Direct calculation of the dimerization constant of water molecules for a dense water vapor
DOI:
https://doi.org/10.15407/dopovidi2014.11.066Keywords:
dimerization, water molecule, water vaporAbstract
The dimerization constant for a dense water vapor is determined from the direct calculation of the internal statistical sums of monomers and dimers. The obtained results are compared to the experimental data and the results of calculations that are based on the relation between the dimerization constant and the second virial coefficient.
Downloads
References
Curtiss L. A., Frurip D. J., Blander M. J. J. Chem. Phys., 1979, 71: 2703. https://doi.org/10.1063/1.438628
Goldman N., Fellers R. S., Leforestier C., Saykally R. J. J. Phys. Chem. A., 2001, 105: 515. https://doi.org/10.1021/jp003567a
Goldman N., Leforestier C., Saykally R. J. J. Phys. Chem. A., 2004, 108: 787. https://doi.org/10.1021/jp035360y
Landau L. D., Livshyts E. M. Statistical physics. Pt. 1, Moscow: Nauka, 1976 (in Russian).
Vigasin A. A. Infrared Phys., 1991, 32: 461–470. https://doi.org/10.1016/0020-0891(91)90135-3
Makhlaichuk P. V., Malomuzh M. P., Zhyganiuk I. V. Ukr. J. Phys., 2013, 58, No 3: 278–288. https://doi.org/10.15407/ujpe58.03.0278
Makhlaichuk P., Malomuzh M., Zhyganiuk I. Ukr. J. Phys., 2012, 57, No 2, 113–117.
Barnes P. Progress in Liquid Physics, 1978: 391–428.
Berendsen H. C., van der Velde G. A. Report of Workshop on Molecular Dynamics and Monte Carlo Calculations on Water. In: Molecular Dynamics on 216 Polarisable Water Molecules. In CECAM, 1972: 29–39.
Makhlaichuk P. V., Moroz K. O. Visn. Kyiv. Univ. Ser. Fiz.-mat. nauky, 2012, No 4: 289–294 (in Ukrainian).
Scribano Y., Goldman N., Saykally R. J. et al. J. Phys. Chem. A., 2006, 110: 5411–5419. https://doi.org/10.1021/jp056759k
Harvey A. H., Lemmon E. W. J. Phys. Chem. Ref. Data, 2004, 33: 369. https://doi.org/10.1063/1.1587731
Malomuzh N. P., Makhlaichuk V. N., Khrapatyi S. V. Zhurn. fiz. khim., 2014, 88, No 8: 1108–1113 (in Russian).
Vigasin A. A., Pavlyuchko A. I., Jin Y. et al. J. Mol. Struct. 2005, 742: 173–181. https://doi.org/10.1016/j.molstruc.2004.12.060
Kraiskii A. V., Mel’nik N. N. Bull. Lebedev Phys. Inst., 2005, 32, No 12: 21.
Downloads
Published
How to Cite
Issue
Section
License
Copyright (c) 2025 Reports of the National Academy of Sciences of Ukraine
This work is licensed under a Creative Commons Attribution-NonCommercial 4.0 International License.
