[Wien] Reg: File to get the number of electrons in majority and minority spin cases for d-orbital

[Peram sreenivasa reddy]

Dear Wien2K,

I am working on magnetic metallic systems which are having Mn atoms, which
are responsible for magnetic nature in these systems. As these compounds
are metallic in nature the arrived magnetism is due to the itinerant
electrons. Here i just want to know the number of electrons in majority and
minority spin cases separately for Mn-3d orbitals. From the density of
calculations i can find the states for the Mn-3d orbitals. But i want to
calculate the number of electrons. Is there any file to get the information
regarding the number of electrons in each spin case?


Thanking you.
-- 
*P.V.SREENIVASA REDDY*

*Research ScholarDepartment of Physics *
*Indian Institute of Technology*
*Hyderabad*
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20180305/10a46a36/attachment.html>