Higher hydrogen uptake capacity of C2H4Ti+ than C2H4Ti: A quantum chemical study

Theoretical Chemistry Accounts

Volumn 127, Issue 4, 2010, Pages 285-292

  Wadnerkar, Nitin ^a   Kalamse, Vijayanand ^a   Chaudhari, Ajay ^a  

^a SWAMI RAMANAND TEERTH MARATHWADA UNIVERSITY   (India)

Author keywords

Adsorption energy; Density functional theory; Hydrogen storage; Organometallic complexes and cation

Indexed keywords

EID: 77957937876     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-009-0714-x     Document Type: Article

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