[QE-users] Plotting Spin up and Spin down bands?

Stephen Zhang lolzen at berkeley.edu
Mon Jul 13 19:53:17 CEST 2020


Hi Mona,

Thank you for your response, I'll give it a try and let everyone know what
happens!

Stephen

On Mon, Jul 13, 2020, 6:12 AM Mona Asadinamin <Mona.a at uga.edu> wrote:

> Dear Stephen;
>
> You can recompile bands.f90 after deleting this line from the code:
>
> IF (two_fermi_energies.or.i_cons /= 0) &     CALL errore('bands',&     'The bands code with constrained magnetization has not been tested',1)
>
> However, this method has not been tested yet; so use with care and please
> share the results with us.
>
>
> Best regards;
>
>
> Mona Asadi Namin
>
> Graduate student
>
> Center for simulational physics
>
> University of Georgia
>
> --------------------------------------
>
> Email:mona.a at uga.ed <mona.a at uga.edu>u <mona.a at uga.edu>
>
>
> Message: 2
> Date: Sun, 12 Jul 2020 17:19:10 -0700
> From: Stephen Zhang <lolzen at berkeley.edu>
> To: users at lists.quantum-espresso.org
> Subject: [QE-users] Plotting Spin up and Spin down bands?
> Message-ID:
>         <
> CAM3V+-9NiTZDou0Hhjoai9uyxww1iATAAty5qi_qs3n9Dse+mw at mail.gmail.com>
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>
> Hi everyone,
>
> Does anyone know how to plot separate spin up and spin down bands after
> doing a bands calculation for pw.x? After running bands.x I get the error
>
> The bands code with constrained magnetism has not been tested
>
> Does anyone know any work around?
>
> Thanks
>
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