Calcium platinum aluminium, CaPtAl

Acta Crystallogr Sect E Struct Rep Online. 2011 Oct 1;67(Pt 10):i55. doi: 10.1107/S1600536811036749. Epub 2011 Sep 20.

Abstract

A preliminary X-ray study of CaPtAl has been reported previously by Hulliger [J. Alloys Compd (1993), 196, 225-228] based on X-ray powder diffraction data without structure refinement. With the present single-crystal X-ray study, we confirm the assignment of the TiNiSi type for CaPtAl, in a fully ordered inverse structure. All three atoms of the asymmetric unit have .m. site symmetry. The structure features a (∞) (3)[AlPt] open framework with a fourfold coordination of Pt by Al atoms and vice versa. The Ca atoms are located in the large channels of the structure.