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Pseudocontinual model of point dipoles for taking into account solvation in quantum-chemical calculations

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Literature Cited

  1. I. A. Abronin, K. Ya. Burshtein, and G. M. zhidomirov, Zh. Strukt. Khim.,21, 145 (1980).

    Google Scholar 

  2. B. Ya. Simkin and I. I. Sheikhet, Physical Chemistry. Current Problems [in Russian], Khimiya, Moscow (1983), p. 148.

    Google Scholar 

  3. A. Warchel, J. Phys. Chem.,83, 1640 (1979).

    Google Scholar 

  4. K. Ya. Burshtein and A. N. Isaev, Theor. Chem. Acta,64, 397 (1984).

    Google Scholar 

  5. M. J. S. Dewar and W. Thiel, J. Am. Chem. Soc.,99, 4899 (1977).

    Google Scholar 

  6. R. P. Bell, The Proton in Chemistry, 2nd edn., Chapman and Hall, London (1973).

    Google Scholar 

  7. D. H. Aue, H. B. Webb, and M. T. Bowers, J. Am. Chem. Soc.,98, 311 (1976).

    Google Scholar 

  8. J. K. Lau, S. Ikuta, and P. Kebarle, J. Am. Chem. Soc.,104, 1462 (1982).

    Google Scholar 

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N. D. Zelinskii Institute of Organic Chemistry, Academy of Sciences of the USSR. Translated from Zhurnal Strukturnoi Khimii, Vol. 28, No. 2, pp. 3–9, March–April, 1987.

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Burshtein, K.Y. Pseudocontinual model of point dipoles for taking into account solvation in quantum-chemical calculations. J Struct Chem 28, 169–174 (1987). https://doi.org/10.1007/BF00751657

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  • DOI: https://doi.org/10.1007/BF00751657

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