[Wien] orbital moments

[bothina hamad]

Dear Wien users,
                        I am doing spin-orbit calculations, after converged calculations, I run
x lapwdm -so -c -up 

this by changing r-index and l,s-index to 1 3 in case.indmc ,
However, I get the case.scfdmup  with only the XOPXXX  values, which I can not figure out what do they mean exactly,  the ORBXXX values are not written in this file, that without having any error messages.

So can someone tell me whay is it the case, and what do these XOP values refer to please.

Best regards
Bothina



      
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20091030/21aa2c57/attachment.htm>