Grand canonical Monte Carlo simulation of isotherm for hydrogen adsorption on nanoporous siliceous zeolites at room temperature |
| |
Authors: | Mahmoud Rahmati |
| |
Institution: | Chemical Engineering Department, Amirkabir University of Technology (Polytechnic Tehran), 424 Hafez Avenue, Tehran, Iran |
| |
Abstract: | Zeolites belong to a most prominent class of nanoporous materials which have been considered as potential sorbents for hydrogen storage. The adsorption of hydrogen molecules on purely siliceous zeolites such as ACO, MEP, ASV, ANA, RWY, and RHO, which encompass a range of different pore structures and their chemical compositions has been simulated employing Grand Canonical Monte Carlo (GCMC) procedure for a temperature range of 250-325 K, and a pressure range of 0-10 kbar. The effects of pore structure of zeolites, temperature and pressure on the hydrogen adsorption has been examined. The results clearly show that the number of adsorbed hydrogen molecules at high pressure, only depends on pore diameter, and the temperature effect on the adsorption decreases with decrease in the number of adsorbed of hydrogen molecules. |
| |
Keywords: | Hydrogen Zeolite Adsorption Pore structure Monte Carlo simulation |
本文献已被 ScienceDirect 等数据库收录! |
|