Neutron scattering study of phonon dynamics on type-I Clathrate Ba<sub>8</sub>Ga<sub>16</sub>Ge<sub>30</sub>
C H Lee; H Yoshizawa; M A Avila; I Hase; K Kihou; T Takabatake
Журнал:
Journal of Physics: Conference Series
Дата:
2007-12-01
Аннотация:
Phonon dynamics of type-I clathrates Ba<sub>8</sub>Ga<sub>16</sub>Ge<sub>30</sub> has been studied at room temperature by inelastic neutron scattering for energy less than 9 meV. Optical phonons associated with large vibrations of Ba atoms filled in large tetrakaidecahedral cages are observed around E = 4.5 meV. Analysis based on a Born-Von Kármán force model shows that the longitudinal force constants between the Ba atoms and the oversized cages has a relatively small value of 0.011 ∼ 0.014 mdyn/Â. The results indicate that the Ba atoms are very loosely bound to the surrounding oversized cages that consist of Ga and Ge atoms.
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