Dear All, Would someone like to share a PZ-LDA USPP for Mg ?
regards, Saha SK stewart at cnf.cornell.edu<h/1wqeyqapgiv7i/?v=b&cs=wh&to=stewart at cnf.cornell.edu>wrote: > Hi all, > > I was wondering if anyone had a reliable ultrasoft > pseudopotential for Mg in > the local density approximation. The periodic table > on the PWscf site has > only norm-conserving and a GGA ultrasoft. > > Thanks, Hi Derek, I can try generate it. My US GGA pseudopotential for Mg works quite well. It will take few days, hopefully, including tests. Bests, Eyvaz. -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110518/30742ec4/attachment.htm
