To whom it may concern,
I have a naive question. I would like to run a LSDA+U calculation on
EuO. I checked the subroutine tabd.f90 and found that the default number of
localized electrons for Eu 4f is 6. However, since Eu has 4f^7 5d^0 6s^2
atomic configuration, why is the number NOT 7?
Thank you very much.
Hanghui Chen
Department of Physics
Yale University
-------------- next part --------------
An HTML attachment was scrubbed...
URL:
http://www.democritos.it/pipermail/pw_forum/attachments/20110801/69ec84f4/attachment.htm
