ISSN:
0040-5744
Keywords:
Key words: Anharmonicity
;
Dynamics
;
Density functionals
;
Infrared
;
Structure
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Abstract. The hydrogen fluoride dimer (HF)2 is the most completely characterized hydrogen bonded species incorporating a donor molecule and an acceptor molecule. We provide a summary of experimental and theoretical information pertinent to the fundamental and harmonic vibrational frequencies, equilibrium geometry and dissociation energies D e and D 0 as well as a brief critical discussion including some new results on the potential function and current “best estimates” of experimental quantities.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF01113547
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