Abstract
The concentration dependence of the viscosity of tert-butanol-water mixtures in the range of tert-butanol mole fractions from 0 to 0.02 was studied experimentally and by computer simulation. The methods of potentials of mean force and statistical geometry were successfully applied to analysis of physical factors responsible for the extrema in the composition-property dependences. The maximum in the concentration dependence of the viscosity is due to association of solvent molecules.
Similar content being viewed by others
REFERENCES
Alary, J.F., Simard, M.A., Dumont, J., and Jolicoeur, C., J. Solution Chem., 1982, vol. 11, no.11, p. 755.
Origlia, M.L. and Woolley, E.M., J. Chem. Thermodyn., 2001, vol. 33, no.4, p. 451.
Tamura, K., Osaki, A., and Koga, Y., Phys. Chem. Chem. Phys., 1999, vol. 1, no.1, p. 121.
Bender, T.M. and Pecora, R., J. Phys. Chem., 1986, vol. 90, no.8, p. 1700.
Harris, K.R., Newitt, P.J., Back, P.J., and Woolf, L.A., High Temp.-High Press., 1998, vol. 30, no.1, p. 51.
Myrthy, N.M., Jeevan, B.K., and Rajagopal, E., Indian J. Pure Appl. Phys., 1997, vol. 35, no.8, p. 496.
Harris, K.R. and Newitt, P.J., J. Phys. Chem. A, 1999, vol. 103, no.33, p. 6508.
Koga, Y., Siu, W.W.Y., and Wong, T.Y.H., J. Phys. Chem., 1990, vol. 94, no.19, p. 7700.
Koga, Y., Can. J. Chem., 1988, vol. 66, no.5, p. 1187.
Velo, E., Pulgjaner, L., and Recasens, F., J. Chem. Eng. Data, 1991, vol. 36, no.1, p. 55.
Senanayake, P.C., Gee, N., and Freeman, G.R., Can. J. Chem., 1987, vol. 65, no.10, p. 2441.
Akhtar, S., Bhuiyan, M.M.H., Uddin, M.S., Sultana, B., Nessa, M., and Saleh, M.A., Phys. Chem. Liq., 1999, vol. 37, no.3, p. 215.
Noskov, S.Yu., Cand. Sci. (Chem.) Dissertation, Ivanovo, 1999.
Naberukhin, Yu.I. and Rogov, V.A., Usp. Khim., 1971, vol. 40, no.3, p. 369.
Bloomfield, V.A. and Dewan, R.K., J. Phys. Chem., 1971, vol. 75, no.20, p. 3113.
Ivlev, D.V. and Kiselev, M.G., Zh. Fiz. Khim., 2001, vol. 75, no.1, p. 74.
Bruk-Levinson, E.T., Vikhrenko, V.S., Nemtsov, V.B., and Rott, L.A., Izv. Vyssh. Uchebn. Zaved., Fiz., 1970, no. 2, p. 70.
Cho, M., Fleming, G.R., Saito, S., Omine, I., and Stratt, R.M., J. Chem. Phys., 1994, vol. 100, no.9, p. 6672.
Computer Simulation in Chemical Physics, Allen, M.P. and Tildesley, D.J., Eds., Dordrecht: Kluwer Academic, 1992.
Allen, M.P. and Tildesley, D.J., Computer Simulation of Liquids, Oxford: Clarendon, 1987.
Hansen, J.P. and McDonald, I.R., Theory of Simple Liquids, New York: Academic, 1986.
Haberlandt, R., Frietzsche, S., Peinel, G., and Heizinger, K., Molekular Dynamik. Grundlagen und Anwendungen, Braunschweig: Vieweg, 1995.
Ciccoti, G. and Hoower, W.G., Molecular Dynamics Simulation of Statistical Mechanical Systems: Int. School of Physics “Enrico Fermi,” Varenna, 1985.
Vaisman, I.I., Kiselev, M.G., Pukhovskii, Yu.P., and Kessler, Yu.M., “MODYS” — paket programm dlya molekulyarno-dinamicheskogo modelirovaniya (MODYS: A Program Package for Molecular-Dynamics Simulation), Ivanovo: Inst. Khimii Nevodnykh Rastvorov Akad. Nauk SSSR, 1985.
Jorgensen, W.L., J. Phys. Chem., 1986, vol. 90, no.7, p. 1276.
Wadso, I., Acta Chem. Scand., 1966, vol. 20, no.2, p. 544.
Majer, V. and Svoboda, V., Enthalpies of Vaporization of Organic Compounds: A Critical Review and Data Compilation, Oxford: Blackwell Scientific, 1985.
Skinner, N.A. and Snelson, A., Trans. Faraday Soc., 1960, vol. 56, no.12, p. 1776.
Polak, J. and Benson, G.C., J. Chem. Thermodyn., 1971, vol. 3, no.2, p. 235.
Tanaka, H., Nakanishi, K., and Touhara, H., J. Chem. Phys., 1984, vol. 81, no.9, p. 4065.
Kapmakap, A.K., Sarkar, S., and Joarder, R.N., J. Phys. Chem., 1995, vol. 99, no.45, p. 16 501.
Simkin, B.Ya. and Sheikhet, I.I., Kvantovokhimicheskaya i statisticheskaya teoriya rastvorov. Vychislitel’nye metody i ikh primenenie (Quantum-Chemical and Statistical Theory of Solutions. Computation Methods and Their Application), Moscow: Khimiya, 1989.
Shimizu, S. and Chan, H.S., J. Chem. Phys., 2000, vol. 113, no.11, p. 4683.
Marty, G., J. Chem. Phys., 1999, vol. 110, p. 6876.
Naberukhin, Y.I., Voloshin, V.P., and Medvedev, N.N., Mol. Phys., 1991, vol. 73, no.4, p. 917.
Kiselev, M., Poxleiter, M., Seitz-Beywl, J., and Heizinger, K., Z. Naturforsch. A, 1993, vol. 48, no.4, p. 806.
Noskov, S.Yu., Kiselev, M.G., and Kolker, A.M., Zh. Strukt. Khim., 1999, vol. 40, no.2, p. 304.
Belousov, V.P. and Morachevskii, A.G., Teploty smesheniya zhidkostei: Spravochnik (Heats of Mixing of Liquids: Handbook), Leningrad: Khimiya, 1970, p. 256.
Weissberger, A. and Proskauer, E.S., Organic Solvents. Physical Properties and Methods of Purification, Riddick, J.A. and Toops, E.E., Eds., New York: Interscience, 1955.
Author information
Authors and Affiliations
Additional information
Translated from Zhurnal Obshchei Khimii, Vol. 74, No. 8, 2004, pp. 1250–1256.
Original Russian Text Copyright © 2004 by Luk’yanchikova, Ivlev, Kiselev, Al’per.
Rights and permissions
About this article
Cite this article
Luk’yanchikova, I.A., Ivlev, D.V., Kiselev, M.G. et al. Concentration dependence of the viscosity of tert-butanol-water mixtures: Physical experiment and computer simulation. Russ J Gen Chem 74, 1156–1162 (2004). https://doi.org/10.1007/s11176-005-0129-x
Received:
Issue Date:
DOI: https://doi.org/10.1007/s11176-005-0129-x