[QE-users] Regarding the calculation on spin and orbital moment

SOUMYAKANTA PANDA sp57 at iitbbs.ac.in
Sun May 2 19:46:22 CEST 2021


Hi users,
As i have calculated the magnetic moment of a particular atom in my crystal
structure, i could not distinguish the contribution of spin as well as
orbital part in it. Where could I find the spin and orbital magnetic moment
in the calculation?

Regards,
Soumyakanta Panda
Research Scholar
Nano Magnetism and Magnetic Materials Laboratory
IIT Bhubaneswar, India

-- 
*Disclaimer: *This email and any files transmitted with it are confidential 
and intended solely for the use of the individual or entity to whom they 
are addressed. If you have received this email in error please notify the 
system manager. This message contains confidential information and is 
intended only for the individual named. If you are not the named addressee 
you should not disseminate, distribute or copy this e-mail. Please notify 
the sender immediately by e-mail if you have received this e-mail by 
mistake and delete this e-mail from your system. If you are not the 
intended recipient you are notified that disclosing, copying, distributing 
or taking any action in reliance on the contents of this information is 
strictly prohibited.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20210502/59d96854/attachment.html>


More information about the users mailing list