Density functional characterization of the potential energy surface of the NO2 + Br reaction

Chemical Physics Letters

Volumn 413, Issue 1-3, 2005, Pages 36-41

  Kovacic S ^a   Lesar, A ^a   Hodoscek M ^a,b  

^a JO EF STEFAN INSTITUTE   (Slovenia)

^b NATIONAL INSTITUTE OF CHEMISTRY   (Slovenia)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ENERGY; BROMINE; CONFORMATIONS; ISOMERIZATION; NITROGEN OXIDES; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION;

HYPERVALENT STRUCTURE; POTENTIAL ENERGY SURFACE; RELATIVE ENERGY; TRANSITION STATE;

SURFACE PHENOMENA;

EID: 24344474504     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2005.07.058     Document Type: Article

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