Dear Wien2k users: Does Ueff=U-J or Ueff=U- 1/2 J? how to estimate J using constrained DFT.?
Thank you in advance
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
