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Maryam Molashahi,Hassan Hashemipour Rafsanjani 한국화학공학회 2012 Korean Journal of Chemical Engineering Vol.29 No.5
The adsorption of methane on two activated carbons with different physical properties was measured. Adsorption isotherms were obtained by static volumetric method at different temperatures and pressures. The experimental results sow the best gas storage capacity was 113.5 V/V at temperature 280 K and pressure 8.5MPa on an activated carbon with surface area 1,060 m2/gr. An artificial neural network (ANN) based on genetic algorithm (GA) was used to predict amount of adsorption. The experimental data including input pressure, temperature and surface area of adsorbents as input parameters were used to create a GA-ANN simulation. The simulation results were compared with the experimental data and a good agreement was observed. The simulation was applied to calculate isosteric heat of adsorption by using the Clausius-Clapeyron equation. Comparison of the calculated adsorption heat showed different surface heterogeneity of the adsorbents.
Abbas Ghareghashi,Sattar Ghader,Hassan Hashemipour Rafsanjani 한국공업화학회 2013 Journal of Industrial and Engineering Chemistry Vol.19 No.6
In this paper, theoretical performance of Fischer Tropsch (FT) synthesis is analyzed where its feed comes from an oxidative coupling of methane (OCM) reactor. In this model based analysis, two consecutive reactors are intended that first reactor is OCM and second reactor is FT and FT reactor performance is compared in two conditions of fixed bed and membrane reactor (MR). The parameters concerned, were CH4/O2 ratio, contact time, temperature, and amount of N2 in OCM feed. High CH4/O2 ratio gave low yield of C2+ in OCM due to insufficient oxygen, but favored FT reaction due to more yield of C5+ and other products. Therefore, it was concluded that production and yield of C5+ could be more by use of these configurations.
Structural properties of water around uncharged and charged carbon nanotubes
Mozaffar Ali Mehrabian,Amir Reza Ansari Dezfoli,Hassan Hashemipour Rafsanjani 한국화학공학회 2013 Korean Journal of Chemical Engineering Vol.30 No.3
Studying the structural properties of water molecules around the carbon nanotubes is very important in a wide variety of carbon nanotubes applications. We studied the number of hydrogen bonds, oxygen and hydrogen density distributions, and water orientation around carbon nanotubes. The water density distribution for all carbon nanotubes was observed to have the same feature. In water-carbon nanotubes interface, a high-density region of water molecules exists around carbon nanotubes. The results reveal that the water orientation around carbon nanotubes is roughly dependent on carbon nanotubes surface charge. The water molecules in close distances to carbon nanotubes were found to make an HOH plane nearly perpendicular to the water-carbon nanotubes interface for carbon nanotubes with negative surface charge. For uncharged carbon nanotubes and carbon nanotubes with positive surface charge, the HOH plane was in tangential orientation with water-carbon nanotubes interface. There was also a significant reduction in hydrogen bond of water region around carbon nanotubes as compared with hydrogen bond in bulk water. This reduction was very obvious for carbon nanotubes with positive surface charge. In addition, the calculation of dynamic properties of water molecules in water-CNT interface revealed that there is a direct relation between the number of Hbonds and selfdiffusion coefficient of water molecules.