Hi all, I would like to calculate the band structure of an antiferromagnetic insulator. In v. 4.2.1 of QE one has to define antiferromagnetism in an insulator like this:
starting_magnetization(1) = 1, starting_magnetization(2) = -1, tot_magnetization = 0 This is considered as constrained magnetization which is not allowed to use with the bands code. Is there another way to define the antiferromagnetism since nelup and neldw are not available anymore? And why is the bands code not working? Thanks in advance for your help, Silvia Bahmann Institute for Theoretical Physics TU Bergakademie Freiberg Germany
