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Far-Infrared Band Strengths in the Water Dimer: Experiments and Calculations.

Ceponkus, Justinas; Uvdal, Per LU and Nelander, Bengt LU (2008) In The journal of physical chemistry. A 112(17). p.3921-3926
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.
Please use this url to cite or link to this publication:
author
organization
publishing date
type
Contribution to journal
publication status
published
subject
in
The journal of physical chemistry. A
volume
112
issue
17
pages
3921 - 3926
publisher
The American Chemical Society
external identifiers
  • pmid:18348553
  • wos:000255292200017
  • scopus:47049120752
ISSN
1520-5215
DOI
10.1021/jp711178w
language
English
LU publication?
yes
id
80cd8e89-7922-436a-bb02-4512697d3308 (old id 1052373)
date added to LUP
2008-05-09 10:45:46
date last changed
2017-08-27 04:51:50
@article{80cd8e89-7922-436a-bb02-4512697d3308,
  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.},
  author       = {Ceponkus, Justinas and Uvdal, Per and Nelander, Bengt},
  issn         = {1520-5215},
  language     = {eng},
  number       = {17},
  pages        = {3921--3926},
  publisher    = {The American Chemical Society},
  series       = {The journal of physical chemistry. A},
  title        = {Far-Infrared Band Strengths in the Water Dimer: Experiments and Calculations.},
  url          = {http://dx.doi.org/10.1021/jp711178w},
  volume       = {112},
  year         = {2008},
}