A generalized Poisson and Poisson-Boltzmann solver for electrostatic environments
نویسندگان
چکیده
منابع مشابه
A generalized Poisson and Poisson-Boltzmann solver for electrostatic environments.
The computational study of chemical reactions in complex, wet environments is critical for applications in many fields. It is often essential to study chemical reactions in the presence of applied electrochemical potentials, taking into account the non-trivial electrostatic screening coming from the solvent and the electrolytes. As a consequence, the electrostatic potential has to be found by s...
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ژورنال
عنوان ژورنال: The Journal of Chemical Physics
سال: 2016
ISSN: 0021-9606,1089-7690
DOI: 10.1063/1.4939125