自制吸附仪储氢性能测试研究

针对全自动吸附仪只能在低压范围内（小于1个大气压）进行吸附研究的缺点,自行设计并生产了一套测量材料吸附性能的仪器,相比于自动吸附仪,此仪器扩大了压力适用范围.应用自制吸附仪,分别运用理想气体状态方程和范德瓦耳斯方程计算了间苯二酚-甲醛碳气凝胶的储氢吸附量. 关键词： 储氢 范德瓦耳斯方程 吸附     

Evolution of planar and cylindrically symmetric magneto-acoustic waves in a van der Waals fluid

We consider a quasilinear system of partial differential equations (PDEs) governing the one-dimensional unsteady planar and cylindrically symmetric motion of an electrically conducting van der Waals fluid permeated with a transverse magnetic field. An asymptotic method is used to derive an evolution equation that governs the wave amplitude in the far field. Our main objective is to study the evolution equation, and to investigate as to how the presence of magnetic field and geometrical spreading (in cylindrical case) along with the cubic nonlinearity, inherently present in the system, influence the wave structure that finally develops.     

Evaluation of the van Deemter equation in terms of open‐ended flow to chromatography

Plate theory and adsorption theory are the main tools available for understanding chromatographic experiments. Both theories predict a Gaussian distribution of solute molecules within the tubular system. However, Gaussian concentration distributions are observed predominantly at slow linear flow rates, while asymmetric concentration distributions are observed at the linear flow rates most used in chromatography. Allegedly, this asymmetry originates from an inhomogeneous distribution of grain sizes in the column and column overload. However, it is an experimental fact that the distribution of chemicals within an injected volume of solute changes as a function of time, while the response is measured simultaneously. Accordingly, the obtained signal cannot be compared to the theory before some type of time‐based deconvolution of the data has been performed. Adjustments to high‐performance liquid chromatography data were thus proposed through empirical equations that describe the relevant time values, peak height, peak area, and parameters of the van Deemter equation. It was proposed that the transfer of solute from the front to the rear part of the pulse during laminar open‐ended flow occurs at rate that depends on the linear flow rate, and to a lesser extent, on properties of the response function.     

Coating for preventing nonspecific adhesion mediated biofouling in salty systems: Effect of the electrostatic and van der waals interactions

Development of anti-biofouling coating has attracted immense attention for reducing the massively detrimental effects of biofouling in systems ranging from ship hulls and surgical instruments to catheters, implants, and stents. In this paper, we propose a model to quantify the role of electrostatic and van der Waals (vdW) forces in dictating the efficacy of dielectric coating for preventing the nonspecific adhesion mediated biofouling in salty systems. The model considers a generic charged lipid-bilayer encapsulated vesicle-like structure representing the bio-organism. Also, we consider the fouling caused by the nonspecific adhesion of the bio-organism on the substrate, without accounting for the explicit structures (e.g., pili, appendages) or conditions (e.g., surface adhesins secreted by the organisms) involved in the adhesion of specific microorganism. The model is tested by considering the properties of actual coating materials and biofouling causing microorganisms (bacteria, fungi, algae). Results show that while the electrostatic-vdW effect can be significant in anti-biofouling action for cases where the salt concentration is relatively low (e.g., saline solution for surgical instruments), it might not be effective for marine environment where the salt concentration is much higher. The findings, therefore, point to a hitherto unexplored driving mechanism of anti-biofouling action of the coating. Such an identification will also enable the appropriate choices of the coating materials (e.g., possible dielectric material with volume charge) and other system parameters (e.g., salinity of the solution for storing the surgical instruments) that will significantly improve the efficiency of the coatings in preventing the nonspecific adhesion mediated biofouling.     

Inclusion property of (R,R)-(-)-trans-2,3,-bis(hydroxydiphenylmethyl)-1,4-dioxaspiro[4,4]nonane for aromatic components

An optically active host molecule, (R,R)-(-)-trans-2,3-bis(hydroxydiphenylmethyl)-1,4- dioxaspiro[4,4]nonane (1), is able to form inclusion complexes with nonpolar aromatic components such as benzene, toluene, p-xylene, mesitylene, and ethylbenzene. The host 1 crystallizes in the monoclinic space group C2 with a = 15.694(2), b = 9.326(2), c = 18.457(1) Å, = 10.34(1)°, and Z = 4. An inclusion complex (1-B) of 1 with benzene crystallizes in the orthorhombic space group P2₁2₁2 with a = 17.007(4), b = 19.670(5), c = 8.634(4) Å, and Z = 4. An inclusion complex (1-X) involving both 1 and p-xylene has the monoclinic space group P2₁ with a = 17.211(3), b = 20.143(3), c = 8.603(3) Å, = 92.64(2)°, and Z = 2. In the inclusion complexes, molecules of 1 are dimerized by intramolecular and intermolecular hydrogen bonds forming eight-membered (OH)₄ rings. The benzene and p-xylene molecules fit into the voids of the crystal packing of 1. In addition, the inclusion complexes are stabilized by van der Waals contacts between the hydrophobic sites. Thermal analysis of the inclusion complexes indicated that the number and the size of the alkyl group of the aromatic components affects the stability of the inclusion complexes.     

Synthesis and characterization of type-II textured tungsten disulfide thin films by vdWR process with Pb interfacial layer as texture promoter

The growth of type-II textured tungsten disulfide (WS₂) thin films by solid state reaction between the spray deposited WO₃ and gaseous sulfur vapors with Pb interfacial layer has been studied. X-ray diffraction (XRD) technique is used to measure the degree of preferred orientation ‘S’ and texture of WS₂ films. Scanning electron microscopy (SEM) and transmission electron microscopy techniques have been used to examine the microstructure and morphology. The electronic structure and chemical composition were studied using X-ray photoelectron spectroscopy (XPS). The use of Pb interfacial layer for the promotion of type-II texture in WS₂ thin films is successfully demonstrated. The presence of (0 0 3 l), (where l=1, 2, 3, …) family of planes in the XRD pattern indicates the strong type-II texture of WS₂ thin films. The crystallites exhibit rhombohedral (3R) structure. The large value of ‘S’ (1086) prompts the high degree of preferred orientation as well. The stratum of crystallites with their basal plane parallel to the substrate surface is seen in the SEM image. The EDS and XPS analyses confirm the tungsten to sulfur atomic ratio as 1:1.75. We purport that Pb interfacial layer enhances type-II texture of WS₂ thin films greatly.     

Correlation of powder flow properties to interparticle interactions at ambient and high temperatures

A combination of a continuum approach and a particle–particle approach to describe the multi-scale nature of the mechanical properties of bulk solids may be beneficial to scientific and engineering applications. In this paper, a procedure is proposed to estimate the interparticle forces beginning with the bulk flow properties as measured with standardized techniques. In particular, the relationship between interparticle forces and bulk solid tensile strength is adopted based on the microscale approaches of Rumpf (1970) and Molerus (1975). The flow properties of fluid cracking catalyst (FCC), corundum and glass bead powders were all characterized with a modified Schulze ring shear cell capable of operating at temperatures up to 500 °C. The powder test conditions were selected such that the van der Waals forces were the most significant particle–particle interactions. The model equations describe two cases, in which either elastic or plastic deformation of the contact points is assumed. The results indicate that the model provides the correct order of magnitude for the values of the tensile strength when proper values for the mean curvature radius at the contact points are taken into account. A sensitivity analysis for the main parameters in the model was performed. This analysis indicated that the assumption of plastic deformation at contact surfaces coupled with a decrease in porosity justified an increase of the tensile strength with consolidation stress. Furthermore, the effect of temperature on the measured flow behavior can be explained as a change in the strength of the material.     

Long-range interactions of the chlorine atom

The dispersion interactions of the chlorine atom ground state with atomic hydrogen and itself are computed with a matrix element tabulation derived from the box-based B-spline configuration-interaction method. The matrix element list was also used to calculate the quadrupole and octupole polarisabilities of the chlorine ground state.     

Dispersion and polarization interactions of the strontium atom

Dispersion coefficients involving the 5s ^{2 1} S ^e and 5s5p ^1,3P ^o states of strontium are determined from a large basis configuration interaction calculation. Dispersion coefficients are presented for the strontium dimer and also for strontium interactions with hydrogen and the rare gases. Polarizabilities and oscillator strengths from some low lying states are also given. The ground state polarizability and that of the 5s5p ¹P ^o and 5s4d ¹D ^e states are very similar in size.