A density-functional theory study of the water-gas shift mechanism on pt/ceria(111)

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Department of Chemistry and the Chemical Physics Program, University of Puerto RiC, P.O. Box 23346, San Juan, 00931-3346, Puerto Rico [1 ]
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J. Phys. Chem. C | / 21卷 / 9239-9250期
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Bi-functional mechanisms - Defect-free surfaces - Density functional theory studies - Energy pathway - Morphological study - Oxygen deficiency - Oxygen storage capacity - Water gas shift (WGS) reaction;
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