[Pw_forum] species list in "set_hubbard_l.f90" and "tabd.f90"

Vo, Trinh (388C) Trinh.Vo at jpl.nasa.gov
Mon Oct 10 02:07:50 CEST 2011


Dear AlL,

I checked the list of species in 2 files "set_hubbard_l.f90" and "tabd.f90."  The list does not contain transition atoms  and La with configuration of  d^1.  Is there any reason why those species are not included?

Thank you,

Trinh Vo

Computing group
JPL/CalTech

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20111009/cad1b9c8/attachment.html>


More information about the users mailing list