Ab initio modelling of defect properties with substitutional and interstitials elements in steels and Zr alloys

A. Souidi , C. Becquart , C. Domain (1) , D. Terentyev , L. Malerba , A.F. Calder , D.J. Bacon , R.E. Stoller , Yu. Osetsky , M. Hou

1 EDF R&D MMC - Matériaux et Mécanique des Composants

Domaines: Sciences de l'ingénieur [physics]; Matériaux

A. Souidi, C. Becquart, C. Domain, D. Terentyev, L. Malerba, et al.. Ab initio modelling of defect properties with substitutional and interstitials elements in steels and Zr alloys. Journal of Nuclear Materials, 2006, 351 (1-3), pp.1 - 19. ⟨10.1016/j.jnucmat.2006.02.025⟩. ⟨hal-01828358⟩