First-principles study on the thermodynamic, electronic and mechanical properties of Mg–Al–Si ternary compounds

First-principles study on the thermodynamic, electronic and mechanical properties of Mg–Al–Si ternary compounds

The alloys used in lightweight equipment such as magnesium (Mg) alloys are not only required the considerable strength but also the good stiffness, i.e., the Young’s modulus (E) is relatively high. Herein, the first-principle density functional theory is adopted to efficiently and economically explo...

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Bibliographic Details
Main Authors: Hailian Wang, Yunxuan Zhou, Quan Dong, Xianhua Chen, Jun Tan
Format: Article
Language:English
Published: Elsevier 2022-07-01
Series:Journal of Materials Research and Technology
Subjects:
Magnesium alloys
Mechanical properties
Thermodynamic properties
Electronic structure
First-principles calculations
Online Access:http://www.sciencedirect.com/science/article/pii/S2238785422009103

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