[Wien] How to calculate the spin-orbit coupling parameter

[Hongjun Xiang]

Dear WIEN2k users,

I want to obtain the spin-orbit coupling parameter (\Lambda in \Lambda L.S)
for a given shell (For example, Fe 3d shell).
How can I extract such information from WIEN2k outputs?
Or should I modify the WIEN2K source codes?

Thank you.

Best regards,
Hongjun Xiang

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 H. J. Xiang
 Postdoctoral Research Associate
 Department of Chemistry
 North Carolina State University
 Raleigh, NC 27695-8204
 Tel: 001-919-515-8919 
 http://www4.ncsu.edu/~hxiang/
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