The electronic properties of Al deposited on GaN(110) surface with dif
ferent adsorption geometries have been studied by using the surface li
near muffin tin orbital approach. The layer projected density of state
s for Al-covered GaN(110) surface is calculated and compared with that
of the clean surface. The charge distribution before and after the ad
sorption of Al are investigated. It is found that the deposited Al ato
ms prefer to bond with the surface N atoms with some charge transferre
d from Al to the GaN substrate. Finally, the Al-Ga exchange mechanism
is also studied and it is found that the adsorbed Al may replace the s
econd layer Ga atom to form a more stable configuration.