An experimental investigation of the elastic scattering of He and H2 from Ag(111)

Experimental diffraction probabilities for 63 meV He and 66 meV H₂ scattering from Ag(111) along the 〈112̄〉 direction are reported. Debye-Waller experiments for the He/Ag(111) system yield a mean well depth of 9.3 meV and an effective surface Debye temperature of 253 K.     

Survival of He+ ions during grazing scattering from a Ag(111) surface

He+ ions as well as neutral He atoms with keV energies are scattered under a grazing angle of incidence from a clean and atomically flat Ag(111) surface. From a comparison of ion fractions observed after scattering of He+ ions and He atoms we find for energies below some keV small but defined fractions of ions that have survived the complete scattering event with the surface. This feature allows us to clear up the microscopic interaction scenario for Auger neutralization of He+ ions at a Ag(111) surface. The Auger neutralization rates are 2 to 3 orders of magnitude smaller than conventional rates derived from experiments for He+-metal systems and agree with recent calculations.     

Atom-surface interaction in inelastic scattering: He/Ag(111)

The amplitude of inelastic He scattering from Rayleigh waves on a Ag(111) surface is calculated in the framework of the distorted wave Born approximation (DWBA) for a two-body exponential potential. Using the potential parameters recently obtained by Bortolani et al. from a quantum mechanical calculation, agreement is obtained with the experimental data. Simple explicit formulas are presented both in the DWBA and in the eikonal approximation. The essential factor in both cases describes an approximate exponential decay of the intensity for increasing parallel momentum transfer.     

High-resolution photoemission from Ag(100), Ag(110), and Ag(111)

Energy distribution curves of photoelectrons emitted normal to (100), (110), and (111) faces of silver have been obtained at photon energies of 21.22, 16.85, and 11.83 eV. The results are compared with Christensen's relativistic band structure calculation of bulk silver yielding a close correspondence between experiment and theory. A surface state in the L gap immediately below the Fermi level is identified.     

Theory of one-phonon scattering of atoms from metal surfaces: Application to He/Ag(111)

We present explicit expressions for one-phonon scattering of atoms from metal surfaces, within the distorted wave Born approximation by including Van der Waals forces. A comparison is made with the recent high-resolution time of flight spectra for He/Ag(1 1 1). We explain in quantitative terms the position and the intensity of the peaks due to scattering from the Rayleigh wave of silver. Also the bulk phonons contribute to the spectra, but the calculated intensities underestimate the data.     

On the diffraction of He by a Ni(110) surface

The diffraction of low-energy He atoms by a Ni(110) surface is studied using hard and soft wall models for the elastic scattering. The effects of thermal vibrations and inelastic processes on the He intensities are estimated. It is shown that the experimental spectra imply a corrugation height along the [001] direction that is maximally 0.12 au. A value of 0.30 au, calculated recently within a scheme that assumes the repulsive interaction to be proportional to the electron density of unperturbed Ni(110), leads to “double rainbow” diffraction patterns qualitatively different from those observed.     

Dislocations on Ag(111)

Various dislocations on Ag(111) were imaged with a scanning tunneling microscope, e.g. screw dislocations, Lomer-Cottrell locks and stacking fault tetrahedron. The distortion field near a screw dislocation was measured.     

In-plane and out-of-plane diffraction of H(2) from metal surfaces

We have measured in-plane and out-of-plane diffraction of H2 and D2 molecular beams scattered by reactive Pd(111) and nonreactive NiAl(110) surfaces at 140-150 meV. A comparison with six-dimensional quantum dynamics and classical trajectory calculations shows for the first time that accurate diffraction patterns can be obtained from state-of-the-art potential energy surfaces based on density functional theory. Our measurements show that, at general incidence conditions, out-of-plane diffraction is much more important than was assumed in previous experiments.     

Symmetry changes in He scattering from a Si(111) surface exposed to H atoms

Changes which occur on, and just below, the surface of a Si(111)-(7×7) crystal when it is dosed with H atoms are complex and still not well described. Measurements of He atom diffraction (HAS) from this surface in the [ 2 ] or [ 11] directions give scans which are asymmetric about the specular angle. The scans become symmetric when the surface is exposed to doses of H atoms sufficient to give coverages of 0.1 to 14 ML, if the atoms all stick. This means that the 3-fold rotational symmetry of the clean surface becomes 6-fold after the addition of the H atoms and shows that the faulted and unfaulted regions of the DAS model become equivalent as they are averaged by the He beam, although the large 49-atom unit cell remains. Thus this surface is not Si(111)-H(1×1), the equilibrated product of H-atom addition which is about 0.3 eV lower in energy, but a metastable intermediate state(s).

Comparison of results from HAS with those from other techniques, such as scanning tunneling microscopy, help to characterize this surface.     

Spin-resolved photoemission from Ag(111): Theory and experiment

Using circularly polarized synchrotron radiation between 14 and 24 eV, spin-resolved normal photoemission spectra have been measured from an unreconstructed Ag(111) surface. Corresponding spectra were calculated by means of a fully relativistic one-step theory of photoemission together with the bulk band structures for real and complex potentials, using two different local approximations for the exchange-correlation potential. Experiment and theory employing anX potential agree well with regard to existence and positions of peaks. Relative peak heights match except for an observed enhancement at photon energies, at which two or more direct interband transitions may resonate.     

The Tamm surface state on Cu(111) and Ag(111)

It is shown, that the well-known d-electron Tamm surface-state emission observed in photoelectron spectra from Cu(111) at the M̄ point in the surface Brillouin zone, is indeed due to such a surface state and not a bulk band transition as recently suggested L. Wallden, Solid State Commun. 59, 205 (1986). A similar surface state on Ag(111) is reported.     

Large-space cluster model calculations for the 3He(3He,2p)4He and 3H(3H,2n)4He reactions

The ³He(³He,2p)⁴He and ³H(³H,2n)su4He reactions are studied in a microscopic cluster model. We search for resonances in the ³He+³He and ⁴He + p + p channels using methods that treat the two- and three-body resonance asymptotics correctly. Our results show that the existence of a low-energy resonance or virtual state, which could influence the ⁷Be and ⁸B solar neutrino fluxes, is rather unlikely. Our calculated ³He(³He,2p)⁴He and ³H(³H,2n)⁴He cross sections are in a good general agreement with the experimental data.     

Microscopic study of the low-energy3He(3He, 2p)4He and3H(3H, 2n)4He fusion cross sections

We have calculated the³He(³He, 2p)⁴He and³H(³H, 2n)⁴He reaction cross sections at low energies within the microscopic multichannel resonating group method. For both reactions, we find good agreement with experiment. For the³H(³H, 2n)⁴He reaction, our calculated energy dependence reproduces that of each individual low-energy experimental data set, except for a normalization constant. Using this fact, we derive at a low-energy³H(³H, 2n)⁴He rate by taking the averaged mean of these fits.This work has been supported in part by the National Science Foundation, Grants PHY86-04197 and PHY88-17296.     

Ag(111)和Au(111)上铋的初始生长行为

半金属铋(Bi)的表面合金具有的Rashba效应,和其具体结构性质有重要关联.本文结合扫描隧道显微镜(STM)和密度泛函理论(DFT),系统地研究了Bi原子在Ag(111)和Au(111)上的不同初始生长行为.在室温Ag(111)上,连续的Ag2Bi合金薄膜会优先在Ag台阶边缘形成;在570 K Ag(111)上,随着...