[Wien] spin-obital coupling (LSDA+SO)
Stefaan Cottenier
Stefaan.Cottenier at fys.kuleuven.be
Thu Jul 12 17:50:57 CEST 2007
>I wonder that which elativistic Local Orbitals' (RLO) should be select ?
>which difference are there for the calculated result?
>
>
>
See this paper:
Electronic structure of fcc Th - spin orbit calculations with 6p1/2
local orbital extension
J.Kunes, P.Novak, R.Schmid, P.Blaha and K.Schwarz, Phys.Rev. B 64,
153102 (2001)
Stefaan
Disclaimer: http://www.kuleuven.be/cwis/email_disclaimer.htm
More information about the Wien
mailing list