139 citations · 235 across the 3 of their papers we have counts for
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Atomic-scale modeling of twinning disconnections in zirconium
Olivier Mackain, Maeva Cottura, David Rodney +1
Twin growth in hexagonal close-packed zirconium is investigated at the atomic scale by modeling the various disconnections that can exist on twin boundaries. Thanks to a coupling w…
Hydrogen and vacancy clustering in zirconium
Céline Varvenne, Olivier Mackain, Laurent Proville +1
The effect of solute hydrogen on the stability of vacancy clusters in hexagonal closed packed zirconium is investigated with an ab initio approach, including contributions of H vib…
Vacancy clustering in zirconium: an atomic scale study
Céline Varvenne, Olivier Mackain, Emmanuel Clouet
The stability properties of vacancy clusters in hexagonal close-packed Zr, cavities and dislocation loops, are investigated at the atomic scale, with a modeling approach based on d…