[Pw_forum] Another question about building a spinel structure

[Clark Lee]

Sorry, ibrav=1

On 11/10/06, Clark Lee <jibiaoli at gmail.com> wrote:
>
> Since the number of atomc specified is 14 for spinel structure, I supposethe case of ibrav=  2
> could probably remove your trouble.
>
> Institute of Metal Research, Chinese Academy of Sciences--IMR
> Wenhua Road, 72
> 110016, Shenyang, Liaoning (China)
> Clark
>
> On 11/9/06, Chaohao Hu <chaohao2002 at 163.com> wrote:
> >
> > I am sorry for my careless mistake. "ATOMIC_POSITIONS" should be set to
> > "crystal"
> > option. Now this structure is OK. However, for the case of "ibrav= 0", I
> > still
> > can not solve it.
> >
>
>
>
> --
> Standing on the shoulders of Newton




-- 
Standing on the shoulders of Newton
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