Hydrogenic impurity ground state in quantum well: the envelope function revisited

Abstract

We present a new variationnal method for calculating the ground state energy of an electron bound to an impurity located in a quantum well. This method relies on an envelope function which is determined exactly from a formal minimization procedure. The obtained energies are lower by as much as 10% than the ones found by the widely used free electron envelope function. Their large width limits are reached with exponentially small corrections as they should. We also find that, except for narrow wells, the shape of these exact envelope functions strongly depends on the impurity position, being consequently quite different from the usual free electron ones. In order to discuss the improvements brought by our new procedure in the most striking way, we have used a model semiconductor quantum well with infinite barrier height and simplified band structure. Extensions can be made to finite barrier and more realistic band structures, following the same technique.