Göbel, C.; Petzke, K.; Schrepel, C.; Scherz, U. - In: The European Physical Journal B - Condensed Matter and … 11 (1999) 4, pp. 559-564
We present an ab initio technique for the calculation of vibrational modes at deep defects in semiconductors outside and inside the host-phonon bands. The dynamical matrix is calculated using density-functional theory in the local density approximation. In the results presented here all...