In this paper, the Bond Energy (BE) model is generalized to account for the cohesive energy of metallic clusters by considering the contributions of interior, surface, edge and vertex atoms.

• 通过考虑团簇的内部原子、面上原子、棱上原子以及顶点原子对团簇结合能的贡献,将键能模型推广至纳米团簇体系。