Search results for "fusion"
showing 10 items of 4513 documents
Deviations from equilibrium at the interface of a charged membrane
1989
The local equilibrium assumption commonly employed for the transport through the interface of a charged membrane has been analysed from a simplified electric double layer model. This layer is characterized on the basis of a surface potential arising from a non-zero surface charge density placed on the membrane surface. The dependence of deviations from local equilibrium on the characteristic parameters of the problem is shown. Connection with the classical treatment by Donnan is discussed. Although the complexity of the problem calls for a number of simplifications, the results obtained appears to be significative. Thus, the analysis carried out displays not only that deviations from equili…
Quantitative description of C-60 diffusion on an insulating surface
2010
The diffusion of ${\text{C}}_{60}$ molecules on large, atomically flat terraces of the ${\text{CaF}}_{2}(111)$ surface is studied under ultrahigh vacuum conditions at various substrate temperatures below room temperature. The weak molecule-substrate interaction on this insulating surface makes a direct observation of hopping events difficult. Therefore, to determine a quantitative value of the diffusion barrier, we employ the so-called onset method. This method is based on the analysis of spatial properties of islands created by nucleation of diffusing ${\text{C}}_{60}$ molecules, as measured by noncontact atomic force microscopy. We first determine the critical cluster size to be ${i}^{\en…
Bridging scales with thermodynamics: from nano to macro
2014
We have recently developed a method to calculate thermodynamic properties of macroscopic systems by extrapolating properties of systems of molecular dimensions. Appropriate scaling laws for small systems were derived using the method for small systems thermodynamics of Hill, considering surface and nook energies in small systems of varying sizes. Given certain conditions, Hill's method provides the same systematic basis for small systems as conventional thermodynamics does for large systems. We show how the method can be used to compute thermodynamic data for the macroscopic limit from knowledge of fluctuations in the small system. The rapid and precise method offers an alternative to curre…
Epitaxial growth of molybdenum on TiO2(110)
2003
Abstract Molybdenum was deposited on blue (i.e. non-stoichiometric) TiO2(1 1 0) surface using a very low deposition rate (less than 0.05 eqML min−1). The resulting deposit was investigated by means of X-ray photoelectron diffraction (XPD), LEED and XPS. Just after deposition, the film is mainly constituted of metallic molybdenum, contains oxygen homogeneously dispersed through the whole deposit and the broad features detected in XPD scans are interpreted as a coarse epitaxy between TiO2(1 1 0) surface and the (0 0 1) face of bcc molybdenum. The orientation relationship is: Mo(1 0 0)[0 0 1]//TiO2(1 1 0)[0 0 1]. After annealing the deposit at 673 K, XPD scans become sharper and epitaxy is ach…
On dewetting dynamics of solid films of hydrogen isotopes and its influence on tritium [Beta] spectroscopy
2000
The dewetting dynamics of solid films of hydrogen isotopes, quench-condensed on a graphite substrate, was measured at various temperatures below desorption by observing the stray light from the film. A schematic model describing the dewetting process by surface diffusion is presented, which agrees qualitatively with our data. The activation energies of different hydrogen isotopes for surface diffusion were determined. The time constant for dewetting of a quench-condensed T2 film at the working temperature of 1.86 K of the mainz neutrino mass experiment was extrapolated.
Effect of kinks and concerted diffusion mechanisms on mass transport and growth on stepped metal surfaces
1997
Abstract We study the effect of kinks and concerted atomic mechanisms on diffusion processes relevant to metal-on-metal homoepitaxy on fcc metal surfaces vicinal to the fcc (100) direction. First, we carry out extensive finite-temperature molecular dynamics simulations based on the effective medium theory to search for diffusion mechanisms that dominate the mass transport perpendicular and parallel to step edges. Then, the energetics of these processes are studied by ground state calculations. Our results show that kinks play an important role for diffusion both across and along step edges. In particular, the combined effect of kinks and concerted exchange is found to be able to remove loca…
The non-equilibrium charge screening effects in diffusion-driven systems with pattern formation.
2011
The effects of non-equilibrium charge screening in mixtures of oppositely charged interacting molecules on surfaces are analyzed in a closed system. The dynamics of charge screening and the strong deviation from the standard Debye-Huckel theory are demonstrated via a new formalism based on computing radial distribution functions suited for analyzing both short-range and long-range spacial ordering effects. At long distances the inhomogeneous molecular distribution is limited by diffusion, whereas at short distances (of the order of several coordination spheres) by a balance of short-range (Lennard-Jones) and long-range (Coulomb) interactions. The non-equilibrium charge screening effects in …
Dynamics of multilayer adsorption: a Monte Carlo simulation
1992
Abstract The growth of an adsorbed film at an initially empty surface which is exposed at time t = 0 to a gas is studied within the framework of a kinetic lattice gas model by Monte Carlo simulation. The model includes an attractive potential V ( z ) between adsorbed particles at distance z from the surface, V(z) = −A z 3 and a nearest-neighbor attractive interaction between the gas atoms. Several choices of the surface potential depth A , corresponding to different sequence of layering transitions, are considered. The Monte Carlo process assumes random evaporation/condensation events of gas atoms in adsorbed layers close to the surface, while surface diffusion is disregarded. For temperatu…
AES and CEMS analysis of the formation of layers on Si steel under thermal treatment in a flux of H2/water vapour
1991
The near surface diffusion and reaction processes in iron-silicon steel (3.1 wt.%Si) during 10 min decarburization in water vapour/hydrogen have been studied. The decarburization temperature has been varied between 506 and 714°C for the fixed partial pressure ratio pH2O/pH2=0.017. An outer layer of SiO2 forms on the surface with its thickness increasing with temperature. From 600°C upwards, the decarburization process is hindered and a cementite layer is formed below the SiO2 layer. The formation of fayalite at the surface has been studied at a fixed decarburization temperature with pH2O/pH2 ranging from 0.017 to 0.49. The scale thickness reduces abruptly just before the ratio pH2O/pH2 nece…
Modeling of PAH elimination by adiabatic steam stripping and intraparticle desorption
2003
The decontamination process of solids loaded with PAH in a pilot plant is modeled. This process is separated into two main stages: fast steam stripping at the entrance of the separation tube and the subsequent slow desorption of PAH from the interior of the soil particles. The stripping process also occurs in two stages: fast diffusion controlled saturation of the partial pressures followed by the heat transfer controlled evaporation. The phase diagram of PAH/water is constructed using both the microscopic model and empirical relationships for systems with wide miscibility gaps. The numerical basis for the calculations describing desorption from the soil particles is discussed. The model fo…