Rate constant for H-atom tunneling in the fluorene-acridine system based on DFT potential energy surface

Chemical Physics

Volumn 303, Issue 1-2, 2004, Pages 107-113

  Trakhtenberg, L I ^a   Fokeyev, A A ^a   Dolin, S P ^a   Mebel, A M ^b,c   Lin, S H ^c  

^a KARPOV INSTITUTE OF PHYSICAL CHEMISTRY   (Russian Federation)

^b FLORIDA INTERNATIONAL UNIVERSITY   (United States)

^c INSTITUTE OF ATOMIC AND MOLECULAR SCIENCES   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

ACRIDINE; FLUORENE; HYDROGEN; REAGENT;

AB INITIO CALCULATION; ARTICLE; ATOM; CHEMICAL REACTION; KINETICS; MATHEMATICAL ANALYSIS; OSCILLATION; PROTON TRANSPORT; QUANTUM CHEMISTRY; SOLID; TEMPERATURE DEPENDENCE; THEORETICAL MODEL; VIBRATION;

EID: 3042737835     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2004.04.014     Document Type: Article

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