nbndssub

[nadeemnatt]

Hi
how can I know the reasonable number nbndsub. should it be the same as number of bands in nscf calculation? Thanks

Regards
Nadeem

[carla.verdi]

Dear Nadeem,

nbndsub is the number of wannierized bands (in practice it is equivalent to num_wann of wannier90); for some comprehensive guidance you can refer to the wannier90 documentation and tutorials http://wannier.org/user_guide.html

Best,
Carla

[nadeemnatt]

Thank you Carla It helped me to understand many things.