[Pw_forum] on nosym=.true.
Mahmoud Payami
mpayami at aeoi.org.ir
Thu Nov 25 08:43:21 CET 2010
Dear Stefano,
Thank you. I followed your suggestion and it worked perfect.
Cheers,
mahmoud
> Dear Mahmoud Payami,
> are you specifing calc='vc-relax' in the &control namelist ?
> otherwise the code will skip the CELL part.
> I thnk that one should specify cell_dofree="z" (with z into quotation
> marks)
>
> stefano
>
> Quoting Mahmoud Payami <mpayami at aeoi.org.ir>:
>
>> Dear Eyvaz,
>> Thank you very much for "cell_dofree" switch. I looked at INPUT_PW
>> and added "cell_dofree=z" in the &CELL namelist but in the output
>> file I noticed that it is ignored with the message:
>> Warning: card &CELL ignored
>> Warning: card CELL_DOFREE=z ignored
>>
>> Am I committing a mistake in using that?
>> Bests,
>> mahmoud
>>
>> If you mean changes only along Z-direction add cell_dofree=z. For
>> ore info please have a look at INPUT_PW,txt in /Doc.
>>
>> Bests,
>> Eyvaz.
>>
>>
>>
>>
>>
>>
>>
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