Atomic Simulations for Packing Changes of Nano-Sized Cu Clusters Embedded in the Fe<sub>bulk</sub> on Heating

Understanding of the defect evolution mechanism under irradiation is very important for the research of pressure vessel steel embrittlement. In this paper, the embedded atom method (EAM) based canonical ensemble molecular dynamics (MD) method was used to study the evolution of the stacking structure...

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Bibliographic Details
Main Authors: Peng Yu, Lin Zhang, Linxiu Du
Format: Article
Language:English
Published: MDPI AG 2021-06-01
Series:Metals
Subjects:
Online Access:https://www.mdpi.com/2075-4701/11/6/934