Neutron Diffraction and Ab initio Studies of Te Site Preference in Mo3Sb7-xTex

Band structure calculations based on the KKR-CPA method have been undertaken on the Mo3Sb7-xTex and Re 3As7-xGex systems as well as neutron diffraction analysis on the polycrystalline Mo3Sb7 and Mo3Sb5.4Te1.6 compounds. Both results strongly suggest that the Te atoms are located only on the 12d crys...

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Váldodahkkit: Candolfi, C, Lenoir, B, Dauscher, A, Tobola, J, Clarke, S, Smith, R
Materiálatiipa: Journal article
Giella:English
Almmustuhtton: 2008