We present detailed results of ab initio pseudopotential calculations
for equilibrium atomic geometry and chemical bonding on the arsenic-te
rminated GaAs(001)-beta 2(2 x 4) surface. We find that this surface is
characterized by the presence of two distinct Ga-As bond lengths betw
een the first and second surface layers. This feature is due to the pr
esence of both threefold-and fourfold-coordinated Ga atoms in the seco
nd layer.