[Wien] Alignment band

Gavin Abo gsabo at crimson.ua.edu
Fri May 15 19:33:22 CEST 2020


See WIEN2k 19.1 usersguide section "3.11.4 Bandstructure" [1] and [2].

[1] http://susi.theochem.tuwien.ac.at/reg_user/textbooks/usersguide.pdf

[2] 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg19589.html

On 5/15/2020 9:21 AM, Brik Hamida wrote:
> Dear
>
> Im working on 2D semiconductor. I have calculated its electronic 
> structure using Wien2k .
>
> Actually , I need to plot the corresponding  alignment band means the 
> band edge position which are usually named Homo and Lumo.
>
> Please can you help me and tell me how  I can do that.
> Thanks in advance .
>
>  Best,
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