Double-proton transfer in the formamidine-formamide dimer. Post-Hartree-Fock gas-phase and aqueous solution study

Journal of Physical Chemistry A

Volumn 106, Issue 50, 2002, Pages 12103-12109

  Podolyan, Yevgeniy ^a   Gorb, Leonid ^a   Leszczynski, Jerzy ^a  

^a JACKSON STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

DIMERS; GIBBS FREE ENERGY; HYDROGEN BONDS; OPTIMIZATION; PROBABILITY DENSITY FUNCTION; PROTONS;

PROTON TRANSFER;

MOLECULAR DYNAMICS;

EID: 84961976157     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp021666d     Document Type: Article

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