The Effect of Alloying Elements on the Structural Stability, Mechanical Properties, and Debye Temperature of Al3Li: A First-Principles Study

The Effect of Alloying Elements on the Structural Stability, Mechanical Properties, and Debye Temperature of Al3Li: A First-Principles Study

The structural stability, mechanical properties, and Debye temperature of alloying elements X (X = Sc, Ti, Co, Cu, Zn, Zr, Nb, and Mo) doped Al3Li were systematically investigated by first-principles methods. A negative enthalpy of formation ΔHf is predicted for all Al3Li doped species whi...

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Bibliographic Details
Main Authors:	Jinzhong Tian, Yuhong Zhao, Hua Hou, Bing Wang
Format:	Article
Language:	English
Published:	MDPI AG 2018-08-01
Series:	Materials
Subjects:	first-principles doping concentration alloying elements mechanical properties Debye temperature lightweight structural materials Al3Li
Online Access:	http://www.mdpi.com/1996-1944/11/8/1471

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