[Wannier] DOS and PDOS calculations

zhangkan3 at mail.sysu.edu.cn zhangkan3 at mail.sysu.edu.cn
Wed Feb 17 10:26:36 CET 2021


Hello everyone,

1) I did a calculation on density of states and plot it by using this command:plot 'ab_up-dos.dat' u (-$2):($1-0.258150) w l,'ab_dn-dos.dat' u2:($1-0.258150) w l

The result is obviously incorrect. I have uploaded the files in attachment. Can give some advice on it?

2) For projected DOS, how to determine the parameter dos_project? It tells that this is a list of WFs. In the tutorial of example 8, it is 2,3,4. I cannot understand it.

best,

Kan
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