Il giorno 28/mar/2011, alle ore 12.37, Magdalena Birowska ha scritto: > Dear users, > > Is it possible to turn on at the same time Spin Orbit Iteraction and LDA+U > corection?
It would be nice, but the answer is no, unfortunately... Personally I know only one electronic structure code that has such a feature, it is the ELK all-electron code, see http://elk.sourceforge.net/ (under "Advanced"). HTH GS > > Best regards; > Magdalena Birowska > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum ? Gabriele Sclauzero, EPFL SB ITP CSEA PH H2 462, Station 3, CH-1015 Lausanne -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110328/c2287713/attachment.htm
