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Calculation of the structure and properties of an associated liquid by the method of integral equations

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Conclusion

The estimates made above lead to the conclusion that the method of integral equations makes it possible to reproduce in a qualitatively correct fashion the principal characteristic features of the structure and thermodynamic behavior of an associated liquid, on the basis of only information on the nature of the interaction of the molecules. To investigate the extent to which this method is suitable for quantitative predictions, it is necessary to solve the numerical system of integral equations (12), or at least Eq. (30) for a strongly associated liquid, using the same approximate methods [13].

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Authors and Affiliations

  1. Odessa Institute of the National Economy, USSR

    E. S. Yakub

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  1. E. S. Yakub
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Translated from Zhurnal Strukturnoi Khimii, Vol. 25, No. 3, pp. 54–60, May–June, 1984.

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Yakub, E.S. Calculation of the structure and properties of an associated liquid by the method of integral equations. J Struct Chem 25, 389–395 (1984). https://doi.org/10.1007/BF00749329

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  • DOI: https://doi.org/10.1007/BF00749329

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