4.8 Article

High-Pressure Synthesis, Structure, and Electrical Property of Iodine-Filled Skutterudite I0.9Rh4Sb12-First Anion-Filled Skutterudite

Journal

CHEMISTRY OF MATERIALS
Volume 22, Issue 1, Pages 47-51

Publisher

AMER CHEMICAL SOC
DOI: 10.1021/cm901594q

Keywords

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Funding

  1. Ministry of Education, Science, and Culture of Japan [16037212, 16750174, 18750182, 18027010, 20550178]
  2. Grants-in-Aid for Scientific Research [20550178, 16037212, 18750182, 18027010, 16750174] Funding Source: KAKEN

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An iodine containing skutterudite compound I0.9Rh4Sb12 wits prepared by the reaction of the element mixture with an iodine excess composition (I:Rh:Sb = 1.5:4:12) at 5-12 GPa and 850 degrees C. Rietveld structural analysis revealed that this is the first anion-filled skutterudite crystallizing in the space group I m-3 with it lattice constant of a = 9.29997(6) angstrom. X-ray photoelectron spectroscopy proved the oxidation state of iodine to be I-. The compound is semimetallic with a resistivity of 9.9 m Omega cm at 300 K. Band structure and density of states calculations Suggested that the bands near the Fermi level are mainly composed of Rh-p, Rh-d, and Sb-p orbitals; the contribution of iodine is not large.

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