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J Phys Chem A. 2008 May 1;112(17):3921-6. doi: 10.1021/jp711178w. Epub 2008 Mar 19.

Far-infrared band strengths in the water dimer: experiments and calculations.

Author information

1
Chemical Physics, P.O. Box 124 and MAX- lab, P.O. Box 118, Lund University, SE-22100 Lund, Sweden.

Abstract

Most fundamentals modes of the water dimer have been experimentally determined, and the frequencies have been measured in either neon or parahydrogen matrices. The band strengths of all intramolecular and most intermolecular fundamentals of the water dimer have been measured. The results are further corroborated by comparison with the corresponding data for the fully deuterated water dimer. DFT calculations of the mode frequencies and band strength are in qualitative agreement with the experimental observations.

PMID:
18348553
DOI:
10.1021/jp711178w

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