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Traditional design cycles for new materials and assemblies have two fundamental drawbacks. The underlying physical relationships are often too complex to be precisely calculated and described. Aside from that, many unknown uncertainties,…

Machine learning has been increasingly applied in climate modeling on system emulation acceleration, data-driven parameter inference, forecasting, and knowledge discovery, addressing challenges such as physical consistency, multi-scale…

Accurate and computationally-viable representations of clouds and turbulence are a long-standing challenge for climate model development. Traditional parameterizations that crudely but efficiently approximate these processes are a leading…

大气与海洋物理 · 物理学 2024-01-05 Jerry Lin , Mohamed Aziz Bhouri , Tom Beucler , Sungduk Yu , Michael Pritchard

Traditionally, yield strength prediction relies on detailed and resource-intensive microstructural characterization combined with empirical equations. However, quantifying microstructural feature length scales for novel processes like…

材料科学 · 物理学 2024-12-12 Abhinav Chandraker , Sampad Barik , Nichenametla Jai Sai , Ankur Chauhan

This short paper presents the potential of using machine learning to predict materials behaviour in the context of hydrogen interaction with steel. Effort has been made to understand the quality, and amount of data needed to get improved…

材料科学 · 物理学 2021-10-22 M. Amir Siddiq

Material scientists are increasingly adopting the use of machine learning (ML) for making potentially important decisions, such as, discovery, development, optimization, synthesis and characterization of materials. However, despite ML's…

计算物理 · 物理学 2019-03-12 Bhavya Kailkhura , Brian Gallagher , Sookyung Kim , Anna Hiszpanski , T. Yong-Jin Han

Machine Learning (ML) techniques are revolutionizing the way to perform efficient materials modeling. Nevertheless, not all the ML approaches allow for the understanding of microscopic mechanisms at play in different phenomena. To address…

Machine Learning (ML) algorithms are vital for supporting clinical decision-making in biomedical informatics. However, their predictive performance can vary across demographic groups, often due to the underrepresentation of historically…

机器学习 · 计算机科学 2025-03-04 Ioannis Bilionis , Ricardo C. Berrios , Luis Fernandez-Luque , Carlos Castillo

During the past decade, metal additive manufacturing (MAM) has experienced significant developments and gained much attention due to its ability to fabricate complex parts, manufacture products with functionally graded materials, minimize…

机器学习 · 计算机科学 2023-07-06 Sina Tayebati , Kyu Taek Cho

Machine Learning (ML) is an expressive framework for turning data into computer programs. Across many problem domains -- both in industry and policy settings -- the types of computer programs needed for accurate prediction or optimal…

机器学习 · 计算机科学 2023-12-21 Elliot Creager

Experimentally [1-38] and computationally [39-50] validated machine learning (ML) articles are sorted based on the size of the training data: 1-100, 101-10000, and 10000+ in a comprehensive set summarizing legacy and recent advances in the…

材料科学 · 物理学 2023-03-20 Sterling G. Baird , Marianne Liu , Hasan M. Sayeed , Taylor D. Sparks

While machine learning has emerged in recent years as a useful tool for rapid prediction of materials properties, generating sufficient data to reliably train models without overfitting is still impractical for many applications. Towards…

材料科学 · 物理学 2022-07-29 Rees Chang , Yu-Xiong Wang , Elif Ertekin

In this paper, five different approaches for reduced-order modeling of brittle fracture in geomaterials, specifically concrete, are presented and compared. Four of the five methods rely on machine learning (ML) algorithms to approximate…

计算工程、金融与科学 · 计算机科学 2018-06-07 A. Hunter , B. A. Moore , M. K. Mudunuru , V. T. Chau , R. L. Miller , R. B. Tchoua , C. Nyshadham , S. Karra , D. O. Malley , E. Rougier , H. S. Viswanathan , G. Srinivasan

Although the tailored metal active sites and porous architectures of MOFs hold great promise for engineering challenges ranging from gas separations to catalysis, a lack of understanding of how to improve their stability limits their use in…

材料科学 · 物理学 2021-06-28 Aditya Nandy , Chenru Duan , Heather J. Kulik

This paper targets the question of predicting machine learning classification model performance, when taking into account the number of training examples per class and not just the overall number of training examples. This leads to the a…

机器学习 · 计算机科学 2024-03-12 Thomas Mühlenstädt , Jelena Frtunikj

The rise of Big Data has led to new demands for Machine Learning (ML) systems to learn complex models with millions to billions of parameters, that promise adequate capacity to digest massive datasets and offer powerful predictive analytics…

机器学习 · 统计学 2016-01-01 Eric P. Xing , Qirong Ho , Pengtao Xie , Wei Dai

In this work, we perform a comprehensive study of the machine learning (ML) methods for the purpose of characterising the quantum set of correlations. As our main focus is on assessing the usefulness and effectiveness of the ML approach, we…

量子物理 · 物理学 2024-07-22 Gabriel Pereira Alves , Nicolas Gigena , Jędrzej Kaniewski

Machine Learning (ML) has the potential to accelerate discovery of new materials and shed light on useful properties of existing materials. A key difficulty when applying ML in Materials Science is that experimental datasets of material…

We consider the problem of retraining machine learning (ML) models when new batches of data become available. Existing approaches greedily optimize for predictive power independently at each batch, without considering the stability of the…

机器学习 · 计算机科学 2025-02-05 Dimitris Bertsimas , Vassilis Digalakis , Yu Ma , Phevos Paschalidis

Predicting properties from coordinate-category data -- sets of vectors paired with categorical information -- is fundamental to computational science. In materials science, this challenge manifests as predicting properties like formation…

材料科学 · 物理学 2025-07-10 Nawaf Alampara , Santiago Miret , Kevin Maik Jablonka