Epoxidation of propylene on a [Ag 14O 9] cluster representing Ag 2O (001) surface: A density functional theory study

Catalysis Letters

Volumn 142, Issue 1, 2012, Pages 22-31

  Fellah, Mehmet Ferdi ^a,b   Onal, Isik ^b  

^a YUZUNCU YIL UNIVERSITY   (Turkey)

^b MIDDLE EAST TECHNICAL UNIVERSITY   (Turkey)

Author keywords

allyl; Basicity; DFT; Propylene epoxidation; Propylene oxide; Silver oxide

Indexed keywords

A-DENSITY; ACTIVATION BARRIERS; ADSORPTION CALCULATIONS; AG(111) SURFACE; ALLYL RADICALS; DENSITY FUNCTIONAL THEORY CALCULATIONS; DFT; EPOXIDATION OF PROPYLENE; ETHYLENE OXIDES; LEWIS BASICITY; OXYGEN ATOM; PARTIAL OXIDATIONS; POSITIVE EFFECTS; PROPANAL; PROPYLENE EPOXIDATION; PROPYLENE OXIDE; SPIN DENSITIES; SURFACE OXYGEN;

ACETONE; ADSORPTION; ALKALINITY; ATOMS; OXYGEN; SILVER OXIDES; SULFUR DIOXIDE;

PROPYLENE;

EID: 84856590352     PISSN: 1011372X     EISSN: 1572879X     Source Type: Journal    
DOI: 10.1007/s10562-011-0727-7     Document Type: Review

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