Investigations about the stability range of the CaAl2Si2 type structure inthe case of ternary silicides

Citation
C. Kranenberg et al., Investigations about the stability range of the CaAl2Si2 type structure inthe case of ternary silicides, Z ANORG A C, 625(11), 1999, pp. 1787-1793
Citations number
34
Categorie Soggetti
Inorganic & Nuclear Chemistry
Journal title
ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE
ISSN journal
00442313 → ACNP
Volume
625
Issue
11
Year of publication
1999
Pages
1787 - 1793
Database
ISI
SICI code
0044-2313(199911)625:11<1787:IATSRO>2.0.ZU;2-O
Abstract
Five compounds LnAl(2)Si(2) (Ln: trivalent rare-earth metal, Y) were synthe sized by heating the elements at 800 degrees-1000 degrees C. They are isoty pic and crystallize in the CaAl2Si2 type structure (<P(3)over bar ml>; Z = 1) (lattice constants see "Inhaltsubersicht"). The electronic structures (L MTO band structure calculations) of CaAl2Si2 and YAl2Si2, the latter one is in accordance to Ln(3+)(Al3+)(2)(Si4-)(2) not electrovalent, are discussed with regard to the bondings and the electrical conductivity respectively. Investigations of GdAl2-xMnxSi2 mixed crystals showed, that the structure t ype already at low Mn content (x approximate to 0,3) changes from CaAl2Si2 (GdAl2Si2) to ThCr2Si2 type structure (GdMn2Si2).