[Pw_forum] [pw_forum] SCF calculation with external magnetic field

Ary Junior aryjunior at gmail.com
Sun Oct 22 15:30:30 CEST 2017


Hi,

If you force your system to have a given total magnetization by setting the
input variable total_magnetization, you can calculate the corresponding
external magnetic field from the difference between the two Fermi energies
in the pw.x output.

Ary Ferreira

FAPESP postdoctoral fellow
UFSCar - Brazil


On Sat, Oct 21, 2017 at 4:43 PM, Maria Tassi <mtassi at phys.uoa.gr> wrote:

> Dear users,
>
> I would like to ask if there is any way to perform a scf calculation with
> the presence of an external magnetic field. Thank you in advance.
>
> Best regards
> Maria Tassi
>
>
> --
> Dr. Maria Tassi
> Post-Doctoral Researcher
>
> National and Kapodistrian University of Athens, Faculty of Physics,
> Department of Solid State Physics, Panepistimiopolis, Zografos, GR-15784
> Athens, Greece
>
> E-mail: mtassi at phys.uoa.gr
> Tel.:   +30 210 7276758
> Mobile: +30 6932131934
> Fax :   +30 210 7276711
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
http://lattes.cnpq.br/8221674673413336
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20171022/0420d1d7/attachment.html>


More information about the users mailing list