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Machine learning models have been progressively used for predicting materials properties. These models can be built using pre-existing data and are useful for rapidly screening the physicochemical space of a material, which is…

软凝聚态物质 · 物理学 2024-09-17 Israrul H. Hashmi , Himanshu , Rahul Karmakar , Tarak K Patra

Most of the existing object detection methods generate poor glass detection results, due to the fact that the transparent glass shares the same appearance with arbitrary objects behind it in an image. Different from traditional deep…

计算机视觉与模式识别 · 计算机科学 2022-01-11 C. Zheng , D. Shi , X. Yan , D. Liang , M. wei , X. Yang , Y. Guo , H. Xie

Visually identifying materials is crucial for many tasks, yet material perception remains poorly understood. Distinguishing mirror from glass is particularly challenging as both materials derive their appearance from their surroundings, yet…

计算机视觉与模式识别 · 计算机科学 2022-03-14 Hideki Tamura , Konrad E. Prokott , Roland W. Fleming

Advancements in neural machinery have led to a wide range of algorithmic solutions for molecular property prediction. Two classes of models in particular have yielded promising results: neural networks applied to computed molecular…

Unraveling the structural factors influencing the dynamics of amorphous solids is crucial. While deep learning aids in navigating these complexities, transparency issues persist. Inspired by the successful application of prototype neural…

软凝聚态物质 · 物理学 2024-03-19 Xiao Jiang , Zean Tian , Kenli Li , Wangyu Hu

Predicting the glass-forming ability (GFA) of chemical compositions remains a fundamental challenge in materials science, especially for oxide glasses with broad compositional diversity. Traditional empirical and thermodynamic approaches…

材料科学 · 物理学 2025-12-10 Fatemeh Mahmoudi

Large language models (LLMs) have demonstrated rapid progress across a wide array of domains. Owing to the very large number of parameters and training data in LLMs, these models inherently encompass an expansive and comprehensive materials…

材料科学 · 物理学 2024-11-20 Siyu Liu , Tongqi Wen , A. S. L. Subrahmanyam Pattamatta , David J. Srolovitz

Predicting the dissolution rates of silicate glasses in aqueous conditions is a complex task as the underlying mechanism(s) remain poorly understood and the dissolution kinetics can depend on a large number of intrinsic and extrinsic…

无序系统与神经网络 · 物理学 2018-03-14 N. M. Anoop Krishnan , Sujith Mangalathu , Morten M. Smedskjaer , Adama Tandia , Henry Burton , Mathieu Bauchy

This study proposes an Artificial Intelligence (AI) driven methodology for predicting a combination of brazed ceramic-metal composite materials. Multiple machine learning (ML) algorithms are compared with the deep learning (DL) model. The…

应用物理 · 物理学 2025-10-14 Sunita Khod , Vinay Kamma , Ravi Kumar Verma , Mayank Goswami

We describe the development of artificial neural networks (ANN) for the prediction of the properties of ceramic materials. The ceramics studied here include polycrystalline, inorganic, non-metallic materials and are investigated on the…

材料科学 · 物理学 2007-05-23 D. J. Scott , P. V. Coveney , J. A. Kilner , J. C. H. Rossiny , N. Mc N. Alford

We apply an artificial neural network to model and verify material properties. The neural network algorithm has a unique capability to handle incomplete data sets in both training and predicting, so it can regard properties as inputs…

计算物理 · 物理学 2018-03-02 P. C. Verpoort , P. MacDonald , G. J. Conduit

Polymer informatics tools have been recently gaining ground to efficiently and effectively develop, design, and discover new polymers that meet specific application needs. So far, however, these data-driven efforts have largely focused on…

材料科学 · 物理学 2021-07-05 Christopher Künneth , William Schertzer , Rampi Ramprasad

Machine learning methods have shown promise in predicting molecular properties, and given sufficient training data machine learning approaches can enable rapid high-throughput virtual screening of large libraries of compounds. Graph-based…

The difficult problem of relating the static structure of glassy liquids and their dynamics is a good target for Machine Learning, an approach which excels at finding complex patterns hidden in data. Indeed, this approach is currently a hot…

软凝聚态物质 · 物理学 2024-05-29 Francesco Saverio Pezzicoli , Guillaume Charpiat , François P. Landes

Optical properties in solids, such as refractive index and absorption, hold vast applications ranging from solar panels to sensors, photodetectors, and transparent displays. However, first-principles computation of optical properties from…

材料科学 · 物理学 2024-06-25 Nguyen Tuan Hung , Ryotaro Okabe , Abhijatmedhi Chotrattanapituk , Mingda Li

A wide range of applications require learning image generation models whose latent space effectively captures the high-level factors of variation present in the data distribution. The extent to which a model represents such variations…

计算机视觉与模式识别 · 计算机科学 2021-11-09 Avinandan Bose , Aniket Das , Yatin Dandi , Piyush Rai

Interatomic potentials are essential for driving molecular dynamics (MD) simulations, directly impacting the reliability of predictions regarding the physical and chemical properties of materials. In recent years, machine-learned potentials…

材料科学 · 物理学 2025-03-20 Penghua Ying , Cheng Qian , Rui Zhao , Yanzhou Wang , Feng Ding , Shunda Chen , Zheyong Fan

Endowing robots with human-like physical reasoning abilities remains challenging. We argue that existing methods often disregard spatio-temporal relations and by using Graph Neural Networks (GNNs) that incorporate a relational inductive…

机器学习 · 计算机科学 2019-10-24 Fabio Ferreira , Lin Shao , Tamim Asfour , Jeannette Bohg

Glass surfaces of transparent objects and mirrors are not able to be uniquely and explicitly characterized by their visual appearances because they contain the visual appearance of other reflected or transmitted surfaces as well. Detecting…

计算机视觉与模式识别 · 计算机科学 2024-03-05 Dongshen Han , Seungkyu Lee , Chaoning Zhang , Heechan Yoon , Hyukmin Kwon , Hyun-Cheol Kim , Hyon-Gon Choo

Accurate estimation of production times is critical for effective manufacturing scheduling, yet traditional methods relying on expert analysis or historical data often fall short in dynamic or customized production environments. This paper…

机器学习 · 计算机科学 2025-09-05 Grzegorz Miebs , Rafał A. Bachorz