A quantitative atomic-scale model for the kinetics of intermixing in GaAs-AlGaAs quantum-confined heterostructures is presented. The model takes into account the statistical nature of the defect diffusion through heterostructures and calculates its effect on the Ga-Al interdiffusion across the associated interfaces. The model has been validated by successfully predicting the observed amounts of bandgap shift induced by the process of hydrogen plasma induced defect layer intermixing, as well as for the process of impurity-free vacancy disordering using SiO2 caps. Good agreement between calculated and measured bandgap shifts has been observed. Values of the group-III vacancy diffusion coefficient, where the agreement took place, are between 2 and 3 2 exp[02:72=kBT ] cm 2 1s 01 .
Index Terms-Diffusion processes, quantum heterostructures, quantum-well interdiffusion, quantum wells.