A combined He - atom scattering and theoretical study of the low energy vibrations of physisorbed monolayers of Xe on Cu ( 111 ) and Cu ( 001 )

نویسندگان

  • A. Šiber
  • B. Gumhalter
  • J. Braun
  • A. P. Graham
  • M. F. Bertino
  • D. Fuhrmann
چکیده

A combined He-atom scattering and theoretical study of the low energy vibrations of physisorbed monolayers of Xe on Cu(111) and Cu(001) Abstract The surface phonon dispersion curves of commensurate Xe monolayers on Cu(111) and incommensurate Xe monolayers on Cu(001) surfaces have been measured using He atom scattering (HAS) time of flight (TOF) spectroscopy. The TOF spectra are interpreted by combining quantum scattering calculations with the dynamical matrix description of the surface vibrations. Both a vertically polarized Einstein-like mode and another, acoustic-like mode of dominantly longitudinal character, are identified. The latter mode is characterized by the presence and absence of the zone center frequency gap in the commensurate and incommensurate adlayers, respectively. The microscopic description of the TOF spectral intensities is based on the extensive theoretical studies of the interplay of the phonon dynamics, projectile-surface potentials , multi-quantum interference and projectile recoil, and their effect on the HAS spectra. Both single and multi-quantum spectral features observed over a wide range of He atom incident energies and substrate temperatures are successfully explained by the theory.

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

Collisional line shapes for low frequency vibrations of adsorbates on a metal surface.

The dynamics of atoms or molecules adsorbed on a metal surface, and excited by collisions with an atomic beam, are treated within a theory that includes energy dissipation into lattice vibrations by means of a frequency and temperature dependent friction function. The theory provides dynamic structure factors for energy transfer derived from collisional time correlation functions. It describes ...

متن کامل

Theoretical Study of OH Adsorption on ‎PdxCu3-x (x = 0-3) Nano Clusters‎

   Adsorption of OH on the PdxCu3-x(x=0-3) small clusters is investigated by density functional theory calculations. It is found that OH adsorbs in three possible modes including on top, bridge and hollow sites while the structures where OH bridges between two atoms are the most stable structures. The Pd-Pd, Pd-Cu and Cu-Cu equilibrium distances for most of the systems...

متن کامل

The Effect of Cu Impurity on the CO-dissociation Mechanism on the Fe (100) Surface: A Full Potential DFT Study

In this study, the theoretical calculations of CO dissociation were carried out on Cu-Fe alloy surface by a full-potential method, which made more accurate results especially on the prediction of adsorption energies. This process may be governed by either a direct route or a H-assisted via HCO and COH intermediates pathways. In comparison to the pure surface Fe (100), the presence of Cu atom en...

متن کامل

Extended Lattice Gas Interactions of Cu on Cu(111) and Cu(001): Ab-Initio Evaluation and Implications

We present ab-initio calculations of a variety of different lattice-gas interaction energies between Cu adatoms on Cu(001) and Cu(111). We find the next-nearest-neighbor (NNN) interactions to be negligible on Cu(111), explaining the success of the nearest-neighbor (NN) Ising model when describing the Cu(111) step stiffness. On Cu(001), however, we find that NNN interactions are roughly (1/7) th...

متن کامل

Debye-Waller factor in He→Cu(001) collisions revisited: the role of the interaction potentials

Following the recently accumulated information on the vibrational properties of the Cu(001) surface acquired through singleand multiphonon He atom scattering experiments and the concomitant theoretical investigations, we have reexamined the properties of the Debye-Waller factor (DWF) characteristic of the He→Cu(001) collisions using the recently developed fully quantal and three-dimensional mod...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

عنوان ژورنال:

دوره   شماره 

صفحات  -

تاریخ انتشار 2008