Sharif Digital Repository

The method of unity bond index-quadratic exponential potential (UBI-QEP) and the computer simulation of the temperature programmed desorption (TPD) patterns are employed to derive the kinetic and thermodynamic parameters associated with the steps of the pathway we propose for the catalytic decomposition of methyl iodide on the Cu(111) surface. Assuming a highly reactive `hot methyl' surface intermediate and on the basis of our calculations it is concluded that the desorption of a part of this species is responsible for the reported methyl radical TPD peak at 140 K, while a part of this surface species is trapped in the three-fold sites of the Cu(111) surface and desorbs to form the reported... 

Hydrogen storage/evolution behavior of nafion/NaCl/graphene quantum dot (GQD) mixed matrix as selective hydrogen capacitor (power source) was evaluated in detail through an electrochemical process at two independent potential ranges. For this purpose, a three-electrode system included Pt disk as counter electrode, Ag/AgCl as reference electrode and GQD-based mixed matrix-modified Pt disk as working electrode. For hydrogen storage, the deposition potential and time were evaluated to −1.0 V (vs. Ag/AgCl) and 120 s, respectively under high basic solution generated using NaOH (1.0 M) solution, followed by evolution of hydrogen at +0.8 V (vs. Ag/AgCl) during formation of hydrogen bubbles. The... 

Comparison of the traditional linear heating method of TPD with an original stepwise heating scheme was reported for the first time. Stepwise heating TPD was carried out by keeping the temperature constant as soon as ammonia desorption signal rises until the signal returns to the baseline. More ammonia desorption peaks on a SAPO-34 catalyst were identified using TPD with stepwise heating. The effect of temperature ramp on desorption peak broadening in TPD curve was also addressed. The more distinct ammonia desorption peaks in stepwise TPD indicates that ammonia adsorbs in about five or six different ways on SAPO-34, and attribution of different adsorptions may be explained considering some... 

Heterogeneous solid catalysts comprising CaO and ZrO 2 mixed oxides with various Ca-to-Zr molar ratios were synthesized by means of coprecipitation method. These synthesized mixed oxide catalysts were used for the transesterification of waste cooking oil (WCO) as feedstock with methanol to produce biodiesel fuel (BDF) at 65 °C and 1 atm. The influences of Ca-to-Zr molar ratio, catalyst loading, methanol-to-oil molar ratio, and the reaction time on the BDF yield were carefully investigated. In addition, the stability of prepared solid catalysts was studied. These catalysts were characterized by using techniques of X-ray diffraction, X-ray florescence, X-ray photoelectron spectroscopy, surface... 

In this research effects of important synthesis parameters upon catalytic performance of a novel graphene based catalyst for an HDS reaction were investigated. The graphene oxide (GO) used as a support was initially prepared through chemical exfoliation of graphite via modified Hummers method. In this venue the impregnation method, promoter/main metallic spices ratio, total metal loading of the active phase and amount of chelating agent were systematically understudied. Thus, GO was impregnated with active metallic phases through the hydrothermal and modified incipient wetness impregnation techniques. In both procedures, 1:2, 1:3 and 1:4 weight ratios of Co/Mo with the percentages of the... 

Faujasite (X, Y) zeolites are considered the main and important catalysts in hydrorefining processes. In order to obtain zeolites with higher acidity and volume of mesopores, post-synthesis modification, dealumination by different pickling techniques (using ethylenediamine tetraacetic acid [EDTA] chelating agent), and thermal treatment (calcination) were employed. The dealumination process led to the removal of the aluminum atoms from the zeolite structure and a rise in acidity while maintaining the zeolite crystalline lattice. X-ray diffraction (XRD), atomic absorption spectrometry (AAS), Fourier-transform infrared (FT-IR), field-emission scanning electron microscopy (FE-SEM),... 

In this study, graphene materials have been synthesized with solid camphor (C10H16O) and methane gas as carbon precursors using atmospheric pressure chemical vapor deposition (CVD) technique at a temperature range of 900-1000 °C for a period of 45 min over copper nanoparticles. Influence of the carbon precursors upon the shape, number of layers and yield of the synthesized graphene samples has been investigated. In this venue, the compounds synthesized were functionalized with oxygen groups and impregnated by cobalt and molybdenum active phases. Moreover, the total metal loading and Co/Mo weight ratio of prepared compounds were adjusted to their industrial nominal values of 10% and 0.33,... 

Several SAPO-34 samples with different Si/Al ratio (0.05-0.5) of synthesis gel were prepared hydrothermally at crystallization temperature of 190-215 °C. The products were characterized by XRD, SEM/EDX, NH3-TPD, FT-IR and nitrogen adsorption techniques. EDX data showed a deviation of elemental composition of products with respect to the Al, Si, and P from that of the gel mixture, but the increasing trend of Si/Al ratio of the products was confirmed. According to XRD and SEM results, crystallinity of samples increased with Si/Al ratio up to the low to medium range of ca. 0.13. However, a reduction in the crystallinity was observed with further increase of the silicon content of the synthesis... 

Abstract: This study investigates the catalytic activity of mixed–metal oxide nanoparticles with different surface acidities on asphaltene adsorption followed by catalytic oxidation–decomposition. Three different types of mixed–metal oxide nanoparticles (CeNiO3, CeCaO3 and CeZrO4) were synthesized, and their size, structure, and acid properties were characterized by field–emission scanning electron microscopy (FE–SEM), energy-dispersive X-ray spectroscopy (EDX), the high–resolution transmission electron microscopy (HR-TEM), X-ray powder diffraction (XRD), Brunauer-Emmett-Teller (BET) surface area measurement and ammonia temperature-programmed desorption (NH3–TPD). Asphaltenes were extracted... 

The present work is comprised of two main parts. In part 1 the Co-Ni/γ-Al2O3 catalyst was prepared using a sol-gel procedure. Then the effect of calcination variables including the calcination temperature and time on the catalytic performance for production of light olefins was investigated and optimized. The obtained results have shown that the catalyst which was calcined at 550 °C for 6 h has revealed the better catalytic performance for production of light olefins. In part 2 the effect of process conditions including the reaction temperature, H2/CO feed ratio and total reaction pressure on the catalytic performance (CO conversion%, (C2-C4) selectivity% and C5+ selectivity%) was...