Electronic properties of the Mg2Si thermoelectric material investigated by linear-response density-functional theory

P. Boulet (1, 2) , M. Verstraete , J.-P. Crocombette (3) , M. Briki , M.-C. Record (4, 1)

1 AMU - Aix Marseille Université
2 MADIREL - Matériaux divisés, interfaces, réactivité, électrochimie
3 SRMP - Service de recherches de métallurgie physique
4 IM2NP - Institut des Matériaux, de Microélectronique et des Nanosciences de Provence

Domaines: Matériaux

P. Boulet, M. Verstraete, J.-P. Crocombette, M. Briki, M.-C. Record. Electronic properties of the Mg2Si thermoelectric material investigated by linear-response density-functional theory. Computational Materials Science, 2011, 50 (3), pp.847 - 851. ⟨10.1016/j.commatsci.2010.10.020⟩. ⟨hal-01756109⟩