Solution of the Nonlinear Poisson–Boltzm
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A.I. Shestakov; J.L. Milovich; A. Noy
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Article
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2002
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Elsevier Science
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English
⚖ 256 KB
The nonlinear Poisson-Boltzmann (PB) equation is solved using Newton-Krylov iterations coupled with pseudo-transient continuation. The PB potential is used to compute the electrostatic energy and evaluate the force on a user-specified contour. The PB solver is embedded in a existing, 3D, massively p