I meant that in the NOSOC case the valence bands go from 11 to 24 (14 bands) and 6 have parity g while 8 have parity u.
In the SOC case the same valence bands goes from 21 to 48 and 14 are + and 14 are - meaning that 7 couples of degenerate bands are + and 7 couples are -. HTH, Andrea Quoting balabi <[email protected]>: > Dear Andrea, > Thank you very much for explanation. > But I don't get it. What do you mean by 6g and 8u? Which lines do > 6g and 8u ( also 7+ 7-)correspond to? > And I can not see why your argument can lead to different parity > product for nosoc and soc case. > I still don't know why my counting is wrong. > > best regards > > _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
