Title :

Solute - 〈111〉 interstitial loop interaction in α-Fe: A DFT study

Author(s) :

Domain, Christophe [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]
Becquart, Charlotte [Auteur]
Unité Matériaux et Transformations - UMR 8207 [UMET]

Journal title :

Journal of Nuclear Materials

Volume number :

499

Pages :

582-594

Publication date :

2018-02

HAL domain(s) :

Chimie/Matériaux
Physique [physics]/Matière Condensée [cond-mat]/Science des matériaux [cond-mat.mtrl-sci]

English abstract : [en]

Density functional theory calculations of the interaction of solute atoms with 〈111〉 SIA loops in Fe have been performed in large supercells. Using the data obtained, it is shown that for the pressure vessel steel solute ...
Show more >Density functional theory calculations of the interaction of solute atoms with 〈111〉 SIA loops in Fe have been performed in large supercells. Using the data obtained, it is shown that for the pressure vessel steel solute concentration, and under equilibriShow less >

Language :

Anglais

Audience :

Internationale

Popular science :

Non

Administrative institution(s) :

Université de Lille
ENSCL
CNRS
INRA

Collections :

• Unité Matériaux et Transformations (UMET) - UMR 8207

Research team(s) :

Métallurgie Physique et Génie des Matériaux

Submission date :

2019-05-16T17:22:00Z
2021-05-14T13:28:25Z