Explainable machine learning assisted molecular-level insights for enhanced specific stiffness exploiting the large compositional space of AlCoCrFeNi high entropy …

KK Gupta, S Barman, S Dey… - … Learning: Science and …, 2024 - iopscience.iop.org
Abstract Design of high entropy alloys (HEA) presents a significant challenge due to the
large compositional space and composition-specific variation in their functional behavior …

[HTML][HTML] Rapid Assessment of Stable Crystal Structures in Single-Phase High-Entropy Alloys via Graph Neural Network-Based Surrogate Modelling

N Beaver, A Dive, M Wong, K Shimanuki, A Patil… - Crystals, 2024 - mdpi.com
To develop a rapid, reliable, and cost-effective method for predicting the structure of single-
phase high-entropy alloys, a Graph Neural Network (ALIGNN-FF)-based approach was …

Mathematical Modeling for High Entropy Materials

B Sokouti - High Entropy Materials - taylorfrancis.com
As a result of simulations of high entropy alloys, we have understood their lattice structure,
defect structure, and deformation mechanism to understand their remarkable mechanical …