A Comparative DFT Study on the Catalytic Oxidation of Nitric Oxide by Pd2 and PdM (M = Cu, Rh, Ag, Au, Pt)

A detailed mechanistic investigation for the catalytic oxidation of NO over monometallic palladium dimer and its bimetallic counterparts, PdM (M = Cu, Rh, Ag, Au, Pt) has been performed using DFT. Nitric oxide is a major environmental problem, inclusive of acid rain and photochemical smog formation...

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Veröffentlicht in:	Catalysis letters 2017-02, Vol.147 (2), p.581-591
Hauptverfasser:	Begum, Pakiza, Deka, Ramesh Chandra
Format:	Artikel
Sprache:	eng
Schlagworte:	Acid rain Bimetals Catalysis Catalysts Catalytic activity Catalytic oxidation Chemistry Chemistry and Materials Science Copper Dimers Gold Industrial Chemistry/Chemical Engineering Nanoparticles Nitric oxide Nitrogen dioxide Organometallic Chemistry Oxidation Palladium Photochemical smog Physical Chemistry Platinum Rhodium Silver Smog
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