Catalyst design to direct high-octane gasoline fuel properties for improved engine efficiency

Connor P. Nash, Daniel P. Dupuis, Anurag Kumar, Carrie A. Farberow, Anh T. To, Ce Yang, Evan C. Wegener, Jeffrey T. Miller, Kinga A. Unocic, Earl Christensen, Jesse E. Hensley, Joshua A. Schaidle, Susan E. Habas, Daniel A. Ruddy

Research output: Contribution to journalArticlepeer-review

8 Scopus citations

Abstract

The paraffin-to-olefin (P/O) ratio in gasoline fuel is a critical metric affecting fuel properties and engine efficiency. In the conversion of dimethyl ether (DME) to high-octane hydrocarbons over BEA zeolite catalysts, the P/O ratio can be controlled through catalyst design. Here, we report bimetallic catalysts that balance the net hydrogenation and dehydrogenation activity during DME homologation. The Cu-Zn/BEA catalyst exhibited greater relative dehydrogenation activity attributed to higher ionic site density, resulting in a lower P/O ratio (6.6) versus the benchmark Cu/BEA (9.4). The Cu-Ni/BEA catalyst exhibited increased hydrogenation due to reduced Ni species, resulting in a higher P/O ratio (19). The product fuel properties were estimated with an efficiency merit function and compared against finished gasolines and a typical alkylate blendstock. Merit values for the hydrocarbon product from all three BEA catalysts exceeded those of the comparison fuels (0–5.3), with the product from Cu-Zn/BEA exhibiting the highest merit value (9.7).

Original languageEnglish
Article number120801
JournalApplied Catalysis B: Environmental
Volume301
DOIs
StatePublished - Feb 2022

Funding

This work was authored in part by the National Renewable Energy Laboratory, operated by Alliance for Sustainable Energy, LLC, in part by Argonne National Laboratory, operated by The University of Chicago, and in part by Oak Ridge National Laboratory, operated by UT-Battelle, LLC, for the U.S. Department of Energy ( DOE ) under Contract Nos. DE-AC36-08GO28308 , DE-AC02-06CH11357 , and DE-AC05-00OR22725 , respectively. Funding provided by the U.S. DOE Office of Energy Efficiency and Renewable Energy Bioenergy Technologies Office in collaboration with the Chemical Catalysis for Bioenergy (ChemCatBio) Consortium, a member of the Energy Materials Network (EMN). ECW and JTM were supported in part by the National Science Foundation under Cooperative Agreement No. EEC–1647722. This research used resources of the Advanced Photon Source, a U.S. DOE Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract DE-AC02-06CH11357. MRCAT operations are supported by the Department of Energy and the MRCAT member institutions. The microscopy was performed as part of a user project at the Center for Nanophase Materials Sciences (CNMS), which is a U.S. DOE Office of Science User Facility. The views expressed in this article do not necessarily represent the views of the DOE or the U.S. Government. The U.S. Government retains and the publisher, by accepting the article for publication, acknowledges that the U.S. Government retains a nonexclusive, paid-up, irrevocable, worldwide license to publish or reproduce the published form of this work, or allow others to do so, for U.S. Government purposes. This work was authored in part by the National Renewable Energy Laboratory, operated by Alliance for Sustainable Energy, LLC, in part by Argonne National Laboratory, operated by The University of Chicago, and in part by Oak Ridge National Laboratory, operated by UT-Battelle, LLC, for the U.S. Department of Energy (DOE) under Contract Nos. DE-AC36-08GO28308, DE-AC02-06CH11357, and DE-AC05-00OR22725, respectively. Funding provided by the U.S. DOE Office of Energy Efficiency and Renewable Energy Bioenergy Technologies Office in collaboration with the Chemical Catalysis for Bioenergy (ChemCatBio) Consortium, a member of the Energy Materials Network (EMN). ECW and JTM were supported in part by the National Science Foundation under Cooperative Agreement No. EEC–1647722. This research used resources of the Advanced Photon Source, a U.S. DOE Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract DE-AC02-06CH11357. MRCAT operations are supported by the Department of Energy and the MRCAT member institutions. The microscopy was performed as part of a user project at the Center for Nanophase Materials Sciences (CNMS), which is a U.S. DOE Office of Science User Facility. The views expressed in this article do not necessarily represent the views of the DOE or the U.S. Government. The U.S. Government retains and the publisher, by accepting the article for publication, acknowledges that the U.S. Government retains a nonexclusive, paid-up, irrevocable, worldwide license to publish or reproduce the published form of this work, or allow others to do so, for U.S. Government purposes.

FundersFunder number
Chemical Catalysis for Bioenergy
Energy Materials Network
U.S. DOE Office of Energy Efficiency and Renewable Energy Bioenergy Technologies Office
U.S. Government
National Science FoundationEEC–1647722
U.S. Department of EnergyDE-AC05-00OR22725, DE-AC02-06CH11357, DE-AC36-08GO28308
Office of Science
Argonne National Laboratory
Oak Ridge National Laboratory
National Renewable Energy Laboratory
University of Chicago

    Keywords

    • Cu/BEA zeolite
    • Dehydrogenation
    • Engine efficiency
    • High octane gasoline
    • Paraffin/olefin ratio

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