Mixed-mode growth of a multicomponent precipitate in the quasi-steady state regime

Tohid Naseri, Daniel Larouche, Rémi Martinez, Francis Breton
{"title":"Mixed-mode growth of a multicomponent precipitate in the quasi-steady state regime","authors":"Tohid Naseri,&nbsp;Daniel Larouche,&nbsp;Rémi Martinez,&nbsp;Francis Breton","doi":"10.1186/s41313-018-0011-y","DOIUrl":null,"url":null,"abstract":"<p>An exact analytical solution of the Fick’s second law was developed and applied to the mixed-mode growth of a multicomponent ellipsoidal precipitate growing with constant eccentricities in the quasi-stationary regime. The solution is exact if the nominal composition, equilibrium concentrations and material properties are assumed constant, and can be applied to compounds having no limitations in the number of components. The solution was compared to the solution calculated by a diffusion-controlled application software and it was found that the solute concentrations at the interface can be determined knowing only the nominal composition, the full equilibrium concentrations and the coefficients of diffusion. The thermodynamic calculations owing to find alternative tie-lines are proven to be useless in the mixed-mode model. From this, it appears that the search of alternative tie-lines is computationally counterproductive, even when the interface has a very high mobility. A more efficient computational scheme is possible by considering that a moving interface is not at equilibrium.</p>","PeriodicalId":693,"journal":{"name":"Materials Theory","volume":"2 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2018-05-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1186/s41313-018-0011-y","citationCount":"5","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Materials Theory","FirstCategoryId":"1","ListUrlMain":"https://link.springer.com/article/10.1186/s41313-018-0011-y","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 5

Abstract

An exact analytical solution of the Fick’s second law was developed and applied to the mixed-mode growth of a multicomponent ellipsoidal precipitate growing with constant eccentricities in the quasi-stationary regime. The solution is exact if the nominal composition, equilibrium concentrations and material properties are assumed constant, and can be applied to compounds having no limitations in the number of components. The solution was compared to the solution calculated by a diffusion-controlled application software and it was found that the solute concentrations at the interface can be determined knowing only the nominal composition, the full equilibrium concentrations and the coefficients of diffusion. The thermodynamic calculations owing to find alternative tie-lines are proven to be useless in the mixed-mode model. From this, it appears that the search of alternative tie-lines is computationally counterproductive, even when the interface has a very high mobility. A more efficient computational scheme is possible by considering that a moving interface is not at equilibrium.

Abstract Image

查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
准稳态下多组分析出物的混合模式生长
建立了菲克第二定律的精确解析解,并将其应用于准平稳状态下以恒定偏心率生长的多组分椭球相的混合模式生长。如果假设标称组成、平衡浓度和材料性质恒定,则该溶液是精确的,并且可以应用于没有组分数量限制的化合物。将该溶液与扩散控制应用软件计算的溶液进行了比较,发现只需知道标称组成、完全平衡浓度和扩散系数就可以确定界面处的溶质浓度。在混合模式模型中,由于寻找替代联络线而进行的热力学计算被证明是无用的。由此看来,即使界面具有非常高的迁移率,寻找替代连接线在计算上也是适得其反的。考虑运动界面不处于平衡状态,可以得到一种更有效的计算方案。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
求助全文
约1分钟内获得全文 去求助
来源期刊
自引率
0.00%
发文量
0
期刊介绍: Journal of Materials Science: Materials Theory publishes all areas of theoretical materials science and related computational methods. The scope covers mechanical, physical and chemical problems in metals and alloys, ceramics, polymers, functional and biological materials at all scales and addresses the structure, synthesis and properties of materials. Proposing novel theoretical concepts, models, and/or mathematical and computational formalisms to advance state-of-the-art technology is critical for submission to the Journal of Materials Science: Materials Theory. The journal highly encourages contributions focusing on data-driven research, materials informatics, and the integration of theory and data analysis as new ways to predict, design, and conceptualize materials behavior.
期刊最新文献
An informatics method for inferring the hardening exponent of plasticity in polycrystalline metals from surface strain measurements Multiscale modelling of precipitation hardening: a review Junction formation rates, residence times, and the rate of plastic flow in FCC metals A model for physical dislocation transmission through grain boundaries and its implementation in a discrete dislocation dynamics tool Dislocation-precipitate interactions in crystals: from the BKS model to collective dislocation dynamics
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1