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A key goal of modern materials science is accelerating the pace of materials discovery. Self-driving labs, or systems that select experiments using machine learning and then execute them using automation, are designed to fulfil this promise…

Computational Physics · Physics 2025-08-12 Adedire D. Adesiji , Jiashuo Wang , Cheng-Shu Kuo , Keith A. Brown

Scan line levelling, a ubiquitous and often necessary step in AFM data processing, can cause a severe bias on measured roughness parameters such as mean square roughness or correlation length. Although bias estimates have been formulated,…

Data Analysis, Statistics and Probability · Physics 2024-06-06 David Nečas

Large language models (LLMs) are revolutionizing self driving laboratories (SDLs) for materials research, promising unprecedented acceleration of scientific discovery. However, current SDL implementations rely on rigid protocols that fail…

Discovering explicit physical laws has traditionally depended on human intuition and domain expertise. Recent advances in artificial intelligence, particularly large language models (LLMs), offer a new route to accelerate this process by…

Materials Science · Physics 2026-01-30 Bo Hu , Siyu Liu , Beilin Ye , Yun Hao , Yanhui Liu , Yang Lu , Ju Li , David J. Srolovitz , Tongqi Wen

Soft robots are intrinsically capable of adapting to different environments by changing their shape in response to interaction forces with the environment. However, sensing and feedback are still required for higher level decisions and…

Soft Condensed Matter · Physics 2023-10-18 Shibo Zou , Sergio Picella , Jelle de Vries , Vera Kortman , Aimée Sakes , Johannes T. B. Overvelde

We introduce SasAgent, a multi-agent AI system powered by large language models (LLMs) that automates small-angle scattering (SAS) data analysis by leveraging tools from the SasView software and enables user interaction via text input.…

Artificial Intelligence · Computer Science 2025-09-09 Lijie Ding , Changwoo Do

Structure determination workloads in neutron diffractometry are computationally expensive and routinely require several hours to many days to determine the structure of a material from its neutron diffraction patterns. The potential for…

Machine Learning · Computer Science 2025-06-16 Tianle Wang , Jorge Ramirez , Cristina Garcia-Cardona , Thomas Proffen , Shantenu Jha , Sudip K. Seal

Complex vehicle routing problems (VRPs) remain a fundamental challenge, demanding substantial expert effort for intent interpretation and algorithm design. While large language models (LLMs) offer a promising path toward automation, current…

Artificial Intelligence · Computer Science 2026-02-17 Ni Zhang , Zhiguang Cao , Jianan Zhou , Cong Zhang , Yew-Soon Ong

Natural organisms can convert environmental stimuli into sensory feedback to regulate their body and realize active adaptivity. However, realizing such a feedback-regulation mechanism in synthetic material systems remains a grand challenge.…

Robotics · Computer Science 2024-12-23 Jianfeng Yang , Haotian Pi , Zixuan Deng , Hongshuang Guo , Wan Shou , Hang Zhang , Hao Zeng

Flatland is a simple, lightweight environment for fast prototyping and testing of reinforcement learning agents. It is of lower complexity compared to similar 3D platforms (e.g. DeepMind Lab or VizDoom), but emulates physical properties of…

Machine Learning · Computer Science 2018-09-11 Hugo Caselles-Dupré , Louis Annabi , Oksana Hagen , Michael Garcia-Ortiz , David Filliat

Recently, using Large Language Models (LLMs) to generate optimization models from natural language descriptions has became increasingly popular. However, a major open question is how to validate that the generated models are correct and…

Artificial Intelligence · Computer Science 2026-04-07 Alexander Zadorojniy , Segev Wasserkrug , Eitan Farchi

A major challenge in autonomous vehicle research is modeling agent behaviors, which has critical applications including constructing realistic and reliable simulations for off-board evaluation and forecasting traffic agents motion for…

Artificial Intelligence · Computer Science 2024-09-30 Zhenghao Peng , Wenjie Luo , Yiren Lu , Tianyi Shen , Cole Gulino , Ari Seff , Justin Fu

Deep neural networks are highly susceptible to overfitting noisy labels, which leads to degraded performance. Existing methods address this issue by employing manually defined criteria, aiming to achieve optimal partitioning in each…

Computer Vision and Pattern Recognition · Computer Science 2025-02-04 Wenzhen Zhang , Debo Cheng , Guangquan Lu , Bo Zhou , Jiaye Li , Shichao Zhang

Active learning (AL) aims to optimize model training and reduce annotation costs by selecting the most informative samples for labeling. Typically, AL methods rely on the empirical distribution of labeled data to define the decision…

Computation and Language · Computer Science 2025-07-23 Hui Xiang , Jinqiao Shi , Ting Zhang , Xiaojie Zhao , Yong Liu , Yong Ma

Self-driving laboratories promise to accelerate materials discovery. Yet current automated solid-state synthesis platforms are limited to ambient conditions, thereby precluding their use for air-sensitive materials. Here, we present A-Lab…

Iterative-based methods have become mainstream in stereo matching due to their high performance. However, these methods heavily rely on labeled data and face challenges with unlabeled real-world data. To this end, we propose a…

Computer Vision and Pattern Recognition · Computer Science 2025-04-01 Jingyi Zhou , Peng Ye , Haoyu Zhang , Jiakang Yuan , Rao Qiang , Liu YangChenXu , Wu Cailin , Feng Xu , Tao Chen

Machine learning has emerged as a powerful tool in materials discovery, enabling the rapid design of novel materials with tailored properties for countless applications, including in the context of energy and sustainability. To ensure the…

In this study, the first-of-its-kind use of active learning (AL) framework in thermal spray is adapted to improve the prediction accuracy of the in-flight particle characteristics and uses Gaussian Process (GP) ML model as a surrogate that…

Optimizing fluid-dynamic performance is an important engineering task. Traditionally, experts design shapes based on empirical estimations and verify them through expensive experiments. This costly process, both in terms of time and space,…

Computational Engineering, Finance, and Science · Computer Science 2020-01-24 Yang Chen

Quality control is a crucial activity performed by manufacturing enterprises to ensure that their products meet quality standards and avoid potential damage to the brand's reputation. The decreased cost of sensors and connectivity enabled…

Machine Learning · Computer Science 2022-11-28 Jože M. Rožanec , Luka Bizjak , Elena Trajkova , Patrik Zajec , Jelle Keizer , Blaž Fortuna , Dunja Mladenić