The oxidation pathways of Ti+ by acetaldehyde in the gas phase: A density functional theory investigation

Chemical Physics Letters

Volumn 431, Issue 1-3, 2006, Pages 56-61

  Zhao, Lianming ^a   Zhang, Rongrong ^a   Guo, Wenyue ^a   Lu, Xiaoqing ^a  

^a CHINA UNIVERSITY OF PETROLEUM   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ALDEHYDES; COMPLEXATION; GEOMETRY; OXIDATION; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; REACTION KINETICS;

GROUND STATE REACTANTS; INTERSYSTEM CROSSING; QUARTET ROUTES; REACTANT ENERGIES;

TITANIUM COMPOUNDS;

EID: 33750321212     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2006.09.079     Document Type: Article

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