Projects
1. Determine the interaction
energy for physisorption by calculating the energy of
CO at low coverage in the lying-down position.
2. Determine the binding energy
and frequency of CO on Pt(111), W(111), Pd(111), Ag(111) or Cu(111)
3. Determine the binding energy
and surface structure of a thiol or amine adsorbate on Au(111) or Ag(111)