Point defect effects on tensile strength of α−zirconium studied by molecular dynamics simulations

Vacancy, interstitial, and Frenkel pair effects on the tensile strength of α−Zr are studied by molecular dynamics simulations. The uni-axial tensile load is along [0001] direction of the α−Zr samples. The yield stresses and the corresponding yield strains decrease with the increase of the defect con...

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Bibliographic Details
Main Authors: Yingying Li, Hong Chen, Yuting Chen, Yuhua Wang, Liang Shao, Wei Xiao
Format: Article
Language:English
Published: Elsevier 2019-08-01
Series:Nuclear Materials and Energy
Online Access:http://www.sciencedirect.com/science/article/pii/S2352179119300158
Description
Summary:Vacancy, interstitial, and Frenkel pair effects on the tensile strength of α−Zr are studied by molecular dynamics simulations. The uni-axial tensile load is along [0001] direction of the α−Zr samples. The yield stresses and the corresponding yield strains decrease with the increase of the defect concentration for the three types of point defects studied. With the same defect concentration, interstitials decrease the tensile strength the most seriously compared with the vacancies and Frenkel pairs. Interstitial clusters form dislocation loops which decrease the uni-axial tensile strength. Keywords: Point defects, Tensile strength, α-Zr, Dislocation, Molecular dynamics simulations
ISSN:2352-1791