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Creeping Motion of Self Interstitial Atom Clusters in Tungsten

The formation and motion features of self interstitial atom (SIA) clusters in tungsten are studied by molecular dynamics (MD) simulations. The static calculations show that the SIA clusters are stable with binding energy over 2 eV. The SIA clusters exhibit a fast one dimensional (1D) motion along 〈1...

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Autores principales: Zhou, Wang Huai, Zhang, Chuan Guo, Li, Yong Gang, Zeng, Zhi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4035581/
https://www.ncbi.nlm.nih.gov/pubmed/24865470
http://dx.doi.org/10.1038/srep05096
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author Zhou, Wang Huai
Zhang, Chuan Guo
Li, Yong Gang
Zeng, Zhi
author_facet Zhou, Wang Huai
Zhang, Chuan Guo
Li, Yong Gang
Zeng, Zhi
author_sort Zhou, Wang Huai
collection PubMed
description The formation and motion features of self interstitial atom (SIA) clusters in tungsten are studied by molecular dynamics (MD) simulations. The static calculations show that the SIA clusters are stable with binding energy over 2 eV. The SIA clusters exhibit a fast one dimensional (1D) motion along 〈111〉. Through analysis of the change of relative distance between SIAs, we find that SIAs jump in small displacements we call creeping motion, which is a new collective diffusion process different from that of iron. The potential energy surface of SIAs implicates that the creeping motion is due to the strong interaction between SIAs. These imply that several diffusion mechanism for SIA clusters can operate in BCC metals and could help us explore deep insight into the performance of materials under irradiation.
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spelling pubmed-40355812014-05-28 Creeping Motion of Self Interstitial Atom Clusters in Tungsten Zhou, Wang Huai Zhang, Chuan Guo Li, Yong Gang Zeng, Zhi Sci Rep Article The formation and motion features of self interstitial atom (SIA) clusters in tungsten are studied by molecular dynamics (MD) simulations. The static calculations show that the SIA clusters are stable with binding energy over 2 eV. The SIA clusters exhibit a fast one dimensional (1D) motion along 〈111〉. Through analysis of the change of relative distance between SIAs, we find that SIAs jump in small displacements we call creeping motion, which is a new collective diffusion process different from that of iron. The potential energy surface of SIAs implicates that the creeping motion is due to the strong interaction between SIAs. These imply that several diffusion mechanism for SIA clusters can operate in BCC metals and could help us explore deep insight into the performance of materials under irradiation. Nature Publishing Group 2014-05-28 /pmc/articles/PMC4035581/ /pubmed/24865470 http://dx.doi.org/10.1038/srep05096 Text en Copyright © 2014, Macmillan Publishers Limited. All rights reserved http://creativecommons.org/licenses/by-nc-sa/3.0/ This work is licensed under a Creative Commons Attribution-NonCommercial-ShareAlike 3.0 Unported License. The images in this article are included in the article's Creative Commons license, unless indicated otherwise in the image credit; if the image is not included under the Creative Commons license, users will need to obtain permission from the license holder in order to reproduce the image. To view a copy of this license, visit http://creativecommons.org/licenses/by-nc-sa/3.0/
spellingShingle Article
Zhou, Wang Huai
Zhang, Chuan Guo
Li, Yong Gang
Zeng, Zhi
Creeping Motion of Self Interstitial Atom Clusters in Tungsten
title Creeping Motion of Self Interstitial Atom Clusters in Tungsten
title_full Creeping Motion of Self Interstitial Atom Clusters in Tungsten
title_fullStr Creeping Motion of Self Interstitial Atom Clusters in Tungsten
title_full_unstemmed Creeping Motion of Self Interstitial Atom Clusters in Tungsten
title_short Creeping Motion of Self Interstitial Atom Clusters in Tungsten
title_sort creeping motion of self interstitial atom clusters in tungsten
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4035581/
https://www.ncbi.nlm.nih.gov/pubmed/24865470
http://dx.doi.org/10.1038/srep05096
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