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Discovering materials with desirable properties in an efficient way remains a significant problem in materials science. Many studies have tackled this problem by using different sets of information available about the materials. Among them,…

Materials Science · Physics 2025-03-04 Onur Boyar , Indra Priyadarsini , Seiji Takeda , Lisa Hamada

Large language models (LLMs) present novel opportunities in public opinion research by predicting survey responses in advance during the early stages of survey design. Prior methods steer LLMs via descriptions of subpopulations as LLMs'…

Computation and Language · Computer Science 2026-04-17 Joseph Suh , Erfan Jahanparast , Suhong Moon , Minwoo Kang , Serina Chang

Large Language Models (LLMs) have long held sway in the realms of artificial intelligence research. Numerous efficient techniques, including weight pruning, quantization, and distillation, have been embraced to compress LLMs, targeting…

Artificial Intelligence · Computer Science 2024-11-01 Xuan Shen , Pu Zhao , Yifan Gong , Zhenglun Kong , Zheng Zhan , Yushu Wu , Ming Lin , Chao Wu , Xue Lin , Yanzhi Wang

Large language models are increasingly deployed in settings where reliability matters, yet output-level uncertainty signals such as token probabilities, entropy, and self-consistency can become brittle under calibration--deployment…

Computation and Language · Computer Science 2026-04-20 Yanli Wang , Peng Kuang , Xiaoyu Han , Kaidi Xu , Haohan Wang

While Large Language Models (LLMs) have exhibited remarkable emergent capabilities through extensive pre-training, they still face critical limitations in generalizing to specialized domains and handling diverse linguistic variations, known…

Computation and Language · Computer Science 2025-05-28 Jinwu Hu , Zhitian Zhang , Guohao Chen , Xutao Wen , Chao Shuai , Wei Luo , Bin Xiao , Yuanqing Li , Mingkui Tan

Software languages evolve over time for reasons such as feature additions. When grammars evolve, textual instances that originally conformed to them may become outdated. While model-driven engineering provides many techniques for…

Software Engineering · Computer Science 2026-02-13 Weixing Zhang , Bowen Jiang , Yuhong Fu , Anne Koziolek , Regina Hebig , Daniel Strüber

Fine-tuning Large Language Models (LLMs) on specific datasets is a common practice to improve performance on target tasks. However, this performance gain often leads to overfitting, where the model becomes too specialized in either the task…

Computation and Language · Computer Science 2024-09-10 Sonam Gupta , Yatin Nandwani , Asaf Yehudai , Mayank Mishra , Gaurav Pandey , Dinesh Raghu , Sachindra Joshi

Large language models (LLMs) exhibit substantial potential across diverse scientific disciplines, including materials science. A property prediction framework, ZEBRA-Prop (Zero-Shot Embedding-Based Rapid and Accessible Regression Model for…

Materials Science · Physics 2026-03-30 Ryoma Yamamoto , Akira Takahashi , Kei Terayama , Yu Kumagai , Fumiyasu Oba

This research was focused on the efficient collection of experimental Metal-Organic Framework (MOF) data from scientific literature to address the challenges of accessing hard-to-find data and improving the quality of information available…

Materials Science · Physics 2024-04-23 Wonseok Lee , Yeonghun Kang , Taeun Bae , Jihan Kim

Various Large Language Models~(LLMs) from the Generative Pretrained Transformer(GPT) family have achieved outstanding performances in a wide range of text generation tasks. However, the enormous model sizes have hindered their practical use…

Computation and Language · Computer Science 2024-04-24 Hang Shao , Bei Liu , Bo Xiao , Ke Zeng , Guanglu Wan , Yanmin Qian

Recent advancements in language models (LMs) have led to the emergence of powerful models such as Small LMs (e.g., T5) and Large LMs (e.g., GPT-4). These models have demonstrated exceptional capabilities across a wide range of tasks, such…

Computation and Language · Computer Science 2024-05-07 Mingchen Li , Rui Zhang

Machine learning is transforming materials discovery by providing rapid predictions of material properties, which enables large-scale screening for target materials. However, such models require training data. While automated data…

Large Language Models (LLMs) have demonstrated remarkable capabilities in code understanding and generation. However, their effectiveness on non-code Software Engineering (SE) tasks remains underexplored. We present 'Software Engineering…

Software Engineering · Computer Science 2026-02-12 Fabian C. Peña , Steffen Herbold

Data-driven soft sensors (DDSS) have become mainstream methods for predicting key performance indicators in process industries. However, DDSS development requires complex and costly customized designs tailored to various tasks during the…

Artificial Intelligence · Computer Science 2025-01-10 Shuo Tong , Han Liu , Runyuan Guo , Xueqiong Tian , Wenqing Wang , Ding Liu , Youmin Zhang

State-of-the-art neural network language models (NNLMs) represented by long short term memory recurrent neural networks (LSTM-RNNs) and Transformers are becoming highly complex. They are prone to overfitting and poor generalization when…

Computation and Language · Computer Science 2022-08-30 Boyang Xue , Shoukang Hu , Junhao Xu , Mengzhe Geng , Xunying Liu , Helen Meng

Deploying Large Language Models (LLMs) on edge devices faces severe computational and memory constraints, limiting real-time processing and on-device intelligence. Hybrid architectures combining Structured State Space Models (SSMs) with…

Machine Learning · Computer Science 2026-04-16 Jason Kong , Nilesh Prasad Pandey , Flavio Ponzina , Tajana Rosing

The rapid advancement of Large Language Models (LLMs) in the realm of mathematical reasoning necessitates comprehensive evaluations to gauge progress and inspire future directions. Existing assessments predominantly focus on problem-solving…

Computation and Language · Computer Science 2024-06-05 Xiaoyuan Li , Wenjie Wang , Moxin Li , Junrong Guo , Yang Zhang , Fuli Feng

Large Language Models (LLMs) have significantly impacted numerous domains, including Software Engineering (SE). Many recent publications have explored LLMs applied to various SE tasks. Nevertheless, a comprehensive understanding of the…

Software Engineering · Computer Science 2024-04-11 Xinyi Hou , Yanjie Zhao , Yue Liu , Zhou Yang , Kailong Wang , Li Li , Xiapu Luo , David Lo , John Grundy , Haoyu Wang

A prominent achievement of natural language processing (NLP) is its ability to understand and generate meaningful human language. This capability relies on complex feedforward transformer block architectures pre-trained on large language…

Computation and Language · Computer Science 2025-11-11 Ronit D. Gross , Yarden Tzach , Tal Halevi , Ella Koresh , Ido Kanter

Recent work on pruning large language models (LLMs) has shown that one can eliminate a large number of parameters without compromising performance, making pruning a promising strategy to reduce LLM model size. Existing LLM pruning…

Machine Learning · Computer Science 2024-10-16 Haiquan Lu , Yefan Zhou , Shiwei Liu , Zhangyang Wang , Michael W. Mahoney , Yaoqing Yang
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