Structural and spectral properties of aqueous hydrogen fluoride studied using ab initio molecular dynamics

Journal of Physical Chemistry B

Volumn 106, Issue 43, 2002, Pages 11315-11322

  Sillanpää, Atte J ^a   Simon, Christian ^b   Klein, Michael L ^b   Laasonen, Kari ^a  

^a UNIVERSITY OF OULU   (Finland)

^b UNIVERSITY OF PENNSYLVANIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ACIDITY; CHEMICAL BONDS; COMPUTER SIMULATION; CONCENTRATION (PROCESS); COORDINATION REACTIONS; DISSOCIATION; MOLECULAR DYNAMICS; MOLECULAR SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; PROTONS; SOLUTIONS;

INTERMOLECULAR FORCES;

HYDROFLUORIC ACID;

EID: 0037206795     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0260088     Document Type: Article

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