In this treatment, the effects of solvent and mean field of surrounding ions have been considered by virtue of an effective interionic pair potential and the three-body interaction is neglected. 其中离子间相互作用选用有效势能描述,并且忽略了稀溶液中粒子间的三体相互作用。
Their action is impeded by interionic attraction. 它们的活动被离子间的引力所制约。
Their band structures are calculated by using tight-bind method within the extended H ü ckle scheme. The results show that it is the intercluster or interionic interaction that produces the possibility of the charge transfer between the clusters. 采用扩展的H櫣ckel近似下的紧束缚能带方法计算了部分化合物的能带结构,表明正是这些簇间或离子间的相互作用提供了簇间电荷转移的可能。
This indicates the flexibility of lattice inversion in the derivation of interionic potentials. 初步的应用说明了晶格反演方法在离子间相互作用势应用上具有较大的适用性。
Study of electrolyte solution has long been a challenging theme due to the intrinsic complexities involved such as the long-range interionic interaction, the ionic solvation, mixed solvents and mixed electrolytes etc. 由于电解质溶液内在的复杂性,如离子间长程作用力、离子水化作用、混合溶剂和混合电解质等等,对电解质溶液的研究一直是挑战性课题之一。
An application of the universal interionic potential including charge transfer-the cohesive energy curves of the NaCl-type alkali halide crystals 一种考虑电荷转移的普适相互作用势的应用&NaCl结构的碱卤离子晶体的结合能曲线
Interionic Potentials and their Parameters in the Alkali Halides 碱金属卤化物的势函数及其参数