Crystal Structure Refinement of Cr3C2.

Crystal structure refinement of matlockite

Asbecasite: crystal structure refinement and crystal chemistry

The crystal structure of antimonian asbecasite in an ejectum of hypabyssal origin occurring at Tre Croci near Vetralla, Vico volcanic complex, Roman potassic province, Latium, Italy, has been refined to R = 0.042, and is compared to the original crystal structure determination carried out on the Sb-free asbecasite of hydrothermal metamorphic origin from the type-locality, Cherbandung in Binna v...

Crystal structure refinement with SHELXL

The improvements in the crystal structure refinement program SHELXL have been closely coupled with the development and increasing importance of the CIF (Crystallographic Information Framework) format for validating and archiving crystal structures. An important simplification is that now only one file in CIF format (for convenience, referred to simply as `a CIF') containing embedded reflection ...

Single-Crystal Structure Refinement of LiZnAs

The crystal structure o f LiZnAs has been veri­ fied with single crystal X-ray methods. LiZnAs crystallizes in a filled-up zinc blende type o f struc­ ture (F 43w , a = 593.9(1) pm, As at site 4 a (000); Zn at site 4 d (3/4 3/4 3/4); Li at site 4c (1/4 1/4 1/4); 25 hkl; R = 0.018). As is coordinated by 4 Li and 4 Zn atoms with identical distances of 257.2(1) pm. Li and Zn atoms are tetrahedrall...

Crystal structure of Na2HfSi2O7 by Rietveld refinement

The structure of triclinic disodium hafnium disilicate, Na2HfSi2O7, has been determined by laboratory powder X-ray diffraction and refined by the Rietveld refinement. The structure is a framework made of alternate layers of HfO6 octa-hedra and SiO4 tetra-hedra linked by common O atoms. Sodium atoms are located in the voids of the framework, aligned into tunnels along the [010] direction. Na2HfS...