Structural Stability, Thermodynamic and Elastic Properties of Cubic Zr<sub>0.5</sub>Nb<sub>0.5</sub> Alloy under High Pressure and High Temperature

Structural Stability, Thermodynamic and Elastic Properties of Cubic Zr<sub>0.5</sub>Nb<sub>0.5</sub> Alloy under High Pressure and High Temperature

Structural stability, sound velocities, elasticity, and thermodynamic properties of cubic Zr<sub>0.5</sub>Nb<sub>0.5</sub> alloy have been investigated at high pressure and high temperature by first-principles density functional calculations combined with the quasi-harmonic D...

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Bibliographic Details
Main Authors: Xiuxiu Yang, Shihao Zhang, Hang Zhu, Peidong Tao, Lili Huang, Mu Li, Wei Zhang, Ying Li, Cangtao Zhou, Yongtao Zou
Format: Article
Language:English
Published: MDPI AG 2022-04-01
Series:Crystals
Subjects:
structural stability
elastic properties
thermodynamic properties
high pressure
high temperature
Zr-Nb alloys
Online Access:https://www.mdpi.com/2073-4352/12/5/631

Internet

https://www.mdpi.com/2073-4352/12/5/631

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