Synergistic experimental and theoretical studies of low coverage adsorption geometries of rare earth adatoms on Si(0 0 1) were performed. Density functional calculations showed charge transfer from adatoms to Si(0 0 1) and explained observed bias dependence in scanning tunneling microscopy images. Comparison of STM simulations with empty states STM data revealed a direct correlation between coverage and surface reconstructions; the ( 4 x 8) reconstruction is a low coverage precursor to ( 2 x 4) reconstruction. Charge transfer from adatom to substrate was also confirmed by Kelvin probe force microscopy; contact potential difference measurements of Dy/Si(0 0 1) reveal a 0.28 eV higher surface potential than that of ( 2 x 1) reconstructed Si. (C) 2008 Elsevier B. V. All rights reserved.