[Pw_forum] eliminating symmetry for pw2casino

Gabriele Sclauzero sclauzer at sissa.it
Tue Dec 16 13:48:55 CET 2008



Gabriele Sclauzero wrote:
> Hi,
> 
> meghdad saeedian wrote:
>> Hi,
>> I have a question:
>> How can I run scf without symmetry?
> 
> nosym=.TRUE. in the namelist &control should do the job.

Sorry, it goes in the &system namelist

GS

> Be careful when chosing the k-point grid (see warnings in Doc/INPUT_PW.txt).
> 
>> I mean: how should I make the required file?
> 
> I hope I've actually understood your question...
> 
> regards,
> 
> GS
> 
>> Best regards,
>> Saeedian
>>
>>
>>
>>       
>>
>>
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>>
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> 

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