Dear All, It looks like the noncollinear calculation only supports lda_plus_u_kind=1 currently, and it can not be used with Hubbard_alpha to calculate U. So is there a way to calculate U for lda_plus_u_kind=1 or will noncollinear calculation support lda_plus_u_kind=0 in the near future?
-- Best Regards. Peng -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20120924/b4794acc/attachment.htm