The conversion of CO2 and CH4 to acetic acid over the Au-exchanged ZSM-5 catalyst: a density functional theory study.

Abstract

The direct conversion of methane and carbon dioxide to acetic acid is one of the most challenging research topics. Using the density functional theory (M06-L) the study reveals the catalytic activity of the Au(I)-ZSM-5 zeolite in this reaction. The Au(I)-ZSM-5 is represented by a 34T quantum cluster model. The activation of the C-H bond over the Au-ZSM-5… (More)
DOI: 10.1039/c2cp42066j

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@article{Panjan2012TheCO, title={The conversion of CO2 and CH4 to acetic acid over the Au-exchanged ZSM-5 catalyst: a density functional theory study.}, author={Wasinee Panjan and Jakkapan Sirijaraensre and Chompunuch Warakulwit and Piboon Pantu and Jumras Limtrakul}, journal={Physical chemistry chemical physics : PCCP}, year={2012}, volume={14 48}, pages={16588-94} }