Non-random walk diffusion enhances the sink strength of semicoherent interfaces

Clean, safe and economical nuclear energy requires new materials capable of withstanding severe radiation damage. One strategy of imparting radiation resistance to solids is to incorporate into them a high density of solid-phase interfaces capable of absorbing and annihilating radiation-induced defe...

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Main Authors: Jourdan, T., Marinica, M.-C., Vattre, A., Ding, Hepeng, Demkowicz, Michael J.
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering
Format: Article
Language:en_US
Published: Nature Publishing Group 2016
Online Access:http://hdl.handle.net/1721.1/101868
https://orcid.org/0000-0002-6832-1068
https://orcid.org/0000-0003-3949-0441
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author Jourdan, T.
Marinica, M.-C.
Vattre, A.
Ding, Hepeng
Demkowicz, Michael J.
author2 Massachusetts Institute of Technology. Department of Materials Science and Engineering
author_facet Massachusetts Institute of Technology. Department of Materials Science and Engineering
Jourdan, T.
Marinica, M.-C.
Vattre, A.
Ding, Hepeng
Demkowicz, Michael J.
author_sort Jourdan, T.
collection MIT
description Clean, safe and economical nuclear energy requires new materials capable of withstanding severe radiation damage. One strategy of imparting radiation resistance to solids is to incorporate into them a high density of solid-phase interfaces capable of absorbing and annihilating radiation-induced defects. Here we show that elastic interactions between point defects and semicoherent interfaces lead to a marked enhancement in interface sink strength. Our conclusions stem from simulations that integrate first principles, object kinetic Monte Carlo and anisotropic elasticity calculations. Surprisingly, the enhancement in sink strength is not due primarily to increased thermodynamic driving forces, but rather to reduced defect migration barriers, which induce a preferential drift of defects towards interfaces. The sink strength enhancement is highly sensitive to the detailed character of interfacial stresses, suggesting that ‘super-sink’ interfaces may be designed by optimizing interface stress fields. Such interfaces may be used to create materials with unprecedented resistance to radiation-induced damage.
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spelling mit-1721.1/1018682022-09-23T12:33:45Z Non-random walk diffusion enhances the sink strength of semicoherent interfaces Jourdan, T. Marinica, M.-C. Vattre, A. Ding, Hepeng Demkowicz, Michael J. Massachusetts Institute of Technology. Department of Materials Science and Engineering Ding, Hepeng Demkowicz, Michael J. Clean, safe and economical nuclear energy requires new materials capable of withstanding severe radiation damage. One strategy of imparting radiation resistance to solids is to incorporate into them a high density of solid-phase interfaces capable of absorbing and annihilating radiation-induced defects. Here we show that elastic interactions between point defects and semicoherent interfaces lead to a marked enhancement in interface sink strength. Our conclusions stem from simulations that integrate first principles, object kinetic Monte Carlo and anisotropic elasticity calculations. Surprisingly, the enhancement in sink strength is not due primarily to increased thermodynamic driving forces, but rather to reduced defect migration barriers, which induce a preferential drift of defects towards interfaces. The sink strength enhancement is highly sensitive to the detailed character of interfacial stresses, suggesting that ‘super-sink’ interfaces may be designed by optimizing interface stress fields. Such interfaces may be used to create materials with unprecedented resistance to radiation-induced damage. United States. Dept. of Energy. Office of Nuclear Energy (Contract DE-NE0000533) United States. Dept. of Energy (National Energy Research Scientific Computing Center (U.S.)) National Science Foundation (U.S.) (Grant 1150862) 2016-03-25T14:06:51Z 2016-03-25T14:06:51Z 2016-01 2015-06 Article http://purl.org/eprint/type/JournalArticle 2041-1723 http://hdl.handle.net/1721.1/101868 Vattré, A., T. Jourdan, H. Ding, M.-C. Marinica, and M. J. Demkowicz. “Non-Random Walk Diffusion Enhances the Sink Strength of Semicoherent Interfaces.” Nat Comms 7 (January 29, 2016): 10424. https://orcid.org/0000-0002-6832-1068 https://orcid.org/0000-0003-3949-0441 en_US http://dx.doi.org/10.1038/ncomms10424 Nature Communications Creative Commons Attribution http://creativecommons.org/licenses/by/4.0/ application/pdf Nature Publishing Group Nature Publishing Group
spellingShingle Jourdan, T.
Marinica, M.-C.
Vattre, A.
Ding, Hepeng
Demkowicz, Michael J.
Non-random walk diffusion enhances the sink strength of semicoherent interfaces
title Non-random walk diffusion enhances the sink strength of semicoherent interfaces
title_full Non-random walk diffusion enhances the sink strength of semicoherent interfaces
title_fullStr Non-random walk diffusion enhances the sink strength of semicoherent interfaces
title_full_unstemmed Non-random walk diffusion enhances the sink strength of semicoherent interfaces
title_short Non-random walk diffusion enhances the sink strength of semicoherent interfaces
title_sort non random walk diffusion enhances the sink strength of semicoherent interfaces
url http://hdl.handle.net/1721.1/101868
https://orcid.org/0000-0002-6832-1068
https://orcid.org/0000-0003-3949-0441
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