[Pw_forum] Regarding vc-relax calculations

[mohaddeseh abbasnejad]

Dear Dario Rocca,

Thank you so much.

Regards,
Mohaddeseh

On Tue, Apr 4, 2017 at 1:28 PM, dario rocca <roccad at gmail.com> wrote:

> Dear Mohaddesh,
> you should look the options of the variable cell_dofree
> Best,
> Dario Rocca
>
> On Tue, Apr 4, 2017 at 8:30 AM, mohaddeseh abbasnejad <
> m.abbasnejad at gmail.com> wrote:
>
>> Dear experts,
>>
>> Hello,
>>
>> I was wondering if there is any option to fix one or two of the cell
>> parameters during vc-relax calculation?
>> Thanks in advance.
>>
>> Regards,
>> Mohaddeseh
>>
>> ---------------------------------------------------------
>>
>> Mohaddeseh Abbasnejad,
>> Room No. 323, Department of Physics,
>> University of Tehran, North Karegar Ave.,
>> Tehran, P.O. Box: 14395-547- IRAN
>> Tel. No.: +98 21 6111 8634 <+98%2021%206111%208634>  & Fax No.: +98 21
>> 8800 4781 <+98%2021%208800%204781>
>> Cellphone: +98 917 731 7514 <+98%20917%20731%207514>
>> E-Mail:     m.abbasnejad at gmail.com
>> Website:  http://physics.ut.ac.ir
>>
>> ---------------------------------------------------------
>>
>> _______________________________________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
---------------------------------------------------------

Mohaddeseh Abbasnejad,
Room No. 323, Department of Physics,
University of Tehran, North Karegar Ave.,
Tehran, P.O. Box: 14395-547- IRAN
Tel. No.: +98 21 6111 8634  & Fax No.: +98 21 8800 4781
Cellphone: +98 917 731 7514
E-Mail:     m.abbasnejad at gmail.com
Website:  http://physics.ut.ac.ir

---------------------------------------------------------
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20170404/dc5394c1/attachment.html>