On Fri, 2012-10-12 at 17:16 +0530, koushik pal wrote: > Is it possible to assign spin label to the electronic bands? That > means, can we tell which band is associated with up spin and which one > due to down spin? If possible, can somebody please tell me how to do > that?
in LSDA calculations, k-points are listed twice: the first time foir spin-up bands, the second time for spin-down bands > P.S.- I'm doing fully relativistic calculation with spin-orbit coupling. P.S. in this case there is no such thing as spin-up and spin-down bands P. -- Paolo Giannozzi, IOM-Democritos and University of Udine, Italy
