[QE-users] syntax of using starting_ns_eigenvalue for two different localized orbitals of the same atom

Mahmoud Payami Shabestari mpayami at aeoi.org.ir
Thu Aug 11 21:00:34 CEST 2022


Dear QE-7.1 Developers,



Hi. I would like to use the starting_ns_eigenvalue()=1.0 for two different 
localized orbitals of the same atom. I do not have problem in the HUBBARD 
card, but I do not know how to use starting_ns_eigenvalue()=1.0 for 
different orbital angular momenta of the same atom.

Any comments is highly appreciated.



Best regards,

Mahmoud Payami





---------------------------------------

Mahmoud Payami

NSTRI, AEOI, Tehran, Iran



Email: mpayami at aeoi.org.ir
Phone: +98 (0)21 82066504
--------------------------------------------------------
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20220811/73305037/attachment.html>


More information about the users mailing list