Bhuiyan L B, Outhwaite C W, Henderson D
Laboratory of Theoretical Physics, Department of Physics, University of Puerto Rico, San Juan.
J Chem Phys. 2005 Jul 15;123(3):34704. doi: 10.1063/1.1992427.
The modified Poisson-Boltzmann theory is used to analyze the anomalous behavior of the electric double layer capacitance for small surface charge at low temperatures and densities. Good agreement is found with simulation and recent density-functional theory results. Negative adsorption is also found in line with theory and simulation. An unsatisfactory feature is the relatively poor structure in this region due to the inherent approximations in the theory. This feature is unimportant in relation to the capacitance results but has implications when calculating adsorption properties.
修正的泊松-玻尔兹曼理论用于分析低温及低密度下小表面电荷的双电层电容异常行为。与模拟结果及近期的密度泛函理论结果吻合良好。还发现负吸附现象与理论和模拟相符。一个不尽人意的特点是,由于该理论中固有的近似,该区域的结构相对较差。这一特点相对于电容结果而言并不重要,但在计算吸附特性时会产生影响。