Discontinuous Bubble Immersed Finite Element Method for Poisson-Boltzmann Equation

Discontinuous Bubble Immersed Finite Element Method for Poisson-Boltzmann Equation

Year:    2019

Communications in Computational Physics, Vol. 25 (2019), Iss. 3 : pp. 928–946

Abstract

We develop a numerical scheme for nonlinear Poisson-Boltzmann equation. First, we regularize the solution of PBE to remove the singularity. We introduce the discontinuous bubble function to treat the nonhomogeneous jump conditions of the regularized solution. Next, starting with an initial guess, we apply linearization to treat the nonlinearity. Then, we discretize the discontinuous bubble and the bilinear form of PBE. Finally, we solve the discretized linear problem by IFEM. This process is repeated by updating the previous approximation. 

We carry out numerical experiments. We observe optimal convergence rate for all examples.

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Journal Article Details

Publisher Name:    Global Science Press

Language:    English

DOI:    https://doi.org/10.4208/cicp.OA-2018-0014

Communications in Computational Physics, Vol. 25 (2019), Iss. 3 : pp. 928–946

Published online:    2019-01

AMS Subject Headings:    Global Science Press

Copyright:    COPYRIGHT: © Global Science Press

Pages:    19

Keywords:    Biomolecular electrostatics Poisson-Boltzmann equation immersed finite element method discontinuous bubble function linearization.