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Numerical solver for the modified Poisson-Boltzmann equation.

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Numerical Solver for the Modified Poisson-Boltzman Equation

A powerful solver based on succesive over-relaxation for the one dimensional modified Poisson–Boltzmann equation, which includes a dielectric response profile, unequal ionic valencies, surface interactions via potentials of mean force and the presence of impurities. The modified PBE is solved in the form of:

PBE

Installation

Prerequisites

You'll need Python3 with the numba package installed.

Linux/MacOS

python3 setup.py install

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Numerical solver for the modified Poisson-Boltzmann equation.

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