A hybrid multilayered "ONIOM"-type approach to solvation is presented in which the basic free energy of hydration is taken from the Poisson Boltzmann method and the contribution to the solute polarization is taken from a quantum mechanical implementation of the Born method. The method has been teste
A New Approach to Analysis of Multilayer Adsorption
β Scribed by Grigoriy L. Aranovich; Marc D. Donohue
- Publisher
- Elsevier Science
- Year
- 1995
- Tongue
- English
- Weight
- 240 KB
- Volume
- 173
- Category
- Article
- ISSN
- 0021-9797
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
A fractal approach to patchwise adsorption is suggested. Although the geometrical structure of the surface is not explicitly considered, some fractal features are included by assuming that a broad distribution of patches exists. A Markovian scenario for generating such a distribution is introduced.
This article presents an improvement on the evaluation of a Green's function method proposed by Niknejad (1998) for modeling and analysis of substrate coupling in integrated circuits. By careful combination, the 64-term summation can be approximated by a four-term one. Therefore, the computational c
A transfer matrix approach is presented to evaluate and analyze the acoustic characteristics of a multilayered active acoustic coating, which can be applied to actively reduce sound re#ection and/or transmission upon a given sound wave excitation. Expressions are derived to obtain the re#ection and