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20 April 2024
 
  » arxiv » cond-mat/0112096

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Cell model and Poisson-Boltzmann theory: A brief introduction
Markus Deserno ; Christian Holm ;
Date 6 Dec 2001
Journal in ``Electrostatic Effects in Soft Matter and Biophysics’’, eds. C. Holm, P. K’ekicheff, and R. Podgornik, NATO Science Series II - Mathematics, Physics and Chemistry, Vol. 46, Kluwer, Dordrecht (2001)
Subject Soft Condensed Matter | cond-mat.soft
AffiliationUCLA, USA), Christian Holm (MPI-P Mainz, Germany
AbstractThe cell-model and its treatment on the Poisson-Boltzmann level are two important concepts in the theoretical description of charged macromolecules. In this brief contribution to the Proceedings of the NATO-ASI on ``Electrostatic Effects in Soft Matter and Biophysics’’, which took place in Les Houches from Oct. 1-13, 2000, we provide an introduction to both ideas and summarize a few important results which can be obtained from them. We outline the sequence of approximations which ultimately lead to the cell-model. Then we present two exact results, namely, an expression for the osmotic pressure and a formula for the ion density at the surface of the macromolecule, known as the contact value theorem. The next section provides a derivation of the Poisson-Boltzmann equation from a variational principle and the assumption of a product state. Afterwards we apply Poisson-Boltzmann theory to the cell-model of linear polyelectrolytes. In particular, the behavior of the exact solution in the limit of zero density is compared to the concept of Manning condensation. Finally, we demonstrate how a system described by a cell model can be coupled to a salt reservoir, i.e., how the so-called Donnan equilibrium is established.
Source arXiv, cond-mat/0112096
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