Automated Development of an Accurate Diffusion Database in Fcc AlCoCrFeNi High-Entropy Alloys from a Big Dataset of Composition Profiles

• Published in: Materials Vol. 15; no. 9; p. 3240
• Main Authors: Zhong, Jing, Li, Qin, Deng, Chunming, Zhang, Lijun
• Format: Journal Article
• Language: English
• Published: Switzerland MDPI AG 30.04.2022; MDPI
• Subjects: AlCoCrFeNi; Alloys; Automation; Composition; Conventions; Couples; Creep (materials); Datasets; diffusion; Diffusion effects; Genetic algorithms; Heat resistance; High entropy alloys; high-entropy alloy; HitDIC; Interdiffusion; Investigations; Optimization; Subsystems; Tracer diffusion; HitDIC; diffusion; AlCoCrFeNi; automation; high-entropy alloy
• ISSN: 1996-1944; 1996-1944
• DOI: 10.3390/ma15093240

This study aims to incorporate a big dataset of composition profiles of fcc AlCoCrFeNi alloys, in addition to those of the related subsystem, to develop a self-consistent kinetic description for quinary high-entropy alloys. The latest feature of the HitDIC ( gh- hroughput etermination of nterdiffusion oefficients) code was adopted in a high-throughput and automatic manner for accommodating a dataset of composition profiles with up to 87 diffusion couples. A good convergence for the optimization process was achieved, while satisfactory results regarding the composition profiles and previously evaluated diffusion properties were obtained. Here, we present an investigation into the elemental effect of Al towards interdiffusion and tracer diffusion, and their potential effect on creep and precipitation processes.