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Modeling the electrical conductivity in BaTiO[sub 3] on the basis of first-principles calculations

โœ Scribed by Erhart, Paul; Albe, Karsten


Book ID
126227786
Publisher
American Institute of Physics
Year
2008
Tongue
English
Weight
804 KB
Volume
104
Category
Article
ISSN
0021-8979

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The electrical transport and magnetic properties of BaVS 3 , made up of individual VS 3 octahedral chains, were examined on the basis of 5rst principles and tight-binding electronic structure calculations. The electrical conductivity of BaVS 3 is nearly isotropic despite its one-dimensional structur