Abstract
In this study we examine the influence of the chemical composition (aluminum content) on structure and proton affinity of zeolite models using first principle density functional procedures. It is shown that changes in the zeolite's aluminum content have a very significant effect on the proton affinity of neighboring protons, making low aluminum zeolites more acidic than high aluminum zeolites. The proton location is also studied.
Sign-in/Register to access full text options 
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callDisclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
