Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen

We report high-resolution infrared absorption spectroscopic studies of the dopant-induced Q₁(0) vibron band in solid parahydrogen crystals doped with low concentrations of rare gas atoms. The frequency, lineshape, and integrated absorption coefficient for the rare gas atom-induced Q₁(0) vibron ban...

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Опубліковано в: :Физика низких температур
Дата:2007
Автори: Raston, P.L., Anderson, D.T.
Формат: Стаття
Мова:English
Опубліковано: Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України 2007
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Онлайн доступ:https://nasplib.isofts.kiev.ua/handle/123456789/121780
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Цитувати:Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen / P.L. Raston, D.T. Anderson // Физика низких температур. — 2007. — Т. 33, № 6-7. — С. 653-660. — Бібліогр.: 44 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine
id nasplib_isofts_kiev_ua-123456789-121780
record_format dspace
spelling Raston, P.L.
Anderson, D.T.
2017-06-16T07:29:35Z
2017-06-16T07:29:35Z
2007
Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen / P.L. Raston, D.T. Anderson // Физика низких температур. — 2007. — Т. 33, № 6-7. — С. 653-660. — Бібліогр.: 44 назв. — англ.
0132-6414
PACS: 33.20.Ea; 63.50.+x; 67.80.–s
https://nasplib.isofts.kiev.ua/handle/123456789/121780
We report high-resolution infrared absorption spectroscopic studies of the dopant-induced Q₁(0) vibron band in solid parahydrogen crystals doped with low concentrations of rare gas atoms. The frequency, lineshape, and integrated absorption coefficient for the rare gas atom-induced Q₁(0) vibron band are measured for Ne, Ar, Kr, and Xe. The observed lineshapes and peak maxima frequencies are sensitive to the H₂ vibrational dependence of the dopant-H₂ isotropic intermolecular potential. Trends observed for Ar, Kr and Xe indicate the vibrational dependence is strong enough for Xe to trap the infrared-active vibron in its first solvation shell while for Ar the vibron remains delocalized. The Ne-induced feature displays a qualitatively different lineshape which is attributed to the weak intramolecular vibrational dependence of the Ne–H₂ intermolecular potential relative to the H₂–H₂ interaction. The lineshapes of the Ar, Kr, and Xe dopant-induced Q₁(0) pure vibrational features agree well with recent first principles calculations.
This work was funded in part by a grant from the Petroleum Research Fund, administered by the American Chemical Society, an award from the Research Corporation, and by a grant from the Chemistry Division of the National Science Foundation (Grant No. CHE-0316268). The authors would like to thank Dr. M.E. Fajardo for making his IR spectral data available to us and acknowledge helpful discussions throughout the course of this work with Prof. R.J. Hinde.
en
Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України
Физика низких температур
Quantum Crystals
Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
Article
published earlier
institution Digital Library of Periodicals of National Academy of Sciences of Ukraine
collection DSpace DC
title Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
spellingShingle Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
Raston, P.L.
Anderson, D.T.
Quantum Crystals
title_short Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
title_full Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
title_fullStr Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
title_full_unstemmed Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
title_sort infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen
author Raston, P.L.
Anderson, D.T.
author_facet Raston, P.L.
Anderson, D.T.
topic Quantum Crystals
topic_facet Quantum Crystals
publishDate 2007
language English
container_title Физика низких температур
publisher Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України
format Article
description We report high-resolution infrared absorption spectroscopic studies of the dopant-induced Q₁(0) vibron band in solid parahydrogen crystals doped with low concentrations of rare gas atoms. The frequency, lineshape, and integrated absorption coefficient for the rare gas atom-induced Q₁(0) vibron band are measured for Ne, Ar, Kr, and Xe. The observed lineshapes and peak maxima frequencies are sensitive to the H₂ vibrational dependence of the dopant-H₂ isotropic intermolecular potential. Trends observed for Ar, Kr and Xe indicate the vibrational dependence is strong enough for Xe to trap the infrared-active vibron in its first solvation shell while for Ar the vibron remains delocalized. The Ne-induced feature displays a qualitatively different lineshape which is attributed to the weak intramolecular vibrational dependence of the Ne–H₂ intermolecular potential relative to the H₂–H₂ interaction. The lineshapes of the Ar, Kr, and Xe dopant-induced Q₁(0) pure vibrational features agree well with recent first principles calculations.
issn 0132-6414
url https://nasplib.isofts.kiev.ua/handle/123456789/121780
citation_txt Infrared-active vibron bands associated with rare gas atom dopants isolated in solid parahydrogen / P.L. Raston, D.T. Anderson // Физика низких температур. — 2007. — Т. 33, № 6-7. — С. 653-660. — Бібліогр.: 44 назв. — англ.
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