Understanding the Reaction Mechanism of Glycerol Hydrogenolysis over a CuCr2 O4 Catalyst.
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DOI: 10.1002/cssc.201601269
Abstract: The reaction mechanism of glycerol hydrogenolysis to 1,2-propanediol over a spinel CuCr2 O4 catalyst was investigated by using DFT calculations. Theoretical models were developed from the results of experimental characterization. Adsorption configurations and energetics of… read more here.
Keywords: cucr2; surface; glycerol hydrogenolysis; reaction ... See more keywords