Comparison of the modified Poisson–Boltzmann theory with recent density functional theory and simulation results in the planar electric double layer
Literature Information
Christopher W. Outhwaite
A comparative study is made of the modified Poisson–Boltzmann results with those of some recent density functional theory and Monte-Carlo results, for the structure and thermodynamics of the planar electric double layer. The results for the diffuse layer potential drop, the wall–ion distribution functions, and the mean electrostatic potential indicate a remarkable degree of consistency in the predictive properties of the two theories. These predictions are also in very close agreement with a new generation of corresponding machine simulation results. Some modified Poisson–Boltzmann results for imaging are also presented.
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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.










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