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Journal of Chemical Physics

Volumn 116, Issue 14, 2002, Pages 6028-6038

Solvation of formic acid and proton transfer in hydrated clusters

(4) Wei, Dongqing a Truchon, Jean Francois a,b Sirois, Suzanne a Salahub, Dennis a,b,c

a Centre de Recherche en Calcul Applique (Canada)

b UNIVERSITÉ DE MONTRÉAL (Canada)

c NATIONAL RESEARCH COUNCIL CANADA (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; DIMERS; ENTHALPY; MOLECULAR STRUCTURE; ORGANIC ACIDS; PHASE TRANSITIONS; PROBABILITY DENSITY FUNCTION; PROTONS; WATER;

FORMIC ACIDS; GAUSSIAN IMPLEMENTATION; HYDRATED CLUSTER; HYDRATION ENERGY; KOHN-SHAM DENSITY FUNCTIONAL THEORY; PROTON TRANSFER; SOLVATION;

PHYSICAL CHEMISTRY;

EID: 0037041679 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1458543 Document Type: Article

Times cited : (57)

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