Computer study of the spectral characteristics of the disperse water–methane system

doi:10.1088/1674-1056/22/12/123602

Abstract The interaction of water clusters that adsorbed methane molecules with infrared radiation is studied by molecular dynamics. The presence of methane molecules in the disperse water system leads to an increase in absorption and emission of infrared radiation and a strong depletion of the Raman spectrum. In this case, the reflection coefficient of a monochromatic plane electromagnetic wave increases and its frequency spectrum significantly changes. The comparison of experimental data for similar characteristics of water, methane, or their mixtures is presented.

Keywords: adsorption methane water cluster infrared and Raman spectra

Received: 01 April 2013
Revised: 06 May 2013
Accepted manuscript online:

PACS:	36.40.Mr	(Spectroscopy and geometrical structure of clusters)
	36.20.Ng	(Vibrational and rotational structure, infrared and Raman spectra)
	92.70.Cp	(Atmosphere)
	92.70.Er	(Biogeochemical processes)

Corresponding Authors: A. Y. Galashev
E-mail: galashev@ecko.uran.ru

Cite this article:

A. Y. Galashev Computer study of the spectral characteristics of the disperse water–methane system 2013 Chin. Phys. B 22 123602

[1]	Boudon V, Rey M and Loete M 2006 J. Quantum Spectrosc. Radiat. Transfer 98 394
[2]	Roush T L 2001 J. Geophys. Res. 106 33315
[3]	Bernstein M P, Cruikshank D P and Sandford S A 2006 Icarus 181 302
[4]	Hudgins D M, Sandford S A, Allamandola L J and Tielens A G G M 1993 Astrophys. J., Suppl. Ser. 86 713
[5]	Laaksonen A and Stilbs P 1991 Mol. Phys. 74 747
[6]	Chandler D 2002 Nature 417 491
[7]	Chau P L and Mancera R L 1999 Mol. Phys. 96 109
[8]	Lambeth B P Jr, Junghans C, Kremer K, Clementi C and Delle Site L 2010 J. Chem. Phys. 133 221101
[9]	Galashev A Y 2010 Mol. Simul. 36 273
[10]	Galashev A E, Chukanov V N, Novruzov A N and Novruzova O A 2006 High Temp. 44 364
[11]	Galashev A E, Rakhmanova O R, Galasheva O A and Novruzov A N 2006 Phase Transitions 79 911
[12]	Dang L X and Chang T M 1997 J. Chem. Phys. 106 8149
[13]	Jorgensen W L and Madura J D 1983 J. Am. Chem. Soc. 105 1407
[14]	Galashev A E and Rakhmanova O R 2012 Chin. Phys. B 21 113602
[15]	New M H and Berne B J 1995 J. Am. Chem. Soc. 117 7172
[16]	Haile J M 1992 Molecular Dynamics Simulation: Elementary Methods (New York: Wiley) p. 160
[17]	Landau L D and Lifshitz E M 1982 Electrodynamics of Continuous Media (Moscow: Nauka) p. 585
[18]	Prokhorov A M 1988 Physical Encyclopedia (Moscow: Sovetskaya Entciklopediya) p. 702
[19]	Koshlaykov V N 1985 Problems of Solid Body Dynamics and Applied Theory of Gyroscopes (Moscow: Nauka) p. 14
[20]	Sonnenschein R 1985 J. Comput. Phys. 59 347
[21]	Bresme F 2001 J. Chem. Phys. 115 7564
[22]	Neumann M 1985 J. Chem. Phys. 82 5663
[23]	Bosma W B, Fried L E and Mukamel S 1993 J. Chem. Phys. 98 4413
[24]	Neumann M 1986 J. Chem. Phys. 85 1567
[25]	Stern H A and Berne B J 2001 J. Chem. Phys. 115 7622
[26]	Lemberg H L and Stillinger F H 1975 J. Chem. Phys. 62 1677
[27]	Rahman A, Stillinger F H and Lemberg H L 1975 J. Chem. Phys. 63 5223
[28]	Saint-Martin H, Hess B and Berendsen H J C 2004 J. Chem. Phys. 120 11133
[29]	Goggin P L and Carr C 1986 Water and Aqueous Solutions (Boston: Adam Hilger) p. 149
[30]	Chamberland A, Belzile R and Cabana A 1970 Can. J. Chem. 48 1129
[31]	Vallee P, Lafait J, Ghomi M, Jouanne M and Morhange J F 2003 J. Mol. Struct. 651 371
[32]	Chou I M, Sharma A, Burruss C, Shu J, Mao H K, Hemley R J, Goncharov F, Stern L A and Kirby H 2000 Proc. Natl. Acad. Sci. USA 97 13484
[33]	Ripmeester J A, Ratcliffe C I, Klug D D and Tse J S 1994 Ann. N. Y. Acad. Sci. 715 161
[34]	Nassar R and Bernath P 2003 J. Quantum Spectrosc. Radiat. Transfer 82 279

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Computer study of the spectral characteristics of the disperse water–methane system

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