DFT calculations of the CO adsorption on Mn, Fe, Co, and Au deposited at MgO (100) and CdO (100)

Faculty Science Year: 2012
Type of Publication: ZU Hosted Pages: 9876– 9890
Authors:
Wael Salah AbdelHalim
Journal: Applied Surface Science elsevier Volume: 24
Keywords : , calculations , , , adsorption , , , , , , deposited , , (100) , , (100)    
Abstract:
Density functional calculations and the embedded cluster model have been utilized to examine the adsorption properties of CO molecules adsorbed on Mn, Fe, Co, and Au atoms deposited on O2−, F, and F+ sites of MgO and CdO terrace surfaces. T
    
     
 
       

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