Chemical potential distribution of nonhomogeneous solid electrolyte

G. Bokun, V. Vikhrenko, D. di Caprio, M. Holovko
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引用次数: 1

Abstract

The concept of mean potentials is used for calculating the free energy and chemical potential distribution in a crystalline nonhomogeneous medium, taking into account Coulomb interactions. The lattice version of the equations determining the mean potentials is considered. The closed system of algebraic equations for the mean potentials is formulated and solved. The interparticle interaction potential is split into a short range part, screened Coulomb interaction and the rest of long range Coulomb interaction. The former two interactions are considered in detail, while the long range part is suggested to take into account in the mean spherical approximation. The chemical potential on a given site depends on the concentration distribution over the whole system.
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非均匀固体电解质的化学势分布
在考虑库仑相互作用的情况下,利用平均势的概念计算晶体非均匀介质中的自由能和化学势分布。考虑了决定平均势的方程的点阵形式。建立并求解了平均势的封闭代数方程组。将粒子间相互作用势分为短程部分、屏蔽的库仑相互作用和其余的长距离库仑相互作用。详细考虑了前两种相互作用,建议在平均球面近似中考虑远程部分。给定位置上的化学势取决于整个系统的浓度分布。
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