[QE-users] the band structure of Au(111)

BARRETEAU Cyrille cyrille.barreteau at cea.fr
Fri Oct 14 15:18:25 CEST 2022


I cannot download your png file.

I need more info about the way you have generated your graph.


Cyrille


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Cyrille Barreteau
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De : users <users-bounces at lists.quantum-espresso.org> de la part de imane BEZZAOUI <imane.bezzaoui at ump.ac.ma>
Envoyé : vendredi 14 octobre 2022 14:38:59
À : users at lists.quantum-espresso.org
Objet : [QE-users] the band structure of Au(111)

Dear all

I would ask you when I plot the band structure of Au(111) with 7 layers to get the Shockley states and I want to add more layers But as in the graph below, I obtained the band as two separate curves instead of obtaining only one.
[https://drive-thirdparty.googleusercontent.com/16/type/image/png] au7layers.png<https://drive.google.com/file/d/1HsGgX5gAekaiLSevHPb1hi-8X3g5S9N2/view?usp=drive_web>

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