Recent applications of machine learning in alloy design: A review

M Hu, Q Tan, R Knibbe, M Xu, B Jiang, S Wang… - Materials Science and …, 2023 - Elsevier
The history of machine learning (ML) can be traced back to the 1950 s, and its application in
alloy design has recently begun to flourish and expand rapidly. The driving force behind this …

Imperfections are not 0 K: free energy of point defects in crystals

I Mosquera-Lois, SR Kavanagh, J Klarbring… - Chemical Society …, 2023 - pubs.rsc.org
Defects determine many important properties and applications of materials, ranging from
doping in semiconductors, to conductivity in mixed ionic–electronic conductors used in …

Interpretable hardness prediction of high-entropy alloys through ensemble learning

YF Zhang, W Ren, WL Wang, N Li, YX Zhang… - Journal of Alloys and …, 2023 - Elsevier
With the development of artificial intelligence, machine learning has a wide range of
applications in the field of materials. The sparsity of data on the mechanical properties of …

Machine Learning Paves the Way for High Entropy Compounds Exploration: Challenges, Progress, and Outlook

X Wan, Z Li, W Yu, A Wang, X Ke, H Guo… - Advanced …, 2023 - Wiley Online Library
Abstract Machine learning (ML) has emerged as a powerful tool in the research field of high
entropy compounds (HECs), which have gained worldwide attention due to their vast …

Distilling physical origins of hardness in multi-principal element alloys directly from ensemble neural network models

D Beniwal, P Singh, S Gupta, MJ Kramer… - npj Computational …, 2022 - nature.com
Despite a plethora of data being generated on the mechanical behavior of multi-principal
element alloys, a systematic assessment remains inaccessible via Edisonian approaches …

Extracting structural motifs from pair distribution function data of nanostructures using explainable machine learning

AS Anker, ETS Kjær, M Juelsholt… - npj Computational …, 2022 - nature.com
Abstract Characterization of material structure with X-ray or neutron scattering using eg Pair
Distribution Function (PDF) analysis most often rely on refining a structure model against an …

[HTML][HTML] Prediction and design of high hardness high entropy alloy through machine learning

W Ren, YF Zhang, WL Wang, SJ Ding, N Li - Materials & Design, 2023 - Elsevier
Two data-driven machine learning (ML) models were proposed for the hardness prediction
of high-entropy alloys (HEA) and the composition optimization of high hardness HEAs …

[HTML][HTML] A machine learning approach for accelerated design of magnesium alloys. Part A: Alloy data and property space

M Ghorbani, M Boley, PNH Nakashima… - Journal of Magnesium and …, 2023 - Elsevier
Typically, magnesium alloys have been designed using a so-called hill-climbing approach,
with rather incremental advances over the past century. Iterative and incremental alloy …

Exploring the relationship between lattice distortion and phase stability in a multi-principal element alloy system based on machine learning method

J Huang, W Fang, C Xue, T Peng, H Yu, J Li… - Computational Materials …, 2023 - Elsevier
Lattice distortion is a basic characteristic of multi-principal element alloys (MPEAs), or high
entropy alloys (HEAs). The severe lattice distortion strategy is an effective way to improve …

Overview: recent studies of machine learning in phase prediction of high entropy alloys

YG Yan, D Lu, K Wang - Tungsten, 2023 - Springer
High entropy alloys (HEAs), especially refractory HEAs, have become a subject of interest in
the past years due to their exceptional properties in terms of high-temperature strength …