(111) facets as the origin of reconstructed Au(110) surfaces

The Au(110) surface has been investigated by scanning tunneling microscopy. The reconstructed surface consists of long ribbons of narrow (111) facets along the [1$\text{1}$0] direction with maximum three free rows. Two-row facets give rise to the 1 × 2 reconstruction of the missing-row type, while three-row facets account for the 1 × 3 reconstruction. Disorder arises from locally random sequences of the two facets.     

Relaxation and electronic states of Au(100), (110) and (111) surfaces

Using a first-principles method based on density functional theory, we investigate the surface relaxation and electronic states of Au(100), (110) and (111) surfaces. The calculated results show that the relaxations of the (100) and (110) surfaces of the metal are inward relaxations. However, the Au(111) surface shows an ‘anomalous’ outward relaxation, although several previous theoretical studies have predicted inward relaxations that are contrary to the experimental measurements. Electronic densities of states and the respective charge density distribution along the Z-axis of the relaxed surfaces are analyzed, and the origin of inward and outward relaxation is discussed in detail.     

The onset of disorder in Al(110) surfaces below the melting point

Molecular dynamics simulations of the disordering of Al(110) surfaces below the melting point are presented. Effective medium theory has been used to calculate the inter-atomic many-body interactions of the metallic system. The origin of the anisotropy of the disordering with respect to the direction along the surface deduced from LEED experiments is suggested to be mainly a consequence of the g² dependence of the Debye-Waller factor even for non-harmonic interactions. Further evidence is presented showing that the disordering of the first layers coincides with the onset of surface vacancy formation.     

Thin film formation on chemically modified surfaces: Au on Mo(110)

The early stages of the formation of Au films on chemically modified Mo(110) surfaces were studied by Auger electron spectroscopy (AES), low energy electron diffraction (LEED), thermal desorption spectroscopy (TDS) and work function change (Δφ) measurements. The surfaces were modified by saturation with oxygen and CO and by carburization. Carburization did not suppress initial two-dimensional (2D) growth but on the oxygen-saturated surface Au grew from the very beginning in small 3D crystals with oscillatory thickness dependence of the Auger signals. CO showed an intermediate behaviour. It is concluded that the bond strength and the location of the chemical modifier normal to the surface is decisive for the growth mode.     

Comparative study of the electronic structure of the ordered and disordered Cu3Au (100) and Cu3Au (110) surfaces

The influence of structural changes on the electronic structure has been investigated by a comparison of the angle-integrated valence and core level photoelectron spectra of ordered and disordered Cu₃Au(100) and (110) surfaces. The total width of the Au 5d and Cu 3d bands does not change with the ordering state or surface orientation. The spectra for the (100) surface are compared with selfconsistent calculations and good agreement is found, for the ordered state, however with a 0.6 eV correction of the calculated Fermi level position. We observe three Au 5d derived bands at 5.1, 6.0 and 6.9 eV, in contrast to previous experimental findings. Our results indicate the existence of shortrange order above the critical temperature.     

Numerical investigation of the submonolayer growth and relaxation of stepped Ag (110) and Au (110) surfaces

The terrace width distribution (TWD) as well as the adatom and island densities for some stepped fcc?(110) surfaces with parallel and equidistant steps of equal stiffness are studied by means of kinetic Monte Carlo simulations. Reliable energy barriers for surface diffusion are used. They have been calculated by means of many-body potentials derived within the second moment approximation to the tight-binding model. The effects of the temperature, atom deposition flux and surface diffusion on quantities of interest in the early stage of the surface evolution process have been singled out. In most cases, linear, logarithmic and power-law behaviors are recovered for the evolution of the step width and terrace defects. The TWD is well described by the Gaussian distribution (GD) in the domain of temperature investigated but deviates from the Generalized Wigner Distribution (GWD).     

Chemisorption of CO on Cu(100), Ag(110) and Au(110)

The adsorption of CO on Cu, Ag and Au is studied using core and valence photoemission, X-ray absorption and autoionization of core excited states. The purpose is to investigate the nature of the adsorption bond starting out from the well-established chemisorption system CO/Cu(100)-c(2 × 2), and from the results we suggest that CO forms chemisorbed phases also on Ag(110) and Au(110). The photoemission spectra show strong shake-up satellites both for the valence levels and the core levels. The separation to the satellite appearing closest to the main line is observed to follow the position of the substrate d-band relative to the Fermi level. The CO adsorption strength for the noble metals is deduced to decrease in the order Cu-Au-Ag. This is based on the widths of the XA resonances, which are related to the adsorbate-substrate interaction strength of the core excited states, and the relative shake-up intensities, which are expected to increase with a decreasing adsorption strength in the ground state. The same trends regarding the shake-up intensities are observed both for the valence and core levels.     

Streuung spinpolarisierter Elektronen an Au(110)

Using the the spin modulated polarized electron gun based on photoemission from positive affinity GaAs the intensityI(E, , ) and asymmetry (E, , ) are measured in LEED from Au(110). The asymmetry is compared with the polarizationS(E, , ) which N. Müller obtained with a Mott detector after scattering an unpolarized electron beam from the same crystal. There is excellent agreement for the (00) beams, if the scattering plane is a mirror symmetry plane of the crystal (=0°, =90°). From the differences for the (00) and (11) beams at =35° and the (01/2) beam at =90° conditions for possible models for the reconstructed Au(110)–(1×2) surface may be derived.

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Die vorliegende Arbeit ist ein Auszug aus [1]

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Neue Addresse ab 1. Oktober 1980: B. Reihl, IBM Thomas J. Watson Research Center, Yorktown Heights, NY 10598, USA     

Substrate-induced spin-orbit splitting of quantum-well and interface states in Au,Ag, and Cu layers of different thicknesses on W(110) and Mo(110) surfaces

The substrate-induced spin-orbit splitting of interface and quantum-well states formed in Au, Ag, and Cu layers on W(110) and Mo(110) surfaces has been revealed using angle- and spin-resolved photoelectron spectroscopy. It has been shown that the magnitude of the splitting depends noticeably on the atomic number of the substrate material and is markedly larger for layers of these metals on W(110), i.e., on the surface of a metal with a larger atomic number (Z _W = 74), than on the surface of Mo(110), i.e., an element with a smaller atomic number (Z _Mo = 42), while depending only weakly on the atomic number of the adsorbed metal. Measurements of the dispersion of the formed quantum-well states have shown that the substrate-induced spin-orbit splitting increases with increasing parallel component of the photoelectron momentum (which correlates with the Rashba model) for all thicknesses of deposited films (up to 10 ML). The magnitude of induced spin-orbit splitting of the interface states evolving in monolayer Au, Ag, and Cu coatings on W(110) and Mo(110) decreases with increasing parallel component of the excited photoelectron momentum.