[sdpd] Re: atomic coordinates for Hexagonal MoSi2

["Armel Le Bail" <alb...@cristal.org>]

"xia changtai" <cxi-...@cec.uchile.cl> wrote: 
original article:http://www.egroups.com/group/sdpd/?start=248
> Hi, Dear friends,
> 
> I'm trying to make a structure refinement for Hexagonal MoSi2. 
> Could anyone teach me what atomic coordinates should I use?
> 
> Thanks!
> 

The CRYSTMET database does contain 2 MoSi2 varieties,
One tetragonal, the other hexagonal. But only the
tetragonal phase is given with atomic coordinates.

Best wishes,

Armel