[Wien] Problem in band structure calculations

Yes, spin orbit couples spin-up and dn and thus you have twice as many bands. > 1. I have tried to compute the band structure of DySb (spin-up) using > LSDA+U with U=0.5 Ry. The band structure of the same also shows doubling > of bands. Is it due to spin-orbit contribution or something wrong ? > >

[Wien] Problem in band structure calculations

Respected Prof. P. Blaha and all wien users, Sir, ? 1. I have tried to compute the band structure of DySb (spin-up) using LSDA+U with? U=0.5 Ry.? The band structure of the same also shows doubling of bands.? Is it? due to spin-orbit contribution or something wrong? ? Regards and thanks, Subhra K