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Informed machine learning methods allow the integration of prior knowledge into learning systems. This can increase accuracy and robustness or reduce data needs. However, existing methods often assume hard constraining knowledge, that does…

机器学习 · 计算机科学 2024-10-10 Christian Schlauch , Nadja Klein , Christian Wirth

Establishing reliable and interpretable structure-property relationships in glasses is a longstanding challenge in condensed matter physics. While modern data-driven machine learning techniques have proven highly effective in establishing…

无序系统与神经网络 · 物理学 2026-02-06 Chenyan Wang , Mouyang Cheng , Ji Chen

It is well established that physical aging of amorphous solids is governed by a marked change in dynamical properties as the material becomes older. Conversely, structural properties such as the radial distribution function exhibit only a…

Around a glass transition, the dynamics of a supercooled liquid dramatically slow down, exhibited by caging of particles, while the structural changes remain subtle. In alternative to recent machine learning studies searching for structural…

无序系统与神经网络 · 物理学 2022-09-07 Kaihua Zhang , Xinyang Li , Yuliang Jin , Ying Jiang

Glass-like objects such as windows, bottles, and mirrors exist widely in the real world. Sensing these objects has many applications, including robot navigation and grasping. However, this task is very challenging due to the arbitrary…

计算机视觉与模式识别 · 计算机科学 2021-12-14 Hao He , Xiangtai Li , Guangliang Cheng , Jianping Shi , Yunhai Tong , Gaofeng Meng , Véronique Prinet , Lubin Weng

The viscosity of lead-containing glasses is of fundamental importance for the manufacturing process, and can be predicted by algorithms such as artificial neural networks. The SciGlass database was used to provide training, validation and…

软凝聚态物质 · 物理学 2022-11-22 Patrick dos Anjos , Lucas A. Quaresma , Marcelo L. P. Machado

Inorganic glasses, produced by the melt-quenching of a concoction of minerals, compounds, and elements, can possess unique optical and elastic properties along with excellent chemical, and thermal durability. Despite the ubiquitous use of…

材料科学 · 物理学 2021-03-24 R. Ravinder , Suresh Bishnoi , Mohd Zaki , N. M. Anoop Krishnan

Glass-like objects can be seen everywhere in our daily life which are very hard for existing methods to segment them. The properties of transparencies pose great challenges of detecting them from the chaotic background and the vague…

计算机视觉与模式识别 · 计算机科学 2024-02-15 Zhiyu Xu , Qingliang Chen

Due to their unique optical and electronic functionalities, chalcogenide glasses are materials of choice for numerous microelectronic and photonic devices. However, to extend the range of compositions and applications, profound knowledge…

Crystal graph neural networks are widely applicable in modeling experimentally synthesized compounds and hypothetical materials with unknown synthesizability. In contrast, structure-agnostic predictive algorithms allow exploring previously…

材料科学 · 物理学 2025-11-06 Ivan Rubtsov , Ivan Dudakov , Yuri Kuratov , Vadim Korolev

Property prediction accuracy has long been a key parameter of machine learning in materials informatics. Accordingly, advanced models showing state-of-the-art performance turn into highly parameterized black boxes missing interpretability.…

材料科学 · 物理学 2023-08-03 Vadim Korolev , Pavel Protsenko

Many glass products require thermoformed geometry with high precision. However, the traditional approach of developing a thermoforming process through trials and errors can cause large waste of time and resources and often end up with…

计算工程、金融与科学 · 计算机科学 2025-05-07 Yuzhou Zhang , Mohan Hua , Jinan Liu , Haihui Ruan

Synthesizing new materials efficiently is highly demanded in various research fields. However, this process is usually slow and expensive, especially for metallic glasses, whose formation strongly depends on the optimal combinations of…

机器学习 · 计算机科学 2025-11-18 K. -C. Ouyang , S. -Y. Zhang , S. -L. Liu , J. Tian , Y. -H. Li , H. Tong , H. -Y. Bai , W. -H. Wang , Y. -C. Hu

The accuracy of molecular simulations is fundamentally limited by the interatomic potentials that govern atomic interactions. Traditional potential development, which relies heavily on ab initio calculations, frequently struggles to…

无序系统与神经网络 · 物理学 2025-10-16 Ruoxia Chen , Kai Yang , Morten M. Smedskjaer , N. M. Anoop Krishnan , Jaime Marian , Fabian Rosner

Successful material selection is critical in designing and manufacturing products for design automation. Designers leverage their knowledge and experience to create high-quality designs by selecting the most appropriate materials through…

In glass bottle manufacturing, precise control of forming machines is critical for ensuring quality and minimizing defects. This study presents a deep learning-based control algorithm designed to optimize the forming process in real…

人工智能 · 计算机科学 2025-10-22 Mattia Pujatti , Andrea Di Luca , Nicola Peghini , Federico Monegaglia , Marco Cristoforetti

Glass composition screening is essential for advancing new glass materials, yet the inherent complexity of multicomponent systems presents significant challenges. Current supervised learning methods for this task rely heavily on large…

计算工程、金融与科学 · 计算机科学 2026-01-23 Meijing Chen , Bin Liu , Ying Liu , Tianrui Li

In the quest to understand how structure and dynamics are connected in glasses, a number of machine learning based methods have been developed that predict dynamics in supercooled liquids. These methods include both increasingly complex…

软凝聚态物质 · 物理学 2022-06-08 Rinske M. Alkemade , Emanuele Boattini , Laura Filion , Frank Smallenburg

Combinatorial and guided screening of materials space with density-functional theory and related approaches has provided a wealth of hypothetical inorganic materials, which are increasingly tabulated in open databases. The OPTIMADE API is a…

Predicting future sensory states is crucial for learning agents such as robots, drones, and autonomous vehicles. In this paper, we couple multiple sensory modalities with exploratory actions and propose a predictive neural network…

机器人学 · 计算机科学 2021-09-17 Xiaohui Chen , Ramtin Hosseini , Karen Panetta , Jivko Sinapov