Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations

Abstract Dislocation loops are ubiquitous in irradiated materials, and dislocation loop bias plays a critical role in void swelling. However, due to complicated interactions between dislocation loops and point defects, it is challenging to evaluate the bias factors of dislocation loops. Here, we det...

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Main Authors: Ziang Yu, Haixuan Xu
Format: Article
Language:English
Published: Nature Portfolio 2023-05-01
Series:Communications Materials
Online Access:https://doi.org/10.1038/s43246-023-00356-5
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author Ziang Yu
Haixuan Xu
author_facet Ziang Yu
Haixuan Xu
author_sort Ziang Yu
collection DOAJ
description Abstract Dislocation loops are ubiquitous in irradiated materials, and dislocation loop bias plays a critical role in void swelling. However, due to complicated interactions between dislocation loops and point defects, it is challenging to evaluate the bias factors of dislocation loops. Here, we determine the bias of sessile < 100 > loops in α-iron using a recently developed atomistic approach based on the lifetime of point defects. We establish a mechanistic understanding of the loop interaction based on the diffusion tendency of point defects near the loop core region. Mobile self-interstitial atoms tend to be absorbed from the edge of the loop, and a trapping region perpendicular to the habit plane of the loop exists. The dislocation loop bias is found to be substantially lower than those of straight dislocations in α-iron and should be included in swelling rate estimates. With the obtained sink strength and bias values, agreement is achieved with experimental results for both absolute values and temperature dependence.
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spelling doaj.art-f25461ef2e984f34a5b1b16a93bb20822023-05-07T11:18:42ZengNature PortfolioCommunications Materials2662-44432023-05-01411910.1038/s43246-023-00356-5Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulationsZiang Yu0Haixuan Xu1Department of Materials Science and Engineering, The University of TennesseeDepartment of Materials Science and Engineering, The University of TennesseeAbstract Dislocation loops are ubiquitous in irradiated materials, and dislocation loop bias plays a critical role in void swelling. However, due to complicated interactions between dislocation loops and point defects, it is challenging to evaluate the bias factors of dislocation loops. Here, we determine the bias of sessile < 100 > loops in α-iron using a recently developed atomistic approach based on the lifetime of point defects. We establish a mechanistic understanding of the loop interaction based on the diffusion tendency of point defects near the loop core region. Mobile self-interstitial atoms tend to be absorbed from the edge of the loop, and a trapping region perpendicular to the habit plane of the loop exists. The dislocation loop bias is found to be substantially lower than those of straight dislocations in α-iron and should be included in swelling rate estimates. With the obtained sink strength and bias values, agreement is achieved with experimental results for both absolute values and temperature dependence.https://doi.org/10.1038/s43246-023-00356-5
spellingShingle Ziang Yu
Haixuan Xu
Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations
Communications Materials
title Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations
title_full Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations
title_fullStr Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations
title_full_unstemmed Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations
title_short Dislocation loop bias and void swelling in irradiated α-iron from mesoscale and atomistic simulations
title_sort dislocation loop bias and void swelling in irradiated α iron from mesoscale and atomistic simulations
url https://doi.org/10.1038/s43246-023-00356-5
work_keys_str_mv AT ziangyu dislocationloopbiasandvoidswellinginirradiatedaironfrommesoscaleandatomisticsimulations
AT haixuanxu dislocationloopbiasandvoidswellinginirradiatedaironfrommesoscaleandatomisticsimulations