[Pw_forum] conduction band wavefunction

[Bertrand SITAMTZE]

Dear Shok,

I guess you have to set the "nbnd" parameter according to your needs, based on the number of electrons you have in your system.


Bertrand

 


***********************************
Bertrand SITAMTZE 
Laboratory of Material Sciences
Department of Physics
Faculty of Sciences
University of Yaounde I-Cameroon

IMMM, Université du Maine
Le Mans, France
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________________________________
 De : pari shok <parishok at gmail.com>
À : "pw_forum at pwscf.org" <pw_forum at pwscf.org> 
Envoyé le : Jeudi 25 avril 2013 21h52
Objet : [Pw_forum] conduction band wavefunction
 


Dear All,
Is there a way to get the wave function (squared) of the conduction bands for semiconductor materials with quantum espresso?
It seems that the code calculates the wave functions (squared) of just the valence bands.
I appreciate any kinds of help.
Best.
P Shok

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