Hydrogen Transportation Behaviour of V–Ni Solid Solution: A First-Principles Investigation

Hydrogen Transportation Behaviour of V–Ni Solid Solution: A First-Principles Investigation

Hydrogen embrittlement causes deterioration of materials used in metal–hydrogen systems. Alloying is a good option for overcoming this issue. In the present work, first-principles calculations were performed to systematically study the effects of adding Ni on the stability, dissolution, trapping, an...

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Bibliographic Details
Main Authors: Jiayao Qin, Zhigao Liu, Wei Zhao, Dianhui Wang, Yanli Zhang, Yan Zhong, Xiaohui Zhang, Zhongmin Wang, Chaohao Hu, Jiangwen Liu
Format: Article
Language:English
Published: MDPI AG 2021-05-01
Series:Materials
Subjects:
V–Ni solid solution
hydrogen trapping
H-diffusion properties
tetrahedral interstitial site
first-principles calculations
Online Access:https://www.mdpi.com/1996-1944/14/10/2603

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https://www.mdpi.com/1996-1944/14/10/2603

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