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dc.contributor.authorKvashin, Nikolai
dc.contributor.authorGarcía-Müller, Pablo Luis
dc.contributor.authorAnento Moreno, Napoleón
dc.contributor.authorSerra Tort, Ana María
dc.contributor.otherUniversitat Politècnica de Catalunya. Doctorat en Física Computacional i Aplicada
dc.contributor.otherUniversitat Politècnica de Catalunya. Departament d'Enginyeria Civil i Ambiental
dc.date.accessioned2020-07-22T11:51:37Z
dc.date.available2020-07-22T11:51:37Z
dc.date.issued2020-07
dc.identifier.citationKvashin, N. [et al.]. Atomic processes of shear-coupled migration in {112} twins and vicinal grain boundaries in bcc-Fe. "Physical review materials", Juliol 2020, vol. 4, núm. 7, p. 073604:1-073604:8.
dc.identifier.issn2475-9953
dc.identifier.urihttp://hdl.handle.net/2117/327359
dc.description© 2020 American Physical Society
dc.description.abstractTilt {112} grain boundaries (GBs) in bcc metals perform shear-coupled grain-boundary migration by the creation and glide of disconnections. Disconnection dipoles may be created at the pristine GB at high stresses or may be generated at the core of a GB dislocation that acts as a source of disconnections. We characterize this source in terms of its Burgers vector, denoted →b1/−1, and describe the mechanism that allows the source to move conservatively with the GB. The →b1/−1 grain-boundary dislocation is created, for instance, during the absorption of a crystal dislocation by the {112} grain boundary. In addition, →b1/−1 accommodates {112} vicinal grain boundaries that are formed by segments of {112} planes separated by →b1/−1 grain-boundary dislocations. The presence of these →b1/−1 dislocations facilitates the conservative displacement of both the pristine and the vicinal GBs. We show that the creation of disconnections is the key for the absorption of edge and screw dislocations by the GB and the drag of mixed dislocations by the GB during its migration. These conservative processes are efficient ways to accommodate plastic deformation by the growth and shrink of {112} twins, and shear-coupled motion of the {112} GB and its vicinal GBs.
dc.description.sponsorshipThis work was supported by the Euratom research and training programme 2014–2018 under Grant Agreement No. 755039 (Project M4F), by the Spanish MINECO: Grants No. FIS2015-69017-P and No. RTI2018-096006-B-I00, the latter with ERDF funds. This work also contributes to the Joint Program on Nuclear Materials (JPNM) of the European Energy Research Alliance (EERA). Simulations partially carried out in the computing facilities provided by the CYTED Network RICAP (517RT0529).
dc.language.isoeng
dc.publisherAmerican Physical Society (APS)
dc.subjectÀrees temàtiques de la UPC::Enginyeria dels materials::Metal·lúrgia
dc.subjectÀrees temàtiques de la UPC::Enginyeria dels materials::Materials compostos
dc.subject.lcshMetals--Plastic properties--Mathematical models
dc.subject.lcshPolycrystals--Plastic properties
dc.subject.otherDislocacions
dc.subject.otherFronteres de gra
dc.subject.otherDisconexions
dc.subject.otherDislocacions de frontera
dc.subject.otherDeformació plàstica
dc.subject.otherDinàmica molecular
dc.titleAtomic processes of shear-coupled migration in {112} twins and vicinal grain boundaries in bcc-Fe
dc.typeArticle
dc.subject.lemacPolicristal·lins
dc.subject.lemacMetalls -- Propietats plàstiques
dc.identifier.doi10.1103/PhysRevMaterials.4.073604
dc.description.peerreviewedPeer Reviewed
dc.relation.publisherversionhttps://journals.aps.org/prmaterials/abstract/10.1103/PhysRevMaterials.4.073604
dc.rights.accessOpen Access
local.identifier.drac28913452
dc.description.versionPostprint (author's final draft)
dc.relation.projectidinfo:eu-repo/grantAgreement/MINECO//FIS2015-69017-P/ES/PROCESOS NANO-ESTRUCTURALES EN METALES Y ALEACIONES ASOCIADOS A LA DEFORMACION PLASTICA Y%2FO IRRADIACION/
dc.relation.projectidinfo:eu-repo/grantAgreement/EC/H2020/755039/EU/MULTISCALE MODELLING FOR FUSION AND FISSION MATERIALS/M4F
local.citation.authorKvashin, N.; García-Müller, P.L.; Anento, N.; Serra, A.
local.citation.publicationNamePhysical review materials
local.citation.volume4
local.citation.number7
local.citation.startingPage073604:1
local.citation.endingPage073604:8
local.personalitzacitaciotrue


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