Publisher: American Chemical Society (ACS)

Issue: 1

License: [{"start"=>{"date-parts"=>[[2022, 11, 1]], "date-time"=>"2022-11-01T00:00:00Z", "timestamp"=>1667260800000}, "content-version"=>"vor", "delay-in-days"=>0, "URL"=>"https://creativecommons.org/licenses/by/4.0/"}]

Publication date(s): 2023/01/25 (print) 2022/11/01 (online)

Pages: 74-83

Volume: 3 Issue: 1

Journal: ACS Physical Chemistry Au

Link: [{"URL"=>"https://pubs.acs.org/doi/pdf/10.1021/acsphyschemau.2c00040", "content-type"=>"application/pdf", "content-version"=>"vor", "intended-application"=>"unspecified"}, {"URL"=>"https://pubs.acs.org/doi/pdf/10.1021/acsphyschemau.2c00040", "content-type"=>"unspecified", "content-version"=>"vor", "intended-application"=>"similarity-checking"}]

URL: http://dx.doi.org/10.1021/acsphyschemau.2c00040

This work investigates the acid sites in a commercial ZSM-5 zeolite catalyst by a combination of spectroscopic and physical methods. The Brønsted acid sites in such catalysts are associated with the aluminum substituted into the zeolite lattice, which may not be identical to the total aluminum content of the zeolite. Inelastic neutron scattering spectroscopy (INS) directly quantifies the concentrations of Brønsted acid protons, silanol groups, and hydroxyl groups associated with extra-framework aluminum species. The INS measurements show that ∼50% of the total aluminum content of this particular zeolite is extra framework, a conclusion supported by solid-state NMR and ammonia temperature-programmed desorption (TPD) measurements. Evidence for the presence of extra-framework aluminum oxide species is also seen in neutron powder diffraction data from proton- and deuterium-exchanged samples. The differences between results from the different analytical methods are discussed, and the novelty of direct proton counting by INS in this typical commercial catalyst is emphasized.