Dear Pwscf users, In the paper ? Inorg. Chem. year 2008, Vol 47, 6608 the author used GGA+U and GGA+OP (OP=orbital polarisation) So just want to ask, whether GGA+OP is implemented in espresso or what one can do to implement it? Give me some reference if possible. regards
-- Dr. Bipul Rakshit Research Associate, S N Bose Centre for Basic Sciences, Salt Lake, Kolkata 700 098 India -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20090829/185f5cb1/attachment.htm
