Atomic-scale properties of jogs along ...
Document type :
Article dans une revue scientifique: Article original
Permalink :
Title :
Atomic-scale properties of jogs along 1/2〈110〉{1¯10} edge dislocations in MgO
Author(s) :
Zhai, Jian-Hui [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]
Hirel, Pierre [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]
Unité Matériaux et Transformations (UMET) - UMR 8207
Carrez, Philippe [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]
Unité Matériaux et Transformations (UMET) - UMR 8207
Unité Matériaux et Transformations - UMR 8207 [UMET]
Hirel, Pierre [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]
Unité Matériaux et Transformations (UMET) - UMR 8207
Carrez, Philippe [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]
Unité Matériaux et Transformations (UMET) - UMR 8207
Journal title :
Scripta Materialia
Abbreviated title :
Scripta Materialia
Volume number :
181
Pages :
66-69
Publisher :
Elsevier BV
Publication date :
2020-05
ISSN :
1359-6462
HAL domain(s) :
Planète et Univers [physics]/Sciences de la Terre
Physique [physics]/Matière Condensée [cond-mat]/Science des matériaux [cond-mat.mtrl-sci]
Physique [physics]/Matière Condensée [cond-mat]/Science des matériaux [cond-mat.mtrl-sci]
English abstract : [en]
We report atomic-scale simulations of the structure and formation energies of jog pairs on edge dislocations in magnesium oxide (MgO). The atomic configurations of elementary jogs of height and super-jogs of height are ...
Show more >We report atomic-scale simulations of the structure and formation energies of jog pairs on edge dislocations in magnesium oxide (MgO). The atomic configurations of elementary jogs of height and super-jogs of height are fully characterized showing that stable jogs spread in {111}. Besides, our simulations confirm that elementary jogs carry an electric charge ± q/2 where q is the charge of a Mg ion, while super-jogs are charge-neutral. The computation of the formation energy reveals the predominance of charged elementary jogs. This offers new insight into the mechanisms for dislocation climb in MgO.Show less >
Show more >We report atomic-scale simulations of the structure and formation energies of jog pairs on edge dislocations in magnesium oxide (MgO). The atomic configurations of elementary jogs of height and super-jogs of height are fully characterized showing that stable jogs spread in {111}. Besides, our simulations confirm that elementary jogs carry an electric charge ± q/2 where q is the charge of a Mg ion, while super-jogs are charge-neutral. The computation of the formation energy reveals the predominance of charged elementary jogs. This offers new insight into the mechanisms for dislocation climb in MgO.Show less >
Language :
Anglais
Peer reviewed article :
Oui
Audience :
Internationale
Popular science :
Non
Administrative institution(s) :
Université de Lille
CNRS
INRA
ENSCL
CNRS
INRA
ENSCL
Collections :
Research team(s) :
Plasticité
Submission date :
2020-02-19T16:02:57Z
2020-02-26T12:02:53Z
2020-02-26T12:02:53Z