[QE-users] (no subject)
mohamed maymoun
maymoun17755 at gmail.com
Fri Dec 3 23:55:32 CET 2021
Dear users,
I calculate the vacuum energy with the average electrostatic potential
using pwscf, pp.x and average.x.
I wanted to calculate the band edge position with respect to vacuum
Any suggestions on what I do ?
*Best regards,*
*mohammad maymoun*
********************************
*PhD Student*
*Laboratoire des sciences des Matériaux, des Milieux et de la Modélisation
(LS3M)*
*Faculté Polydisciplinaire de Khouribga*
*Université Sultan Moulay Slimane*
*Béni Mellal , Maroc*
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