Full text loading...
Absolute formation energy [Eq. (1)] of (dash-dotted), the main complexes (solid) and the complex (dashed) vs the Fermi level. The slopes of the different portions of the curves equal the charge state of the system, and the crossing points are the thermal charging levels.
Energy path for the kick-out of by self-interstitials.
Ga-vacancy interaction energy for the pair ring mechanism vs the NEB hypercoordinate. The dots indicate the vacancy being first, second, third neighbor of Ga.
Activation energy for the main diffusion mechanism assisted by interstitials and vacancies (see legends).
Article metrics loading...