Hi, It sounds interesting. Rather me and my group are working on lanthanide based single, doubled and trilayered perovskites at the moment using functionals like LDA, GGA, LDA/GGA+U, Hybrid-functional etc. For the purpose we are using wien2k and FPLO code. Couples of paper are published on rare-earth based compounds among which one of it recently on lanthanides series is "Ground state electronic and magnetic properties of RCrSb3 (R= La, Ce, Nd, Gd, Dy): A first principles study" which can be found on http://dx.doi.org/10.1016/j.physb.2011.02.043. If you require the papers I can send it. Relating with vanadate and other series of lanthanides, I also have a running project in hand. I am quite interested to collaborate with an experimentalist working on lanthanides and actinides based systems.
Best regards Madhav P. Ghimire --------------------------- MANA, National Institute for Materials Science (NIMS) 1-1 Namiki, Tsukuba, Ibaraki, Japan --------------------------------------------------------- On Thu, Oct 4, 2012 at 6:25 PM, Thomas Mazet < thomas.mazet at ijl.nancy-universite.fr> wrote: > Dear Wien community, > > I used the Wien code in the past, now I perform only experimental research. > I'm looking for a collaboration with somebody specialized in electronic > structure calculations of rare-earth compounds, more particularly in the > field of intermediate valency. > Our group has recently obtained very interesting and new experimental > results on this subject. > Computations should help in understanding the underlying physics. > > If you are interested and want more information, please contact me at : > thomas.mazet at ijl.nancy-**universite.fr<thomas.mazet at > ijl.nancy-universite.fr> > > > Best, > > Thomas Mazet > > -- > ------------------------- > !!! Nouvelle adresse e-mail : > thomas.mazet at ijl.nancy-**universite.fr<thomas.mazet at > ijl.nancy-universite.fr>!!! > > Thomas MAZET Institut Jean Lamour > D?partement P2M - Equipe 103 > CNRS (UMR 7198)-Nancy Universit? > Facult? des Sciences et Technologies > BP 70239 54506 Vandoeuvre-l?s-Nancy Cedex > FRANCE > Tel. : +33-(0)3-83-68-46-77 > Fax : +33-(0)3-83-68-46-11 > > ______________________________**_________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.**at <Wien at zeus.theochem.tuwien.ac.at> > http://zeus.theochem.tuwien.**ac.at/mailman/listinfo/wien<http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien> > -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20121005/21456d88/attachment.htm>