Molecular dynamics simulations have been carried out in order to investigate the adsorption and permeation phenomena of butane isomers through ZSM-5 membranes. Using the VT ensemble configurational-bias Monte Carlo technique, we are able to determine the preferred locations of the butane isomers in the ZSM-5 channels. In permeation simulations, using the VT ensemble non-equilibrium molecular dy...

Fe2O3/ZSM-5 modified with Ce via citrate route (sol-gel approach) is applied for H2S removal in 500–700 ◦C temperature range. The sulfidation activity of Fe2O3/ZSM-5 is appreciably promoted by introduction of Ce plausibly attributed to the synergy of Fe2O3 and CeO2. 5Fe5Ce/ZSM-5 performs the optimal desulfurization behavior at 600 ◦C with sulfur capacity of 1020 μmol S/g, and the sulfidation pr...

Fe/ZSM-5 nanosheet zeolites of varying thickness were synthesized with di- and tetraquaternary ammonium structure directing agents and extensively characterized for their textural, structural, and catalytic properties. Introduction of Fe3+ ions in the framework of nanosheet zeolites was slightly less effective than in bulk ZSM-5 zeolite. Steaming was necessary to activate all catalysts for N2O ...

Aluminum coordination in the framework of USY and ZSM-5 zeolites containing charge-compensating cations (NH4+, H+, or Cu+) was investigated by Al K-edge EXAFS and XANES. This work was performed using a newly developed in-situ cell designed especially for acquiring soft X-ray absorption data. Both tetrahedrally and octahedrally coordinated Al were observed for hydrated H-USY and H-ZSM-5, in good...

Interpretation of catalytic performance during the MTH process is hampered by heat transport phenomena. We demonstrate that large temperature rises can occur during fixed bed labscale catalyst testing of ZSM-5, even when a large catalyst bed dilution is applied. Formation of mesopores in ZSM-5 leads to partial mitigation of these effects because of a lower generation of heat per unit catalyst v...

The catalytic fast pyrolysis (CFP) of bio-derived furans offers a promising approach for sustainable aromatic production. ZSM-5 modified by different metal species (Zn, Mo, Fe, and Ga) was employed in the CFP enhancing effects species, loadings, weight hourly space velocity (WHSV) on product distributions from 2-methylfuran (MF) were systemically investigated. It is found that introduction Zn, ...