[Pw_forum] "ibrav=7"

lan haiping lanhaiping at gmail.com
Wed Jan 7 11:47:54 CET 2009


Dear Deng Pan,
a suggestion is that you can try to use xcrysden to examine your input file.

a simple command just likes
xcrysden --pwi  your.inp

good luck.


On Wed, Jan 7, 2009 at 6:37 PM, 潘登 <panda.deng.pan at gmail.com> wrote:

>  Dear Paolo,
>
>   Would you tell more detail about my problem.
>
> >  > cellem(1)=7.7702
>
> Is this one nosense in the namelist ?Or it needs for other settings?
> I have tried run without this option 'cellem(1)=7.7702', it will give
> the error message 'Invalid lattice parametre'.Please tell me how to
> set it properly.
>
> Have a nice day.
> _______________________________________________
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> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>



-- 
Hai-Ping Lan
Department of Electronics ,
Peking University , Bejing, 100871
lanhaiping at gmail.com, hplan at pku.edu.cn
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