Propanol Clustering in Argon Matrix: 2D FTIR Correlation Spectroscopy

V. Balevicius; V. Sablinskas; I. Doroshenko; V.  Pogorelov

doi:10.15407/ujpe56.8.855

Propanol Clustering in Argon Matrix: 2D FTIR Correlation Spectroscopy

Authors

V. Balevicius Vilnius University
V. Sablinskas Vilnius University
I. Doroshenko Taras Shevchenko National University of Kyiv
V. Pogorelov Taras Shevchenko National University of Kyiv

DOI:

https://doi.org/10.15407/ujpe56.8.855

Keywords:

Abstract

The dynamic FTIR spectra of propanol in the argon matrix have been measured using a thermal perturbation by heating the sample from T = 11 K to 30 K stepping by 1 K. The 2D Fourier-transform infrared (FTIR) absorption correlation analysis has been carried out, the main attention being concentrated to the region of propanol O–H stretching vibrations at 3000–3700 cm^–1. The peaks of monomers, two conformers of open dimer, and the cyclic structures from a dimer to a pentamer have been resolved and studied in more details. Analyzing the dependences of the integral band intensities of various aggregates on the temperature, it has been deduced that monomers and dimers act in the initial clustering stage as the main "building units" whose diffusion sustains the formation of the higher H-bond structures in the matrix. The full width at half height (FWHH) for each band has been processed as a
function of the aggregation number (n). It is found that the FHWW is a perfectly linear function of n for all cyclic aggregates n ≥ 2. The resonance broadening has been proposed to be the most reliable mechanism for the formation of diffuse O–H stretching bands in the matrix isolated clusters.

References

Atomic and Molecular Cluster Research, edited by Y.L. Ping (Nova Science, New York, 2006).

P.G. Reinhard and E. Suraud, Introduction to Cluster Dynamics (Wiley-VCH, Weinheim, 2004).

https://doi.org/10.1002/9783527602520

Nanoparticles: from Theory to Application, edited by G. Schmid (Wiley-VCH, Weinheim, 2004).

N. Michniewicz, A.S. Muszynski, W. Wrzeszcz et al., J. Mol. Struct. 887, 180 (2008).

https://doi.org/10.1016/j.molstruc.2008.03.020

Z. Mielke, S. Coussan, K. Mierzwicki et al., J. Phys. Chem. A 110, 4712 (2006).

https://doi.org/10.1021/jp057300t

R. Wugt Larsen and M.A. Suhm, J. Chem. Phys. 125, 15314 (2006).

https://doi.org/10.1063/1.2358349

T.N. Wassermann, P. Zielke, J.J. Lee, C. Cezard, and M.A. Suhm, J. Phys. Chem. A 111, 7437 (2007).

https://doi.org/10.1021/jp071008z

C. Emmeluth, V. Dyczmons, T. Kinzel, P. Botschwina, M.A. Suhm, and M. Yanez, Phys. Chem. Chem. Phys. 7, 991 (2005).

https://doi.org/10.1039/B417870J

M. Behrens, R. Frochtenicht, M. Hartmann, J.G. Siebers, U. Buck, and F. Hagemeister, J. Chem. Phys. 111, 2436 (1999).

https://doi.org/10.1063/1.479521

R.A. Provencal, J.B. Paul, K. Roth et al., J. Chem. Phys. 110, 4258 (1999).

https://doi.org/10.1063/1.478309

S. Coussan, V. Brenner, J.P. Perchard, and W.Q. Zheng, J. Chem. Phys. 113, 8059 (2000).

https://doi.org/10.1063/1.1316002

S. Coussan, Y. Bouteiller, A. Loutellier et al., Chem. Phys. 219, 221 (1997).

https://doi.org/10.1016/S0301-0104(97)00108-0

V. Pogorelov, L. Bulavin, I. Doroshenko, O. Fesjun, and O. Veretennikov, J. Mol. Struct. 708, 61 (2004).

https://doi.org/10.1016/j.molstruc.2004.03.003

V. Pogorelov, I. Doroshenko, P. Uvdal, V. Balevicius, and V. Sablinskas, Mol. Phys. 108, 2165 (2010).

https://doi.org/10.1080/00268976.2010.494629

K. Gaffney, P. Davis, I. Piletic, N.E. Levinger, and M.D. Fayer, J. Phys. Chem. A 106, 12012 (2002).

https://doi.org/10.1021/jp021696g

K. Gaffney, I. Piletic, and M.D. Fayer, J. Phys. Chem. A 106, 9428 (2002).

https://doi.org/10.1021/jp021170w

I. Noda and Y. Ozaki, Two-Dimensional Correlation Spectroscopy: Applications in Vibrational and Optical Spectroscopy (Wiley, Chichester, 2004).

https://doi.org/10.1002/0470012404

I. Noda, Appl. Spectrosc. 54, 994 (2000).

https://doi.org/10.1366/0003702001950472

I. Noda, Appl. Spectrosc. 47, 1329 (1993).

https://doi.org/10.1366/0003702934067694

J. Grdadolnik, private communication.

A.B. Pipard, The Physics of Vibration. The Simple Vibrator in Quantum Mechanics (Cambridge Univ. Press, Cambridge, 1983).

Downloads

Published

2022-02-09

How to Cite

Balevicius, V., Sablinskas, V., Doroshenko, I., & Pogorelov, V. . (2022). Propanol Clustering in Argon Matrix: 2D FTIR Correlation Spectroscopy. Ukrainian Journal of Physics, 56(8), 855. https://doi.org/10.15407/ujpe56.8.855

Download Citation

Issue

Vol. 56 No. 8 (2011)

Section

General problems of theoretical physics

License

Copyright Agreement
License to Publish the Paper
Kyiv, Ukraine

The corresponding author and the co-authors (hereon referred to as the Author(s)) of the paper being submitted to the Ukrainian Journal of Physics (hereon referred to as the Paper) from one side and the Bogolyubov Institute for Theoretical Physics, National Academy of Sciences of Ukraine, represented by its Director (hereon referred to as the Publisher) from the other side have come to the following Agreement:

1. Subject of the Agreement.
The Author(s) grant(s) the Publisher the free non-exclusive right to use the Paper (of scientific, technical, or any other content) according to the terms and conditions defined by this Agreement.

2. The ways of using the Paper.
2.1. The Author(s) grant(s) the Publisher the right to use the Paper as follows.
2.1.1. To publish the Paper in the Ukrainian Journal of Physics (hereon referred to as the Journal) in original language and translated into English (the copy of the Paper approved by the Author(s) and the Publisher and accepted for publication is a constitutive part of this License Agreement).
2.1.2. To edit, adapt, and correct the Paper by approval of the Author(s).
2.1.3. To translate the Paper in the case when the Paper is written in a language different from that adopted in the Journal.
2.2. If the Author(s) has(ve) an intent to use the Paper in any other way, e.g., to publish the translated version of the Paper (except for the case defined by Section 2.1.3 of this Agreement), to post the full Paper or any its part on the web, to publish the Paper in any other editions, to include the Paper or any its part in other collections, anthologies, encyclopaedias, etc., the Author(s) should get a written permission from the Publisher.

3. License territory.
The Author(s) grant(s) the Publisher the right to use the Paper as regulated by sections 2.1.1–2.1.3 of this Agreement on the territory of Ukraine and to distribute the Paper as indispensable part of the Journal on the territory of Ukraine and other countries by means of subscription, sales, and free transfer to a third party.

4. Duration.
4.1. This Agreement is valid starting from the date of signature and acts for the entire period of the existence of the Journal.

5. Loyalty.
5.1. The Author(s) warrant(s) the Publisher that:
– he/she is the true author (co-author) of the Paper;
– copyright on the Paper was not transferred to any other party;
– the Paper has never been published before and will not be published in any other media before it is published by the Publisher (see also section 2.2);
– the Author(s) do(es) not violate any intellectual property right of other parties. If the Paper includes some materials of other parties, except for citations whose length is regulated by the scientific, informational, or critical character of the Paper, the use of such materials is in compliance with the regulations of the international law and the law of Ukraine.

6. Requisites and signatures of the Parties.
Publisher: Bogolyubov Institute for Theoretical Physics, National Academy of Sciences of Ukraine.
Address: Ukraine, Kyiv, Metrolohichna Str. 14-b.
Author: Electronic signature on behalf and with endorsement of all co-authors.