Theoretical study of the Ti+(NO,O2) → TiO + (N,O) reactions

Journal of Chemical Physics

Volumn 117, Issue 18, 2002, Pages 8385-8390

  Kim, Kyoung Hoon ^a   Lee, Yoon Sup ^a   Moon, Jung Ho ^b   Kim, Yoonho ^b   Jeung, Gwang Hi ^c  

^a Korea Advanced Institute of Science and Technology (KAIST)   (South Korea)

^b Korea Institute of Science and Technology   (South Korea)

^c Institut de Chimie Biologique   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; CALCULATIONS; CHEMICAL ACTIVATION; INTERFACIAL ENERGY; ISOMERS; MOLECULAR DYNAMICS; NITROGEN OXIDES; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; TITANIUM;

ACTIVATION BARRIERS; CONFIGURATION INTERACTION CALCULATIONS; EXOERGIC REACTION; INTERMOLECULAR DISTANCES;

REACTION KINETICS;

EID: 0037044969     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1510119     Document Type: Article

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