Bimetallic sites for catalysis: from binuclear metal sites to bimetallic nanoclusters and nanoparticles

L Liu, A Corma - Chemical Reviews, 2023 - ACS Publications
Heterogeneous bimetallic catalysts have broad applications in industrial processes, but
achieving a fundamental understanding on the nature of the active sites in bimetallic …

High-entropy energy materials: challenges and new opportunities

Y Ma, Y Ma, Q Wang, S Schweidler, M Botros… - Energy & …, 2021 - pubs.rsc.org
The essential demand for functional materials enabling the realization of new energy
technologies has triggered tremendous efforts in scientific and industrial research in recent …

Multifunctional high-entropy materials

L Han, S Zhu, Z Rao, C Scheu, D Ponge… - Nature Reviews …, 2024 - nature.com
Entropy-related phase stabilization can allow compositionally complex solid solutions of
multiple principal elements. The massive mixing approach was originally introduced for …

Accelerated and conventional development of magnetic high entropy alloys

V Chaudhary, R Chaudhary, R Banerjee… - Materials Today, 2021 - Elsevier
High-entropy alloys (HEA) are of high current interest due to their unique and attractive
combination of structural, physical, chemical or magnetic properties. HEA comprise multiple …

Machine-learning and high-throughput studies for high-entropy materials

EW Huang, WJ Lee, SS Singh, P Kumar, CY Lee… - Materials Science and …, 2022 - Elsevier
The combination of multiple-principal element materials, known as high-entropy materials
(HEMs), expands the multi-dimensional compositional space to gigantic stoichiometry. It is …

Machine learning assisted design of FeCoNiCrMn high-entropy alloys with ultra-low hydrogen diffusion coefficients

XY Zhou, JH Zhu, Y Wu, XS Yang, T Lookman, HH Wu - Acta Materialia, 2022 - Elsevier
The broad compositional space of high entropy alloys (HEA) is conducive to the design of
HEAs with targeted performance. Herein, a data-driven and machine learning (ML) assisted …

Efficient machine-learning model for fast assessment of elastic properties of high-entropy alloys

G Vazquez, P Singh, D Sauceda, R Couperthwaite… - Acta Materialia, 2022 - Elsevier
We combined descriptor-based analytical models for stiffness-matrix and elastic-moduli with
mean-field methods to accelerate assessment of technologically useful properties of high …

[HTML][HTML] Machine learning prediction of the mechanical properties of γ-TiAl alloys produced using random forest regression model

S Kwak, J Kim, H Ding, X Xu, R Chen, J Guo… - Journal of Materials …, 2022 - Elsevier
The mechanical properties of a directionally solidified (DS) TiAl alloy were predicted through
a random forest regression (RFR) machine learning algorithm. The prediction results were …

Machine learning assisted prediction of the Young's modulus of compositionally complex alloys

H Khakurel, MFN Taufique, A Roy… - Scientific reports, 2021 - nature.com
We identify compositionally complex alloys (CCAs) that offer exceptional mechanical
properties for elevated temperature applications by employing machine learning (ML) in …

Supervised machine learning-based multi-class phase prediction in high-entropy alloys using robust databases

A Oñate, JP Sanhueza, D Zegpi, V Tuninetti… - Journal of Alloys and …, 2023 - Elsevier
This work evaluated the phase prediction capability of high entropy alloys using four
supervised machine learning models K-Nearest Neighbors (KNN), Multinomial Regression …