posted on 2025-05-09, 05:40authored byM. W. Radny, G. A. Shah, S. R. Schofield, P. V. Smith, N. J. Curson
We have carried out extensive calculations of the Ge(001)c4 X 2 clean surface using a slab containing 8, 10, and 12 Ge layers, respectively. These calculations have again been performed using the VASP code. The change in the electronic structure with increasing
number of layers also affects the relationship between the back bond and dangling bond surface states.