Dear all, Is there anyone in the forum who can provide me with a pseudo-potential (nonlinear core-correction + ultrasoft + PBE) for any of the following elements? : Sm, Nd, Pr, Ce . We are running experiments that include those elements and I could provide feedback on how well those pseudos reproduce experimental properties, such as vibrational spectra and lattice parameters at different pressure conditions; in order to include them in the PWscf.org web page. Nd is the one that we are going to measure first, so, getting that one would be cool.
Thanks, Javier -- Javier A. Montoya Geophysical Laboratory Carnegie Institution of Washington 5251 Broad Branch Rd. NW Washington, DC 20015 -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20080508/6b380739/attachment.htm
