Ab initio characterization of Ti decorated SWCNT for hydrogen storage

Faculty Science Year: 2013
Type of Publication: ZU Hosted Pages: 140-152
Authors:
Journal: International Journal of Hydrogen Energy elsevier Volume: 1
Keywords : , initio characterization , , decorated SWCNT , hydrogen storage    
Abstract:
Characterization has been performed on basis of several physicochemical parameters. The results indicate that the preferential adsorption is on Ti atom deposited on the top site of the (5,5) armchair SWCNT with energies (0.44 and 0.71)
   
     
 
       

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