Éditeur(s) : HAL CCSD Elsevier
Résumé : International audience
In this paper, we determine dislocation core structures and Peierls stresses of wadsleyite, a high-pressure mineral present in the Earth mantle. We use a Peierls-Nabarro model combined with a finite-element method in which we introduce two-dimensional generalized stacking fault energies. Several potential slip planes of wadsleyite are considered. The results show that dislocations in this mineral can exhibit complex dislocation cores with linear or non-collinear dissociation and even three-dimensional dislocation cores. The calculation of the Peierls stresses gives information on the potential activity of slip systems governing the plasticity of wadsleyite. Our study confirms experimental observations that 1/2 < 1 1 1 >{1 0 1} is the easiest slip system in this structure at high-pressure and that [1 0 0](0 1 0) is the second easiest. Both these easily slip systems have dislocations that dissociate into collinear partial dislocations. In contrast [0 1 0] dislocations with very large Burgers vector (11.2 angstrom) are stabilized by complex dissociations involving four partial dislocations.
ISSN: 1359-6454

hal-00475548
https://hal.archives-ouvertes.fr/hal-00475548
DOI : 10.1016/j.actamat.2009.10.047

Éditeur(s) : HAL CCSD Springer Verlag
Résumé : The core structures of dislocations in diopside have been calculated within the Peierls model, which assumes a planar core. 1/2 < 110 > dislocations can dissociate into two collinear partial dislocations. We show that [001] glide is very difficult in (010) and that a non-collinear dissociation of [001](100) (modelled within a Peierls-Nabarro-Galerkin approach) makes glide equally easy in (100) and {110}. A widely spread core structure corresponding to a low lattice friction has been found for [100](010) and [010](100) dislocations which is not supported by mechanical data and, together with TEM observations, suggests that another, probably non-planar core structure is possible for these dislocations.
ISSN: 0342-1791

hal-00558238
https://hal.archives-ouvertes.fr/hal-00558238
DOI : 10.1007/s00269-010-0370-7