Dependence of molecular recognition of fullerene derivative on the adlayer structure of zinc octaethylporphyrin formed on Au(100) surface

Adlayers of ZnOEP were prepared on reconstructed Au(100)-(hex) and unreconstructed Au(100)-(1 x 1) surfaces by immersing into a benzene solution containing ZnOEP molecules, and the adlayer structures were characterized by scanning tunneling microscopy (STM). A hexagonally arranged ZnOEP array was formed on an Au(100)-(hex) surface, whereas a rectangularly arranged ZnOEP array was found on an Au(100)-(1 x 1) surface. The adlayer structure of ZnOEP was dependent upon the underlying Au atomic arrangements. Furthermore, an investigation of the spuramolecular assembly for these modified surfaces was carried out by using an open-cage C(60) derivative (opened C(60)). A supramolecular assembled adlayer with a 1:1 composition of opened C(60)/ZnOEP was formed on Au(100)-(hex), whereas aggregates of opened C(60) were found on the ZnOEP-modified Au(100)-(1 x 1) surface. Electrochemical responses of opened C(60) were significantly influenced by underlying ZnOEP arrays. This finding suggests that precise control of underlying ZnOEP adlayers with the Au atomic structure is important to recognize the opened C(60) on them.     

Dibenzo[a,f]perylene Bisimide: Effects of Introducing Two Fused Rings

Perylene bisimides (PBIs) are fascinating dyes with various potential applications. To study the effects of introducing a dibenzo‐fused structure to the perylene moiety, π‐extended PBI derivatives with a dibenzo‐fused structure at both of the a and f bonds were synthesized. The twisted structure was characterized by X‐ray crystal structure analysis. In the cyclic voltammograms, the dibenzo[a,f]‐fused PBI showed a reversible oxidation wave at much less positive potential, relative to a dibenzo[a,o]‐fused PBI derivative. These data indicated that two ring fusions at both sides of a naphthalene moiety, which construct a tetracene core, effectively raise the HOMO level compared to fusion of one ring at each naphthalene moiety (two anthracene cores). The dibenzo[a,f]‐fused PBI derivative showed an absorption band at 735 nm with a shoulder band reaching 900 nm.     

Transverse instability of solitary waves in the generalized kadomtsev-petviashvili equation

The linear stability of planar solitary waves with respect to long-wavelength transverse perturbations is studied in the framework of the generalized Kadomtsev-Petviashvili equation. It is newly discovered that for some nonlinearities in this family, the solitary waves could be transversely unstable even in a medium with negative dispersion. In the case of positive dispersion, they are found to be always unstable.     

Numerical simulations of droplet formation in a cross‐junction microchannel by the lattice Boltzmann method

An immiscible liquid–liquid multiphase flow in a cross‐junction microchannel was numerically studied using the lattice Boltzmann method. An improved, immiscible lattice BGK model was proposed by introducing surface tension force based on the continuum surface force (CSF) method. Recoloring step was replaced by the anti‐diffusion scheme in the mixed region to reduce the side‐effect and control the thickness of the interface. The present method was tested by the simulation of a static bubble. Laplace's law and spurious velocities were examined. The results show that our model is more advantageous for simulations of immiscible fluids than the existing immiscible lattice BGK models. Computational results of multiphase flow in a cross‐junction microchannel were obtained and analyzed based on dimensionless numbers. It is found that the flow pattern is decided mostly by the capillary number at a small inlet flux. However, at the same capillary number, a large inlet flux will lead to much smaller droplet generation. For this case, the flow is determined by both the capillary number and the Weber number. Copyright © 2007 John Wiley & Sons, Ltd.     

A Discrete Effect of the Thermal Lattice BGK Model

In this article, a discrete effect in the thermal Lattice BGK two-speed model is studied. These effects are due to the non-equilibrium state in the particle distribution function, and the non-equilibrium occurs near walls. The mechanism of the LBM counterpart of the thermal creep flow, which appears due to the temperature gradient of the boundary in rarefied gases, is clarified analytically and numerical calculations are performed for some cases. A technique for eliminating this effect is also shown.     

Observation of micropores in hard-carbon using Xe NMR porosimetry

The existence of micropores and the change of surface structure in pitch-based hard-carbon in xenon atmosphere were demonstrated using ¹²⁹Xe NMR. For high-pressure (4.0 MPa) ¹²⁹Xe NMR measurements, the hard-carbon samples in Xe gas showed three peaks at 27, 34 and 210 ppm. The last was attributed to the xenon in micropores (<1 nm) in hard-carbon particles. The NMR spectrum of a sample evacuated at 773 K and exposed to 0.1 MPa Xe gas at 773 K for 24 h showed two peaks at 29 and 128 ppm, which were attributed, respectively, to the xenon atoms adsorbed in the large pores (probably mesopores) and micropores of hard-carbon. With increasing annealing time in Xe gas at 773 K, both peaks shifted and merged into one peak at 50 ppm. The diffusion of adsorbed xenon atoms is very slow, probably because the transfer of molecules or atoms among micropores in hard-carbon does not occur readily. Many micropores are isolated from the outer surface. For that reason, xenon atoms are thought to be adsorbed only by micropores near the surface, which are easily accessible from the surrounding space.     

Reduction and dephosphorization of molten iron oxide with hydrogen-argon plasma

A laboratory-scale test was made in which iron oxide contained in a water-cooled crucible was melted and reduced by using a 10–50% H₂-Ar transferred arc plasma. The degree of reduction was found to be proportional to the amount of hydrogen fed. The efficiency of hydrogen utilization for the reduction was 50–70%, which is much higher than equilibrium values below 3000 K. This high efficiency was attributable partially to the reactivity of the hydrogen atom in a plasma and partially to the continuous contact of the hydrogen plasma with the molten iron oxide layer floating over the liquid iron formed. During the plasma reduction, evaporative loss of phosphorus was observed. The degree of phosphorus removal depended on the weight ratio, CaO/(SiO₂+Al₂O₃). H₂-Ar plasma was shown to be far superior for the phosphorus removal, compared with Ar and Ar-N₂ plasma.