Hiroyuki Takenaka

Exohedral Bonding Nature of Si Atom on the Ba@Si28 Cluster; Ab Initio Study

Guest Atom Displacements in Silicon Cluster Na2@Si50H44

Optimized structures of Si28 and Ba@Si28 clusters: Ab initio study

28aRC-10 Electronic structures of endohedral sodium atoms in silicon clathrate II

Electronic structures and displacements of endohedral sodium atoms in silicon clathrate II

19aPS-84 Binding energy between endohedral atoms in clathrate

Guest displacements in silicon clathrate II

Electronic structures and stabilities of dimers of endohedral silicon clusters

Semiconductiong Properties of Clathrates Ba8@Ge43: ab initio Study

Mechanism of Clathrate Formation through Binding Nature of Si-X and Ge-X dimers: ab initio Study