[Wien] Multiplet effects in EELS
Che Seabourne
cheseabourne at gmail.com
Mon Feb 2 02:09:45 CET 2009
I am running the latest version of wien2k, compiled on the HECTOR
supercomputing grid with a stable build.
The question relates to the TELNES module. I am interested in finding L2,3
edges. I am familiar with how to find that edge, but am interested in
knowing if it might be possible to find separately the L2 and L3 edges?
Secondly, a point of clarification on the output case.elnes file. The two
columns labelled partial spectrum 1 and 2, do they actually refer to the
different j states, or are they (in the case of say an L edge) the s and d
orbital contributions? In either case I would be interested in available
discussions of how that separation is carried out?
Thanks,
Che Seabourne
--
--------------------------------------------------
Che Seabourne
Institute for Materials Research
SPEME
University of Leeds
chmcrs at leeds.ac.uk
http://www.engineering.leeds.ac.uk/imr/people/ResearchStudentProfiles.shtml
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20090202/7fe3790a/attachment.html
More information about the Wien
mailing list