[Pw_forum] calculation 'band' not allowed

Pietro Bonfa' pietro.bonfa at fis.unipr.it
Thu Jan 9 16:39:37 CET 2014


Use:

    calculation='bands'

not

    calculation='band'

Bests,
Pietro Bonfa'

On 01/09/2014 04:22 PM, sufyan wrote:
> Dear developers and users,
> I run some calculations of mono layer graphene with two atoms.
> the sfc calculations is converged very well,however when i run band
> calculations
> i get this error:
> 
> from  control_checkin     : error #         1
>       calculation 'band' not allowed
> the file of the two calculations are attached herebelow
> 
> any help will be appreciated
>  and thanks
> 
> Sufyan SA Naji
> LMPHE,FSR,U M. V-Agdal,Rabat,Morocco
> 
>  
> 
> 
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-- 
Pietro Bonfa' - PhD student
Dipartimento di Fisica e Scienze della Terra "Macedonio Melloni"
Viale delle Scienze 7A
43124 Parma - Italy



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