Formation of Metal-Encapsulating Si Cage Clusters

作者: Hidefumi Hiura , Takehide Miyazaki , Toshihiko Kanayama

DOI: 10.1103/PHYSREVLETT.86.1733

关键词: PhysicsMetalAtomic physicsAb initioCluster (physics)Silicon clustersProduct (mathematics)CrystallographyIonAtomTransition metal ions

摘要: … total (12 electrons from the Si12 cage and 6 valence electrons by itself), resulting in closed electronic shells, such as Rn. At the same time, 3 valence electrons are left for each Si atom, …

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