Literature DB >> 23685848

Catalytic oxidation of CO by N2O conducted via the neutral oxide cluster couple VO2/VO3.

Zhe-Chen Wang1, Shi Yin, Elliot R Bernstein.   

Abstract

Neutral vanadium and cobalt oxide clusters are generated at the same time employing a V-Co mixed target. Experimental results indicate that the reaction VO2 + N2OVO3 + N2 occurs in a fast flow reactor. This interpretation is further supported for a gas mixture of CO and N2O in the flow cell: regeneration of VO2 is observed for this case via the reaction VO3 + COVO2 + CO2. A full catalytic cycle for the reaction N2O + CO → N2 + CO2 is thus complete at room temperature enabled by the VO2/VO3 cluster couple. DFT calculations demonstrate that the entire catalytic process is overall barrierless and reproduce the experimental results quite well.

Entities:  

Year:  2013        PMID: 23685848     DOI: 10.1039/c3cp51368h

Source DB:  PubMed          Journal:  Phys Chem Chem Phys        ISSN: 1463-9076            Impact factor:   3.676


  1 in total

1.  Understanding structure-activity relation in VxOy clusters of varied stoichiometry and sizes through conceptual density functional approach.

Authors:  Navjot Kaur; Shuchi Gupta; Neetu Goel
Journal:  J Mol Model       Date:  2019-10-09       Impact factor: 1.810

  1 in total

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