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• W2014133098 startingPage "9107" @default.
• W2014133098 abstract "An algorithm is developed for performing calculations for the nonlocal electrostatic solvation theory of an ion in a cavity, accounting for electrostatic boundary conditions. The latter implies an induced charge distribution on the cavity surface as well as an induced volume charge distribution in the medium. This approach is validated by a variational derivation which also provides a general expression for the solvation energy. The procedure, implemented for spherical ions, is tested by calculating the analytic solution for an exponential nonlocal dielectric kernel and determining the corresponding solvation energy. Parametrization is presented for a range of solvents, fitted to experimental solvation energies. © 1998 American Institute of Physics." @default.
• W2014133098 created "2016-06-24" @default.
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• W2014133098 date "1998-06-01" @default.
• W2014133098 modified "2023-09-25" @default.
• W2014133098 title "Nonlocal continuum solvation model with exponential susceptibility kernels" @default.
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• W2014133098 doi "https://doi.org/10.1063/1.476357" @default.
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