[QE-users] pseudo-potential

foudil zaabar foufou191085 at hotmail.fr
Mon Sep 9 17:03:44 CEST 2019


Dear expert
I am trying to calculate the ground state proprieties (structural parameters and the band structure) of MoSe2 and WSe2 monolayers using pseudo-potential dojo.
I found a good results with these pseudo-potential in the DFT level but  when I tried to calculate optical properties (GW and BSE) using yambo code and after many convergence tests I have got strange results such as the gap nature in the GW level.
Can anyone   help me to cheek if these peudo-potential in attached files don't have ghost states !
Thanks in advanced.
Zaabar foudil
university of bejaia
algeria
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