Electronic and thermoelectric properties of Ce3Te4 and La3Te4 computed with density functional theory with on-site Coulomb interaction correction

The electronic properties and Seebeck coefficients of Ce3Te4 and La3Te4 are computed using Density Functional Theory with on-site Coulomb interaction correction. We found that the Seebeck coefficients of Ce3Te4 and La3Te4 are almost equal at temperatures larger than the Curie temperature of Ce3Te4,...

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Veröffentlicht in:Journal of applied physics 2014-10, Vol.116 (13)
Hauptverfasser: Vo, Trinh, von Allmen, Paul, Huang, Chen-Kuo, Ma, James, Bux, Sabah, Fleurial, Jean-Pierre
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Sprache:eng
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