Electronic structure of the antiferromagnetic semiconductor MnSb₂S₄

URN to cite this document:: urn:nbn:de:bvb:355-epub-118347
DOI to cite this document:: 10.5283/epub.11834

Matar, S. F. ; Weihrich, Richard ; Kurowski, D. ; Pfitzner, Arno

; Eyert, V.

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Date of publication of this fulltext: 23 Dec 2009 11:39

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Abstract

The electronic band structures of orthorhombic (oP28) and monoclinic (mC28) MnSb2S4 were investigated with ab initio calculations in the local spin density approximation to the density functional theory. An analysis of the electronic properties and of the chemical bonding is provided using the augmented spherical wave method considering nonmagnetic, ferromagnetic, ferrimagnetic, and ...