Study of the hydronium ion in water. A combined quantum chemical and statistical mechanical treatment

Journal of Molecular Structure: THEOCHEM

Volumn 712, Issue 1-3, 2004, Pages 167-173

  Hermida Ramón, Jose Manuel ^a,b   Karlström, Gunnar ^a  

^a LUND UNIVERSITY   (Sweden)

^b UNIVERSITY OF VIGO   (Spain)

Author keywords

Hydronium ion; Ions; Proton; QM MM method

Indexed keywords

ION; WATER;

ANALYTIC METHOD; ARTICLE; CALCULATION; CHEMICAL BOND; CONFORMATION; GAS ANALYSIS; HYDROGEN BOND; MOLECULE; QUANTUM CHEMISTRY; SOLVATION; STATISTICAL ANALYSIS; STRUCTURE ANALYSIS;

EID: 84961974187     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.10.017     Document Type: Article

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