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Accelerating the design of materials with targeted properties is one of the key materials informatics tasks. The most common approach takes a data-driven motivation, where the underlying knowledge is incorporated in the form of…

Materials Science · Physics 2022-09-28 Shunshun Liu , Kyungtae Lee , Prasanna V. Balachandran

Refractory high-entropy alloys can function at temperatures exceeding those of nickel-based superalloys. Aluminum, as an alloying element, contributes multiple advantageous characteristics to various high-temperature alloys. The Aluminum…

Materials Science · Physics 2025-03-28 M. Sreenidhi Iyengar , M. K Anirudh , P. H. Anantha Desik , M. P. Phaniraj

Machine learning (ML) is shown to predict new alloys and their performances in a high dimensional, multiple-target-property design space that considers chemistry, multi-step processing routes, and characterization methodology variations. A…

Materials Science · Physics 2020-10-12 Sen Liu , Branden B. Kappes , Behnam Amin-ahmadi , Othmane Benafan , Xiaoli Zhang , Aaron P. Stebner

New discoveries in chemistry and materials science, with increasingly expanding volume of requisite knowledge and experimental workload, provide unique opportunities for machine learning (ML) to take critical roles in accelerating research…

Machine learning (ML) can facilitate efficient thermoelectric (TE) material discovery essential to address the environmental crisis. However, ML models often suffer from poor experimental generalizability despite high metrics. This study…

Materials Science · Physics 2026-02-03 Shoeb Athar , Adrien Mecibah , Philippe Jund

Soil compaction is critical in construction engineering to ensure the stability of structures like road embankments and earth dams. Traditional methods for determining optimum moisture content (OMC) and maximum dry density (MDD) involve…

Artificial Intelligence · Computer Science 2025-12-10 Caner Erden , Alparslan Serhat Demir , Abdullah Hulusi Kokcam , Talas Fikret Kurnaz , Ugur Dagdeviren

Machine learning (ML) offers a promising solution to pathloss prediction. However, its effectiveness can be degraded by the limited availability of data. To alleviate these challenges, this paper introduces a novel simulation-enhanced data…

This paper illustrates an application of machine learning (ML) within a complex system that performs grade estimation. In surface mining, assay measurements taken from production drilling often provide useful information that allows…

Geophysics · Physics 2021-09-15 Raymond Leung , Mehala Balamurali , Alexander Lowe

The discovery of extremal structures in mathematics requires navigating vast and nonconvex landscapes where analytical methods offer little guidance and brute-force search becomes intractable. We introduce FlowBoost, a closed-loop…

Combinatorics · Mathematics 2026-01-27 Gergely Bérczi , Baran Hashemi , Jonas Klüver

Subsurface lithological heterogeneity presents challenges for traditional geophysical methods, particularly in resolving nonlinear electrical resistivity and induced polarization (IP) relationships. This study introduces a data-driven…

We explore the application of computer vision and machine learning (ML) techniques to predict material properties (e.g. compressive strength) based on SEM images. We show that it's possible to train ML models to predict materials…

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…

Machine Learning · Computer Science 2023-07-06 Sina Tayebati , Kyu Taek Cho

In this study, we present a machine learning (ML) framework to predict the axial load-bearing capacity, (kN), of cold-formed steel structural members. The methodology emphasizes robust model selection and interpretability, addressing the…

Process optimization in chemical engineering may be hindered by the limited availability of reliable thermodynamic data for fluid mixtures. Remarkable progress is being made in predicting thermodynamic mixture properties by machine learning…

Computational Engineering, Finance, and Science · Computer Science 2025-10-14 Martin Bubel , Tobias Seidel , Michael Bortz

In recent years, significant advancements have been made in computational methods for analyzing masonry structures. Within the Finite Element Method, two primary approaches have gained traction: Micro and Macro Scale modeling, and their…

Computational Engineering, Finance, and Science · Computer Science 2024-09-02 Alejandro Cornejo , Philip Kalkbrenner , Riccardo Rossi , Luca Pelà

Microstructural heterogeneity affects the macro-scale behavior of materials. Conversely, load distribution at the macro-scale changes the microstructural response. These up-scaling and down-scaling relations are often modeled using…

Materials Science · Physics 2023-06-13 Ashwini Gupta , Anindya Bhaduri , Lori Graham-Brady

In the pursuit of developing high-temperature alloys with improved properties for meeting the performance requirements of next-generation energy and aerospace demands, integrated computational materials engineering (ICME) has played a…

Applied Physics · Physics 2022-12-01 Baldur Steingrimsson , Xuesong Fan , Benjamin Adam , Peter K. Liaw

Surface modification results in substantial improvement in pool boiling heat transfer. Thin film-coated and porous-coated substrates, through different materials and techniques, significantly boost heat transfer through increased nucleation…

Applied Physics · Physics 2025-06-24 Vijay Kuberan , Sateesh Gedupudi

High-temperature alloy design requires a concurrent consideration of multiple mechanisms at different length scales. We propose a workflow that couples highly relevant physics into machine learning (ML) to predict properties of complex…

Materials Science · Physics 2020-09-04 Jian Peng , Yukinori Yamamoto , Jeffrey A. Hawk , Edgar Lara-Curzio , Dongwon Shin

In the analysis of composite materials with heterogeneous microstructures, full resolution of the heterogeneities using classical numerical approaches can be computationally prohibitive. This paper presents a micromechanics-enhanced finite…

Materials Science · Physics 2011-11-08 J. Novák , Ł. Kaczmarczyk , P. Grassl , J. Zeman , C. J. Pearce
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