Microsolvation effect on chemical reactivity: The case of the Cl-+CH3Br SN2 reaction

Journal of Chemical Physics

Volumn 114, Issue 9, 2001, Pages 4089-4098

  Raugei, Simone ^a,b   Cardini, Gianni ^a,b   Schettino, Vincenzo ^a,b  

^a UNIVERSITY OF FLORENCE   (Italy)

^b UNIVERSITY OF FLORENCE   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; COMPUTATIONAL METHODS; COMPUTER SIMULATION; ELECTRONIC STRUCTURE; HYDROGEN BONDS; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; THERMAL EFFECTS; WATER;

DENSITY FUNCTIONAL THEORY; MICROSOLVATION EFFECTS;

REACTION KINETICS;

EID: 0035280645     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1348023     Document Type: Article

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