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Decomposition of electronic properties and calculation of solvation energies for surface-active molecules

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Abstract

For ions and polar molecules located near a surface, we derived and analyzed the general formulas to calculate their solvation energies.

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St. Petersburg State University. Translated fromZhurnal Strukturnoi Khimii, Vol. 35, No. 6, pp. 3–12, November-December, 1994.

Translated by A. Arbuznikov

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Tulub, A.V., Kukhtina, E.A. Decomposition of electronic properties and calculation of solvation energies for surface-active molecules. J Struct Chem 35, 755–764 (1994). https://doi.org/10.1007/BF02578104

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  • DOI: https://doi.org/10.1007/BF02578104

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