Silver-Promoted Dehydroaromatization of Ethylene over ZSM-5 Catalysts

Hsieh, Ming‐Feng; Zhou, Yunwen; Thirumalai, Hari; Grabow, Lars C.; Rimer, Jeffrey D.

doi:10.1002/cctc.201700192

Silver-Promoted Dehydroaromatization of Ethylene over ZSM-5 Catalysts

Journal Article · Thu Feb 16 00:00:00 EST 2017 · ChemCatChem

DOI:https://doi.org/10.1002/cctc.201700192· OSTI ID:1543477

Hsieh, Ming‐Feng ^[1]; Zhou, Yunwen ^[1]; Thirumalai, Hari ^[1]; ^[1]; ^[1]

University of Houston, Houston, TX (United States). Dept. of Chemical and Biomolecular Engineering

The shape selectivity of ZSM-5 (MFI type) catalysts is ideal for the production of C₆–C₈ aromatics. Developing high-performance zeolite catalysts with improved selectivity to aromatics, particularly from diversified (non-petroleum) feedstocks, has broad commercial appeal. Non-oxidative coupling (NOC) of ethylene was examined over Ag-ZSM-5 catalysts at 400 °C and shows that Ag⁺ sites promote dehydroaromatization with enhanced selectivity to toluene and xylenes. Metal exchange of H-ZSM-5 results in Ag zoning wherein Ag⁺ site density is higher on the exterior of ZSM-5 particles. Catalyst performance was characterized with varying Ag loading as well as the use of methane co-feed. Aromatic selectivity is about 60 % on Ag-ZSM-5 compared to 20 % on H-ZSM-5, which is qualitatively consistent with density functional theory (DFT) showing that ethylene forms strong complexes with Ag⁺ (Lewis acid) sites. DFT calculations also reveal that ethylene activation on H⁺ (Brønsted acid) sites is more energetically favorable, and likely constitutes the first mechanistic step in ethylene-to-liquids (ETL) reactions. Ag-ZSM-5 is thus identified as an effective catalyst for low-temperature ETL reactions that has the potential to outperform conventional metal-exchanged zeolites.

View Accepted Manuscript (DOE)

Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC); Univ. of California, Oakland, CA (United States)

Sponsoring Organization:: USDOE; USDOE Office of Science (SC)

Grant/Contract Number:: AC02-05CH11231

OSTI ID:: 1543477

Alternate ID(s):: OSTI ID: 1401762

Journal Information:: ChemCatChem, Journal Name: ChemCatChem Journal Issue: 9 Vol. 9; ISSN 1867-3880

Publisher:: ChemPubSoc EuropeCopyright Statement

Country of Publication:: United States

Language:: English

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