P. Sandl et E. Bertel, SURFACE-STATES, LOCAL BONDING, AND SURFACE RECONSTRUCTION - NA ON CU(110), Surface science, 302(3), 1994, pp. 120000325-120000330
Occupied and unoccupied surface states on Na/Cu(110) have been investi
gated by photoemission and inverse photoemission. By measuring surface
state positions at the same adsorbate coverage on the reconstructed a
nd the unreconstructed surface it is demonstrated that the surface sta
tes contribute to the total energy balance of the Na induced missing r
ow reconstruction. During the onset of the reconstruction an up-shift
of the surface states depopulates an initially occupied Cu-Cu bonding
surface state and consequently destabilizes the topmost Cu atoms. The
surface state wavefunctions are qualitatively analyzed in a thight-bin
ding LCAO picture.