articleScienceJan 23, 2025Closed access

Atomic locations and adsorbate interactions of Al single and pair sites in H-ZSM-5 zeolite

Hong Kong Polytechnic University · University of Oxford · +4 more institutions

PubMed
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Abstract

The distribution of substitutional aluminum (Al) atoms in zeolites affects molecular adsorbate geometry, catalytic activity, and shape and size selectivity. Accurately determining Al positions has been challenging. We used synchrotron resonant soft x-ray diffraction (RSXRD) at multiple energies near the Al K-edge combined with molecular adsorption techniques to precisely locate “single Al” and “Al pairs” in a commercial H-ZSM-5 zeolite. This analysis depicts three distinct Al tetrahedral (T) sites: T8, T6, and T4. A combined suite of characterizations, including ammonia temperature-dependent desorption, neutron powder diffraction, solid-state nuclear magnetic resonance spectroscopy, and density functional…

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