Search results for "Surfaces"

Searching for hexagonal analogues of the half-metallic half-Heusler XYZ compounds

2008

The XYZ half-Heusler crystal structure can conveniently be described as a tetrahedral zinc blende YZ structure which is stuffed by a slightly ionic X species. This description is well suited to understand the electronic structure of semiconducting 8-electron compounds such as LiAlSi (formulated Li$^+$[AlSi]$^-$) or semiconducting 18-electron compounds such as TiCoSb (formulated Ti$^{4+}$[CoSb]$^{4-}$). The basis for this is that [AlSi]$^-$ (with the same electron count as Si$_2$) and [CoSb]$^{4-}$ (the same electron count as GaSb), are both structurally and electronically, zinc-blende semiconductors. The electronic structure of half-metallic ferromagnets in this structure type can then be d…

Enhanced Reflectivity Change and Phase Shift of Polarized Light: Double Parameter Multilayer Sensor

2022

Herein, the concept of point of darkness based on polarized light phase difference and absorption of light is demonstrated by simulations using low refractive index and extinction coefficient semiconductor and dielectric, and high refractive index nonoxidizing metal multilayer thin film structures. Several multilayer sensor configurations show great sensitivity to thickness and refractive index variation of the detectable material by measuring the reflectivity ratio {\Psi} and phase shift {\Delta}. Focus is on such multilayers, which have sensitivity to both parameters ({\Psi}, {\Delta}) in the visible spectral range, thus opening the possibility for further research on a new biomedical sen…

The 23rd international vacuum microbalance techniques conference

1990

Photoelectron spectroscopy of thin discontinuous metal films deposited onto a sapphire substrate

1995

Abstract The charging of small metallic clusters forming discontinuous gold and gallium films, condensed in vacuum onto an insulating substrate (sapphire), was experimentally studied by the method of ultraviolet photoelectron spectroscopy (UPS) for a photon energy of 5.4 eV. It seems that the charging is due to electron emission as well as to electron transfer from metal islands to the empty electron states in the metal-insulator interface.

Локальные и интегральные свойства квазиодномерного сверхпроводника в режиме квантовых флуктуаций параметра порядка

2021

Utilization of superconducting materials for the new generation of nanoelectronic devices seems extremely tempting from the point of view of the absence of Joule heating. However, in small systems, the role of fluctuations can be very significant. In this work, the transport properties of thin superconducting titanium nanostructures were studied experimentally and theoretically. It has been shown that quantum fluctuations of the order parameter have a dif-ferent impact on integral and local characteristics of a quasi-one-dimensional superconductor. In sufficiently thin nanowires, a finite electrical resistance can be observed at the lowest tem-peratures, while the tunneling current-voltage…

Сверхпроводящие микроструктуры с высоким импедансом

2020

Abstract The transport properties of two types of quasi-one-dimensional superconducting microstructures were investigated at ultra-low temperatures: the narrow channels close-packed in the shape of meander, and the chains of tunneling contacts “superconductor-insulator-superconductor.” Both types of the microstructures demonstrated high value of high-frequency impedance and-or the dynamic resistance. The study opens up potential for using of such structures as current stabilizing elements with zero dissipation.

A Comparative Ab Initio Thermodynamic Study of Oxygen Vacancies in ZnO and SrTiO3: Emphasis on Phonon Contribution

2013

Using a hybrid Hartree–Fock (HF)-DFT method combined with LCAO basis set and periodic supercell approach, the atomic, electronic structure and phonon properties of oxygen vacancies in ZnO and SrTiO3 were calculated and compared. The important role of a ghost basis function centered at the vacant site and defect spin state for SrTiO3 is discussed. It is shown that the use of hybrid functionals is vital for correct reproduction of defects basic properties. The Gibbs free energy of formation of oxygen vacancies and their considerable temperature dependence has been compared for the two oxides. These calculations were based on the polarizability model for the soft mode temperature behavior in S…

Valence band photoemission from thin iron films - A comparison of experimental and theoretical results

1998

Abstract In this contribution, we report on photoemission data from thin iron films on W(110) that have been carried out by means of spin-resolved photoelectron spectroscopy as well as Magnetic Circular Dichroism in valence band photoemission at the storage ring BESSY. These techniques give complementary information on the electronic and magnetic properties, such as exchange and spin–orbit splitting. We compare our experimental data to new photoemission calculations, which have been obtained in the framework of a fully relativistic one-step theory for ferromagnetic materials.

Competition between submonolayer ordering and multilayer adsorption: Studies of simple lattice gas models

1986

Abstract We model condensation of adatoms at a substrate surface by a semi-infinite simple cubic lattice gas system. While in the bulk there is just a nearest-neighbour attractive interaction, in the first layer adjacent to the surface we allow for a periodic potential due to the substrate with a period of two lattice spacings, or for a next-nearest-neighbour repulsive interaction mediated by the substrate. Hence order-disorder phenomena may occur in the first layer, while only gas-liquid condensation transitions can occur in layers further away from the substrate surface. The ground-state phase diagrams of this model are obtained exactly, while the behaviour at nonzero temperatures is obta…

Incommensurate phases in adsorbed monolayers: structure and energy of domain walls

2002

Abstract The properties of incommensurate films of domain-wall structure formed on the (1 0 0) plane of face centered cubic crystals are studied by Monte Carlo simulation. The wall energies, wall structure and the wall–wall interaction are determined for different types of domain walls occurring in films which form the c(2×2) registered structure. The systems characterized by different strength and corrugation of the surface potential and of different misfit between adsorbate and adsorbent are discussed. It is demonstrated that heavy as well as light walls are rather strongly localized. Moreover, it is shown that the incommensurate structure with crossing heavy walls has higher stability th…