Effect of resonance dipole-dipole interaction on spectra of adsorbed SF6 molecules.

A.N. Dobrotvorskaia, T.D. Kolomiitsova, S.N. Petrov, D.N. Shchepkin, K.S. Smirnov, A.A. Tsyganenko

Результат исследований: Научные публикации в периодических изданияхстатья

6 Цитирования (Scopus)

Выдержка

© 2015 Elsevier B.V. All rights reserved.Abstract Adsorption of SF6 on zinc oxide and on silicalite-1 was investigated by a combination of IR spectroscopy with the calculations of spectra by means of a modernized model, developed previously for liquids. Comparison of the experimental spectra and the results of modeling shows that the complex band shapes in spectra of adsorbed molecules with extremely high absorbance are due to the strong resonance dipole-dipole interaction (RDDI) rather that the surface heterogeneity or the presence of specific surface sites. Perfect agreement between calculated and observed spectra was found for ZnO, while some dissimilarity in band intensities for silicalite-1 was attributed to complicated geometry of molecular arrangement in the channels.
Язык оригиналаанглийский
Страницы (с-по)271-279
Число страниц9
ЖурналSpectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy
Том148
Номер выпуска271–279
DOI
СостояниеОпубликовано - 2015

Отпечаток

dipoles
Zinc Oxide
Molecules
Zinc oxide
molecules
Infrared spectroscopy
interactions
Adsorption
Geometry
Liquids
zinc oxides
adsorption
liquids
geometry
spectroscopy

Цитировать

Dobrotvorskaia, A.N. ; Kolomiitsova, T.D. ; Petrov, S.N. ; Shchepkin, D.N. ; Smirnov, K.S. ; Tsyganenko, A.A. / Effect of resonance dipole-dipole interaction on spectra of adsorbed SF6 molecules. В: Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy. 2015 ; Том 148, № 271–279. стр. 271-279.
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abstract = "{\circledC} 2015 Elsevier B.V. All rights reserved.Abstract Adsorption of SF6 on zinc oxide and on silicalite-1 was investigated by a combination of IR spectroscopy with the calculations of spectra by means of a modernized model, developed previously for liquids. Comparison of the experimental spectra and the results of modeling shows that the complex band shapes in spectra of adsorbed molecules with extremely high absorbance are due to the strong resonance dipole-dipole interaction (RDDI) rather that the surface heterogeneity or the presence of specific surface sites. Perfect agreement between calculated and observed spectra was found for ZnO, while some dissimilarity in band intensities for silicalite-1 was attributed to complicated geometry of molecular arrangement in the channels.",
author = "A.N. Dobrotvorskaia and T.D. Kolomiitsova and S.N. Petrov and D.N. Shchepkin and K.S. Smirnov and A.A. Tsyganenko",
year = "2015",
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Effect of resonance dipole-dipole interaction on spectra of adsorbed SF6 molecules. / Dobrotvorskaia, A.N.; Kolomiitsova, T.D.; Petrov, S.N.; Shchepkin, D.N.; Smirnov, K.S.; Tsyganenko, A.A.

В: Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, Том 148, № 271–279, 2015, стр. 271-279.

Результат исследований: Научные публикации в периодических изданияхстатья

TY - JOUR

T1 - Effect of resonance dipole-dipole interaction on spectra of adsorbed SF6 molecules.

AU - Dobrotvorskaia, A.N.

AU - Kolomiitsova, T.D.

AU - Petrov, S.N.

AU - Shchepkin, D.N.

AU - Smirnov, K.S.

AU - Tsyganenko, A.A.

PY - 2015

Y1 - 2015

N2 - © 2015 Elsevier B.V. All rights reserved.Abstract Adsorption of SF6 on zinc oxide and on silicalite-1 was investigated by a combination of IR spectroscopy with the calculations of spectra by means of a modernized model, developed previously for liquids. Comparison of the experimental spectra and the results of modeling shows that the complex band shapes in spectra of adsorbed molecules with extremely high absorbance are due to the strong resonance dipole-dipole interaction (RDDI) rather that the surface heterogeneity or the presence of specific surface sites. Perfect agreement between calculated and observed spectra was found for ZnO, while some dissimilarity in band intensities for silicalite-1 was attributed to complicated geometry of molecular arrangement in the channels.

AB - © 2015 Elsevier B.V. All rights reserved.Abstract Adsorption of SF6 on zinc oxide and on silicalite-1 was investigated by a combination of IR spectroscopy with the calculations of spectra by means of a modernized model, developed previously for liquids. Comparison of the experimental spectra and the results of modeling shows that the complex band shapes in spectra of adsorbed molecules with extremely high absorbance are due to the strong resonance dipole-dipole interaction (RDDI) rather that the surface heterogeneity or the presence of specific surface sites. Perfect agreement between calculated and observed spectra was found for ZnO, while some dissimilarity in band intensities for silicalite-1 was attributed to complicated geometry of molecular arrangement in the channels.

U2 - 10.1016/j.saa.2015.04.002

DO - 10.1016/j.saa.2015.04.002

M3 - Article

VL - 148

SP - 271

EP - 279

JO - SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

JF - SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

SN - 1386-1425

IS - 271–279

ER -