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Fast, vacancy-free climb of prismatic dislocation loops in bcc metals
Vacancy-mediated climb models cannot account for the fast, direct coalescence of dislocation loops seen experimentally. An alternative mechanism, self climb, allows prismatic dislocation loops to move away from their glide surface via pipe diffusion around the loop perimeter, independent of any vaca...
Autores principales: | , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4993995/ https://www.ncbi.nlm.nih.gov/pubmed/27549928 http://dx.doi.org/10.1038/srep30596 |
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author | Swinburne, Thomas D. Arakawa, Kazuto Mori, Hirotaro Yasuda, Hidehiro Isshiki, Minoru Mimura, Kouji Uchikoshi, Masahito Dudarev, Sergei L. |
author_facet | Swinburne, Thomas D. Arakawa, Kazuto Mori, Hirotaro Yasuda, Hidehiro Isshiki, Minoru Mimura, Kouji Uchikoshi, Masahito Dudarev, Sergei L. |
author_sort | Swinburne, Thomas D. |
collection | PubMed |
description | Vacancy-mediated climb models cannot account for the fast, direct coalescence of dislocation loops seen experimentally. An alternative mechanism, self climb, allows prismatic dislocation loops to move away from their glide surface via pipe diffusion around the loop perimeter, independent of any vacancy atmosphere. Despite the known importance of self climb, theoretical models require a typically unknown activation energy, hindering implementation in materials modeling. Here, extensive molecular statics calculations of pipe diffusion processes around irregular prismatic loops are used to map the energy landscape for self climb in iron and tungsten, finding a simple, material independent energy model after normalizing by the vacancy migration barrier. Kinetic Monte Carlo simulations yield a self climb activation energy of 2 (2.5) times the vacancy migration barrier for 1/2〈111〉 (〈100〉) dislocation loops. Dislocation dynamics simulations allowing self climb and glide show quantitative agreement with transmission electron microscopy observations of climbing prismatic loops in iron and tungsten, confirming that this novel form of vacancy-free climb is many orders of magnitude faster than what is predicted by traditional climb models. Self climb significantly influences the coarsening rate of defect networks, with important implications for post-irradiation annealing. |
format | Online Article Text |
id | pubmed-4993995 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | Nature Publishing Group |
record_format | MEDLINE/PubMed |
spelling | pubmed-49939952016-08-30 Fast, vacancy-free climb of prismatic dislocation loops in bcc metals Swinburne, Thomas D. Arakawa, Kazuto Mori, Hirotaro Yasuda, Hidehiro Isshiki, Minoru Mimura, Kouji Uchikoshi, Masahito Dudarev, Sergei L. Sci Rep Article Vacancy-mediated climb models cannot account for the fast, direct coalescence of dislocation loops seen experimentally. An alternative mechanism, self climb, allows prismatic dislocation loops to move away from their glide surface via pipe diffusion around the loop perimeter, independent of any vacancy atmosphere. Despite the known importance of self climb, theoretical models require a typically unknown activation energy, hindering implementation in materials modeling. Here, extensive molecular statics calculations of pipe diffusion processes around irregular prismatic loops are used to map the energy landscape for self climb in iron and tungsten, finding a simple, material independent energy model after normalizing by the vacancy migration barrier. Kinetic Monte Carlo simulations yield a self climb activation energy of 2 (2.5) times the vacancy migration barrier for 1/2〈111〉 (〈100〉) dislocation loops. Dislocation dynamics simulations allowing self climb and glide show quantitative agreement with transmission electron microscopy observations of climbing prismatic loops in iron and tungsten, confirming that this novel form of vacancy-free climb is many orders of magnitude faster than what is predicted by traditional climb models. Self climb significantly influences the coarsening rate of defect networks, with important implications for post-irradiation annealing. Nature Publishing Group 2016-08-23 /pmc/articles/PMC4993995/ /pubmed/27549928 http://dx.doi.org/10.1038/srep30596 Text en Copyright © 2016, The Author(s) http://creativecommons.org/licenses/by/4.0/ This work is licensed under a Creative Commons Attribution 4.0 International License. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in the credit line; if the material is not included under the Creative Commons license, users will need to obtain permission from the license holder to reproduce the material. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/ |
spellingShingle | Article Swinburne, Thomas D. Arakawa, Kazuto Mori, Hirotaro Yasuda, Hidehiro Isshiki, Minoru Mimura, Kouji Uchikoshi, Masahito Dudarev, Sergei L. Fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
title | Fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
title_full | Fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
title_fullStr | Fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
title_full_unstemmed | Fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
title_short | Fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
title_sort | fast, vacancy-free climb of prismatic dislocation loops in bcc metals |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4993995/ https://www.ncbi.nlm.nih.gov/pubmed/27549928 http://dx.doi.org/10.1038/srep30596 |
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