Structural and optical properties of metastable SiGe/Si films with a low germanium concentration

The properties of metastable Si_{1 ? x} Ge _x /Si (10% < x < 16%) layers grown by molecular beam epitaxy on Si(100) substrates have been investigated using atomic force microscopy, X-ray diffraction, and low-temperature luminescence spectroscopy. It has been shown that ring-like aggregates are formed on the surface of layers grown at temperatures of 500–700°C. The size and shape of these aggregates suggest that their formation is associated with the diffusion instability arising due to the existence of a relationship between the surface diffusion, stresses, and the wetting potential during the growth of the epitaxial film. The existence of deviations from the homogeneous germanium distribution in the layer plane has been confirmed by a detailed analysis of the X-ray rocking curves and two-dimensional diffraction patterns. The structures with severe surface disturbances are characterized by an abnormal change in the decay times of the emission lines of bulk silicon, which indicate the presence of local electric and/or strain fields in subsurface regions. The perturbations of the flat crystallization front are suppressed as the growth temperature of layers decreases to 350°C. Despite the absence of a coating layer of silicon, the photoluminescence spectra of the layers themselves depend weakly on their thickness and growth temperature and remain sensitive only to the technological concentration of germanium. A slowly decaying luminescence associated presumably with the localization of excitons near the SiGe-Si interface has been observed in one of the samples grown at a temperature of 700°C and containing a dense array of ring-like aggregates.     

Kinetic Simulation of Fractal Aggregation on Liquid Surfaces

A modified fractal growth model based on the deposition, diffusion, and aggregation (DDA) with cluster rotation is presented to simulate two-dimensional fractal aggregation on liquid surfaces. The mobility (including diffusion and rotation) of clusters is related to its mass, which is given by D_m=D₀ s^-γ_D and θ_m=θ₀s^-γ_θ, respectively. We concentrate on revealing the details of the influence of deposition flux F, cluster diffusion factor γ_D and cluster rotation factor γ_θ on the dynamics of fractal aggregation on liquid surfaces. It is shown that the morphologies of clusters and values of cluster density and fractal dimension depend dramatically on the deposition flux and migration factors of clusters.     

Processes involved in the formation of silver clusters on silicon surface

We analyze scanning electron microscopy measurements for structures formed in the deposition of solid silver clusters onto a silicon(100) substrate and consider theoretical models of cluster evolution onto a surface as a result of diffusion and formation of aggregates of merged clusters. Scanning electron microscopy (SEM) data are presented in addition to energy dispersive X-ray spectrometry (EDX) measurements of the these films. Solid silver clusters are produced by a DC magnetron sputtering source with a quadrupole filter for selection of cluster sizes (4.1 and 5.6 nm or 1900 and 5000 atoms per cluster in this experiment); the energy of cluster deposition is 0.7 eV/atom. Rapid thermal annealing of the grown films allows analysis of their behavior at high temperatures. The results exhibit formation of cluster aggregates via the diffusion of deposited solid clusters along the surface; an aggregate consists of up to hundreds of individual clusters. This process is essentially described by the diffusion-limited aggregation (DLA) model, and thus a grown porous film consists of cluster aggregates joined by bridges. Subsequent annealing of this film leads to its melting at temperatures lower than to the melting point of bulk silver. Analysis of evaporation of this film at higher temperatures gives a binding energy in bulk silver of ɛ₀= (2.74 ± 0.03) eV/atom. The text was submitted by the authors in English.     

Light-scattering properties of fractal aggregates: numerical calculations by a superposition technique and the discrete-dipole approximation

Dust particles in space often grow by mutual collisions and appear to be an agglomeration of individual grains, the morphology of which can be described by the concept of fractals. In this paper, we study light scattering by fractal aggregates of identical spheres (monomers) using the superposition technique incorporated into the T-matrix method where the orientationally averaged scattering matrix is analytically obtained. We also apply the discrete-dipole approximation, in which the dipole polarizability of spherical monomers is determined by the first term of the scattering coefficients in the Mie theory. Two cases of the ballistic aggregation process (particle–cluster and cluster–cluster aggregations) are considered to model fractal aggregates consisting of silicate or carbon material. The dependences of light-scattering properties on the monomer sizes, aggregate structures and material compositions are intensively investigated. The light-scattering properties of the fractal aggregates strongly depend on the size parameters of the monomers. The difference in the scattering function between the particle–cluster and cluster–cluster aggregates can be seen in the case of monomers much smaller than the wavelength of incident radiation. When the size parameter of monomers exceeds unity, the material composition of the monomers influences the light-scattering properties of the aggregates, but different morphologies result in similar scattering and polarization patterns. We show that silicate aggregates consisting of submicron-sized monomers, irrespective of the aggregate size and morphology, produce a backscattering enhancement and a negative polarization observed for dust in the solar system.     

Measurements of Silica Aggregate Particle Growth Using Light Scattering and Thermophoretic Sampling in a Coflow Diffusion Flame

The evolution of silica aggregate particles in a coflow diffusion flame has been studied experimentally using light scattering and thermophoretic sampling techniques. An attempt has been made to calculate the aggregate number density and volume fraction using the measurements of scattering cross section from 90° light scattering with combination of measuring the particle size and morphology from the localized sampling and a TEM image analysis. Aggregate or particle number densities and volume fractions were calculated using Rayleigh–Debye–Gans and Mie theory for fractal aggregates and spherical particles, respectively. Using this technique, the effects of H₂ flow rates on the evolution of silica aggregate particles have been studied in a coflow diffusion flame burner. As the flow rate of H₂ increases, the primary particle diameters of silica aggregates have been first decreased, but, further increase of H₂ flow rate causes the diameter of primary particles to increase and for sufficiently larger flow rates, the fractal aggregates finally become spherical particles. For the cases of high flame temperatures, the particle sizes become larger and the number densities decrease by coagulation as the particles move up within the flame. For cases of low flame temperatures, the primary particle diameters of aggregates vary a little following the centerline of burner and for the case of the lowest flame temperature in the present experiments, the sizes of primary particles even decrease as particles move upward.     

Effect of different surfactants on the morphology,growth and magnetic behavior of MnWO4 crystals via the hydrothermal method

MnWO₄ nano- and microcrystals with various morphologies have been prepared by the surfactant-assisted hydrothermal method. The crystals were characterized by X-ray diffraction, scanning electron microscopy and magnetic measurements. Different morphologies and growth mechanisms of MnWO₄ crystals depend on the surfactant employed. Our results reveal that the MnWO₄ nanocrystals exhibit weak ferromagnetism at low temperature due to incomplete spin compensation on the surface with nanoparticle size, while microflowers show antiferromagnetic behavior at low temperature. The crystal morphologies and the size effects associated with surfactants result in these tunable magnetic behaviors.     

Measurement of Aggregate Fractal Dimensions Using Static Light Scattering

Aggregates formed from colloidal particles will vary in shape according to the aggregation regime prevalent. Compact structures are formed when the aggregation is slow, whilst loose tenuous structures are formed when rapid (or diffusion limited) aggregation prevails. These structures can be fractal in nature, that is, there is a relationship between porosity and the number of primary particles making up the aggregate, and is described by the fractal dimension, d_F. Fractal dimensions of hematite aggregates have been measured experimentally using the static light scattering technique. Fractal dimensions varied with aggregation regimes; for the rapid aggregation regime, d_F was found to be 2.8, whilst for conditions in which aggregation was slow (retardation forces prevail), d_F's of 2.3 were measured. For conditions which lead to aggregation in which both diffusion and retardation forces play a part, structures with fractal dimensions such that 2.3 < d_F < 2.8 were found. The effects of adsorbed fulvic acid, a naturally occuring organic acid, on the kinetics of hematite aggregation and on the resulting structure of hematite aggregates were also investigated. The study of aggregate structure shows that the fractal dimensions of hematite aggregates which are partially coated with fulvic acid molecules are higher than those obtained with no adsorbed fulvic acid. The scattering exponents obtained from static light scattering experiments of these aggregates range from 2.83 ± 0.08 to 3.42 ± 0.1. The scattering exponents of greater than 3 indicate that the scattering is the result of objects that contains pores which are bounded by surfaces with a fractal structure, and can be related only to surface fractal dimension. The high fractal dimensions are due to restructuring within the aggregates, which only occured at low coverage by the organic acid.     

Thermodynamic and scaling behaviour in finite diffusion-limited aggregation

Rényi's entropies for diffusion-limited aggregates are studied as a function of the number N of particles contained in the aggregates. It is found that Rényi's values increase with log N in a linear fashion, and that the aggregates exhibit multifractal behaviour for finite values of N. When N → ∞, the aggregate has a monofractal structure. Rényi's entropies depend on the fractal dimension of the aggregate. When the fractal dimension increases, the values of K_q decrease for q ? 1> and increase for q > 1.     

Controlled synthesis of BaWO4 hierarchical nanostructures by exploiting oriented attachment in the solution of H2O and C2H5OH

Shape-controlled synthesis of BaWO₄ hierarchical nanostructures has been successfully achieved by exploiting oriented attachment in a mixture of water and ethanol. A controlled change in the volume ratio of C₂H₅OH and H₂O or the concentration of initial reagents has resulted in the synthesis of products of various morphologies, such as shuttle-like, ellipsoid-like, and flower-like ones. The obtained products are characterized by field emission scanning electron microscopy, high-resolution transmission electron microscopy, X-ray powder diffraction, and Fourier transform infrared spectroscopy. The altered nucleation and growth rates of primary particles that assembled to the final hierarchical nanostructures through oriented attachment are the main cause of the evolution of their morphologies. The room-temperature photoluminescent intensities of the products strongly depend on their morphology.     

A Dissymmetry Ratio Optical Technique as Applied to Scattering Pattern Recognition of Differently Shaped Soot Aggregates

We investigated the shape of soot aggregates as retrieved from light scattering measurements. In particular, the ratios of scattered light intensities at two angles, called the dissymmetry ratios (DRs), will be considered. These are attractive diagnostic tools as they are insensitive to variations in the complex refractive index (m = n + i k) and to the electromagnetic effect of self-interaction that each individual scatterer in the aggregate produces with itself depending on its finite size. The aim of the paper is both to correlate the DRs with the information about the aggregate shape and to establish what is the minimum number of scattering measurements to be performed to characterize the aggregate scattering patterns. The main results can be summarized as follows: (a) an independent evaluation of the primary spherule size is required in order to interpret the scattering data correctly; (b) some of the DRs can share common values for different morphologies when the number of primary spherules per aggregate is sufficiently high; in this respect, we demonstrate the significance of the dissymmetry ratio R_vv(10°/90°) for the identification of the prevailing morphology of aggregates at different levels of agglomeration; (c) the information about light intensities scattered at three angles seems to suffice for the recognition of prevailing aggregate morphology.     

Implementation of an advanced fixed sectional aerosol dynamics model with soot aggregate formation in a laminar methane/air coflow diffusion flame

An advanced fixed sectional aerosol dynamics model describing the evolution of soot particles under simultaneous nucleation, coagulation, surface growth and oxidation processes is successfully implemented to model soot formation in a two-dimensional laminar axisymmetric coflow methane/air diffusion flame. This fixed sectional model takes into account soot aggregate formation and is able to provide soot aggregate and primary particle size distributions. Soot nucleation, surface growth and oxidation steps are based on the model of Fairweather et al. Soot equations are solved simultaneously to ensure convergence. The numerically calculated flame temperature, species concentrations and soot volume fraction are in good agreement with the experimental data in the literature. The structures of soot aggregates are determined by the nucleation, coagulation, surface growth and oxidation processes. The result of the soot aggregate size distribution function shows that the aggregate number density is dominated by small aggregates while the aggregate mass density is generally dominated by aggregates of intermediate size. Parallel computation with the domain decomposition method is employed to speed up the calculation. Three different domain decomposition schemes are discussed and compared. Using 12 processors, a speed-up of almost 10 is achieved which makes it feasible to model soot formation in laminar coflow diffusion flames with detailed chemistry and detailed aerosol dynamics.     

Humic acid metal cation interaction studied by spectromicroscopy techniques in combination with quantum chemical calculations

Humic acids (HA) have a high binding capacity towards traces of toxic metal cations, thus affecting their transport in aquatic systems. Eu(III)–HA aggregates are studied by synchrotron‐based scanning transmission X‐ray microscopy (STXM) at the carbon K‐edge and laser scanning luminescence microscopy (LSLM) at the ⁵D₀→⁷F_1,2 fluorescence emission lines. Both methods provide the necessary spatial resolution in the sub‐micrometre range to resolve characteristic aggregate morphologies: optically dense zones embedded in a matrix of less dense material in STXM images correspond to areas with increased Eu(III) luminescence yield in the LSLM micrographs. In the C 1s‐NEXAFS of metal‐loaded polyacrylic acid (PAA), used as a HA model compound, a distinct complexation effect is identified. This effect is similar to trends observed in the dense fraction of HA/metal cation aggregates. The strongest complexation effect is observed for the Zr(IV)–HA/PAA system. This effect is confirmed by quantum chemical calculations performed at the ab initio level for model complexes with different metal centres and complex geometries. Without the high spatial resolution of STXM and LSLM and without the combination of molecular modelling with experimental results, the different zones indicating a `pseudo'‐phase separation into strong complexing domains and weaker complexing domains of HA would never have been identified. This type of strategy can be used to study metal interaction with other organic material.     

Effect of Surface Roughness, Type and Size of Model Aggregates on the Bond Strength of Aggregate/Mortar Interface

The paper reports on a two-stage study of the interface between three types of model cylindrical aggregates (sandstone, limestone and granite) and two types of mortar matrix (plain and 20% Silica Fume mortar). In the first stage, the surface roughness (R _a) of the aggregates and the interfacial bond strength using push-out specimens have been experimentally determined. In the second, aggregate push-out geometry has been modelled using two different approaches. In the first approach, the surface roughness is ignored and the cylindrical aggregates are assumed to have an ideally smooth surface with a constant radius, r ₀ over the aggregate length, L. In the second approach, the surface roughness of the aggregates is included so that the radius, r varies along the length of the cored rock aggregate. Hence, the influence of the surface roughness of the aggregates on the interfacial bond strength is obtained. It is found that the surface roughness plays a significant role in determining the interfacial bond strength, in particular of smaller size aggregates. The effect, however, diminishes as the aggregate size increases, regardless of the aggregate and mortar type.     

Controlled synthesis of oriented ZnO nanorod arrays by seed-layer-free electrochemical deposition

Oriented ZnO nanorod arrays were successfully prepared on transparent conductive substrates by seed-layer-free electrochemical deposition in solution of Zn(NO₃)₂ at a low temperature of 70 °C without using any catalysts, additives, and additional seed crystals. The effects of the Zn(NO₃)₂ concentration, deposition time and applied current on the localized nanorod arrays are investigated. X-ray powder diffraction (XRD) and field emission scanning electron microscopy (FE-SEM) were used to characterize the structures and the morphologies of ZnO nanorod arrays. The heights and diameters of ZnO nanorods can be tuned by controlling the electrodeposition parameters.     

沉积在硅油表面上的Ag原子分形凝聚体

研究了沉积在硅油表面上的Ag原子团簇,经过随机扩散和转动,最终形成大尺度分形凝聚体的凝聚过程．研究结果表明：Ag原子团簇在这种液体基底上的转动为随机转动,转动角位移的方均值<(Δθ)²>和测量时间间隔Δt满足广义爱因斯坦关系<(Δθ)²>=4D_θΔt．随机转动系数D_θ与凝聚体面积S满足指数关系D_θ∝S^{－γ_θ,其中指数γ_θ＝2.4±0. 关键词：}     

Modeling of methane steam reforming in a microchannel subject to multicomponent diffusion

Catalytic methane steam reforming in a slot microchannel under external heat supply to the mixture reacting on walls is considered based on numerical simulation of a complete system of Navier-Stokes equations. Three ways of heat supply to channel walls are represented, namely, a uniform heat flux, a heat flux linearly decreasing in channel length, and a heat flux following the reaction rate profile of the main reaction. The thermophysical parameters of the mixture depend on its temperature and composition. Two diffusion models are considered, namely, models with equal and different diffusion coefficients for each mixture component. It is shown that consideration of multicomponent diffusion does not practically affect the concentration of the components and the methane reforming at the outlet. For the above-mentioned ways of heat supply, the methane reforming with a heat flux linearly decreasing in channel length is most significant.     

Dipolar structuring of organically modified fluorohectorite clay particles

This report focuses on both the characterization of organically modified fluorohectorite (Fh) clay particles and their electric-field-induced alignment when suspended in a non-polar liquid (silicone oil). Thermal decomposition temperatures of the surfactant molecules adsorbed on the clay surfaces and those being intercalated between clay crystalline layers were measured by thermal gravimetric analysis (TGA). Zeta potential measurements confirmed the successful modification of the clay surfaces. Optical microscopy observations showed that the sedimentation of modified particles was much slower compared to that of the non-modified system. It was shown that organic modification has a significant effect on colloidal stability of the system, preventing particles from forming large aggregates when suspended in a non-polar liquid. There are also signs of a slight increase in overall alignment of the clay particles when exposed to in an electric field, with the nematic order parameter (S₂) being higher for the organically modified particles, compared to that of the non-modified counterparts. This behaviour is mainly a result of the formation of smaller and more uniform aggregates, in contrast to the large aggregate structures formed by non-modified clay particles.     

Effects of Soret diffusion on the laminar flame speed and Markstein length of syngas/air mixtures

The effects of Soret diffusion on premixed syngas/air flames at normal and elevated temperatures and pressures are investigated numerically including detailed chemistry and transport. The emphasis is placed on assessing and interpreting the influence of Soret diffusion on the unstretched and stretched laminar flame speed and Markstein length of syngas/air mixtures. The laminar flame speed and Markstein length are obtained by simulating the unstretched planar flame and positively-stretched spherical flame, respectively. The results indicate that at atmospheric pressure the laminar flame speed of syngas/air is mainly reduced by Soret diffusion of H radical while the influence of H₂ Soret diffusion is negligible. This is due to the facts that the main reaction zone and the Soret diffusion for H radical (H₂) are strongly (weakly) coupled, and that Soret diffusion reduces the H concentration in the reaction zone. Because of the enhancement in the Soret diffusion flux of H radical, the influence of Soret diffusion on the laminar burning flux increases with the initial temperature and pressure. Unlike the results at atmospheric pressure, at elevated pressures the laminar flame speed is shown to be affected by the Soret diffusion of H₂ as well as H radical. For stretched spherical flame, it is shown that the Soret diffusion of both H and H₂ should be included so that the stretched flame speed can be accurately predicted. Similar to the laminar flame speed, the Markstein length is also reduced by Soret diffusion. However, the reduction is found to be mainly caused by Soret diffusion of H₂ rather than that of H radical. Moreover, the influence of Soret diffusion on the Markstein length is demonstrated to decrease with the initial temperature and pressure.     

Atomic force microscopy studies of SrTiO<Subscript>3</Subscript> (001) substrates treated by chemical etching and annealing in oxygen

The SrTiO₃ (001) substrates treated by chemical etching in NH₄F-buffered HF solution and annealing in oxygen ambient have been studied by an atomic force microscopy (AFM). The SrTiO₃ substrates with TiO₂-termineted and atomically smooth surfaces and single unit cell steps have been obtained. The surface morphologies of SrTiO₃ substrates strongly depend on the treated conditions and the quality of the substrates.     

Calculation of the growth kinetics and dispersity of K<Subscript>2</Subscript>SO<Subscript>4</Subscript> crystals in drops of an evaporating solution

Experimental data on the evaporation kinetics of saturated K₂SO₄ solution drops and the nucleation kinetics of the first crystals are used to develop a simple procedure for the calculation of the solution concentration and the number, size, and dispersity of growing crystals. The calculation results agree well with the experimental data on the growth kinetics of K₂SO₄ crystals and their dispersity after complete evaporation of water. The dispersity of crystals is shown to linearly depend on the reciprocal time of evaporation of drops having different initial heights.