Gradient-corrected density functional theory was used to investigate the adsorption of H2S on Pd(1 1 1) surface. Molecular adsorption was found to be stable with H2S binding preferentially at top sites. In addition, the adsorption of other S moieties (SH and S) was investigated. SH and S were found to be preferentially bind at the bridge and fcc sites, respectively. The reaction pathways and energy profiles for H2S decomposition giving rise to adsorbed S and H were determined. Both H2S(ad) → SH(ad) + H(ad) and SH(ad) → S(ad) + H(ad) reactions were found to have low barriers and high exothermicities. This reveals that the decomposition of H2S on Pd(1 1 1) surface is a facile process. 相似文献
A method to calculate the steady-state multicomponent mass transfer in heterogeneous structures is presented. For this, different transport mechanisms represent different regions inside the composite system. The solving scheme allows the calculation of the molar flow rates along the different transport pathways and the estimation of unknown transport parameters based on experimental data.
The steady-state mass transfer of hydrogen and sulfur hexafluoride through a sinter metal supported MFI zeolite membrane is examined as a model system. The support is simulated using the dusty gas model, the molecules passing the zeolite layer may follow transport mechanisms like Knudsen diffusion, surface diffusion or activated gas diffusion. The configuration used, with data from single gas experiments, can predict the binary system only at high temperatures. The problems arising at low temperatures are due to the oversimplified assumption that adsorbed and desorbed molecules do not interact on their way through the MFI zeolite micropores.
However, because of the modular structure of the approach, it can be easily extended to more advanced transport models to account for interactions between the different molecules. And the method can be applied equally well to other systems, such as palladium composite membranes or membranes with catalytic activity. 相似文献
A sulfur-acetylene black (AB) composite was synthesized by thermally treating a mixture of sublimed sulfur and AB. The sulfur-AB composites were characterized by transmission electron microscopy (TEM), scanning electron microscopy (SEM), X-ray diffraction (XRD), and Brunauer-Emmett-Teller (BET) tests. From the results, we confirmed that sulfur was well dispersed on nano-scale and embedded inside nano-pores of the acetylene black with the steric chain structure in the composite. The electrochemical performance of the composite as cathode materials was evaluated by the galvanostatic method, cyclic voltammetry (CV) and electrochemical impedance spectra (EIS). The sulfur-AB composite, which can effectively confine the diffusion of dissolved polysulfides in organic electrolyte and stabilize the structure during the charge and discharge process, showed high capacity and good cycle performance. The discharge capacity of the sulfur-AB composite was maintained at 500 mAh/g after 50 cycles. 相似文献
Five different sulfur content fuels were used on a light-duty diesel engine to study the effect of fuel sulfur on emissions. Four regulated emissions: smoke, nitrogen oxide (NOx), unburned hydrocarbon (HC) and carbon monoxide (CO) emissions of the engine were investigated, as well as three unregulated emissions: formaldehyde (HCHO), acetaldehyde (MECHO) and sulfur dioxide (SO2). The smoke emission decreases continuously and remarkably with the fuel sulfur content, and the fuel sulfur has more influence on smoke emission at lower engine load. The concentration of NOx emissions did not change significantly with the different sulfur content fuels. As the fuel sulfur content decreases, the concentrations of HC and CO emissions have distinct reduction. The HCHO emission values are very low. The MECHO emission decreases with increasing engine load, and it continuously decreases with the fuel sulfur content and it could not be detected at higher engine load with 50 ppm sulfur fuel. The SO2 emission increases continuously with the engine load, and obviously decreases with the fuel sulfur contents. 相似文献
The shell of sulfur coated urea was easily cracked due to sulfur being friable. Sulfur was modified with dicyclopentadiene (DCPD) to increase its strength and abrasion resistance. SEM images showed that the micro-structure of modified sulfur was denser and more uniform than pure sulfur. The strength of modified sulfur increased with the DCPD/S ratio. Experiments of urea particle coating with sulfur and modified sulfur were carried out in a fluidized bed coater. The shell of coated urea particles with modified sulfur was more compact than that with pure sulfur. The modification retarded the sulfur phase transformation from monoclinic to orthorhombic, avoiding the crack formation in the coating shell of sulfur. The modified sulfur coated urea particles can be produced with thinner shell and higher strength, and had better controlled release properties. 相似文献
Sulfur nanoparticles were synthesized from hazardous H2S gas using novel biodegradable iron chelates in w/o microemulsion system. Fe3+–malic acid chelate (0.05 M aqueous solution) was studied in w/o microemulsion containing cyclohexane, Triton X-100 and n-hexanol as oil phase, surfactant, co-surfactant, respectively, for catalytic oxidation of H2S gas at ambient conditions of temperature, pressure, and neutral pH. The structural features of sulfur nanoparticles have
been characterized by X-ray diffraction (XRD), transmission electron microscope (TEM), energy dispersive spectroscopy (EDS),
diffused reflectance infra-red Fourier transform technique, and BET surface area measurements. XRD analysis indicates the
presence of α-sulfur. TEM analysis shows that the morphology of sulfur nanoparticles synthesized in w/o microemulsion system
is nearly uniform in size (average particle size 10 nm) and narrow particle size distribution (in range of 5–15 nm) as compared
to that in aqueous surfactant systems. The EDS analysis indicated high purity of sulfur (>99%). Moreover, sulfur nanoparticles
synthesized in w/o microemulsion system exhibit higher antimicrobial activity (against bacteria, yeast, and fungi) than that
of colloidal sulfur. 相似文献
Electrochemical gold deposition from sulfite solutions was studied by means of voltammetry, EIS and EQCM. A gold film electrode
was used for polyaniline layer formation by electrochemical oxidation of aniline. The standard electrochemical reduction potential
of the reaction [Au(SO3)2]3− + e− = Au + 2 SO32− was determined, and is equal to 0.116 V (vs. NHE). Both solution stirring and temperature increase accelerate the electrochemical
reduction of gold, when the electrode potential is below −0.55 V. When the potential is above −0.55 V the electrochemical
reduction proceeds via passive layer formation. Our study suggests that the passive layer consists of chemically adsorbed
sulfite ions and sulfur. The gold film deposited from sulfite solution is a high quality substrate suitable for conducting
polymer layer formation. This technique, where a polymer layer electrode is prepared by thin gold film deposition onto a metal
surface and by subsequent polymer layer formation, can be applied in sensor research and technology. 相似文献