foppiano , Guillaume Lambard , Toshiyuki Amagasa , Masashi Ishii

Most of the knowledge in materials science literature is in the form of unstructured data such as text and images. Here, we present a framework employing natural language processing, which automates text and image comprehension and…

Digital Libraries · Computer Science 2021-01-06 Vineeth Venugopal , Sourav Sahoo , Mohd Zaki , Manish Agarwal , Nitya Nand Gosvami , N. M. Anoop Krishnan

Discovering authoritative links between publications and the datasets that they use can be a labor-intensive process. We introduce a natural language processing pipeline that retrieves and reviews publications for informal references to…

Digital Libraries · Computer Science 2023-05-03 Sara Lafia , Lizhou Fan , Libby Hemphill

Accurate and comprehensive material databases extracted from research papers are crucial for materials science and engineering, but their development requires significant human effort. With large language models (LLMs) transforming the way…

Abundant and diverse data on medicines manufacturing and other lifecycle components has been made easily accessible in the last decades. However, a significant proportion of this information is characterised by not being tabulated and…

Information Retrieval · Computer Science 2025-05-02 Diego Alvarado-Maldonado , Blair Johnston , Cameron J. Brown

Scientific literature is one of the most significant resources for sharing knowledge. Researchers turn to scientific literature as a first step in designing an experiment. Given the extensive and growing volume of literature, the common…

Computation and Language · Computer Science 2021-09-28 Xintong Zhao , Steven Lopez , Semion Saikin , Xiaohua Hu , Jane Greenberg

As the application of large language models in various fields continues to expand, materials science also ushers in opportunities for AI-driven innovation. The traditional way of relying on manual search for materials science-related…

Artificial Intelligence · Computer Science 2024-11-14 Chao Huang , Huichen Xiao , Chen Chen , Chunyan Chen , Yi Zhao , Shiyu Du , Yiming Zhang , He Sha , Ruixin Gu

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…

Digital Libraries · Computer Science 2025-12-11 Wenkai Ning , Musen Li , Jeffrey R. Reimers , Rika Kobayashi

Automated knowledge extraction from scientific literature can potentially accelerate materials discovery. We have investigated an approach for extracting synthesis protocols for reticular materials from scientific literature using large…

The rapid discovery of materials is constrained by the lack of large, machine-readable datasets that couple performance metrics with structural context. Existing databases are either small, manually curated, or biased toward first…

Machine Learning · Computer Science 2026-03-10 Subham Ghosh , Abhishek Tewari

We present a demonstration of the utility of NLP for aiding research into energetic materials and associated systems. The NLP method enables machine understanding of textual data, offering an automated route to knowledge discovery and…

Computation and Language · Computer Science 2024-02-13 Francis G. VanGessel , Efrem Perry , Salil Mohan , Oliver M. Barham , Mark Cavolowsky

This paper investigates the use of large language models (LLMs) for extracting sample lists of polymer nanocomposites (PNCs) from full-length materials science research papers. The challenge lies in the complex nature of PNC samples, which…

Computation and Language · Computer Science 2024-03-04 Ghazal Khalighinejad , Defne Circi , L. C. Brinson , Bhuwan Dhingra
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