[Wien] How to run the runamf_lapw with LDA+U

kongshi kongshi at hotmail.com
Tue Nov 21 03:42:42 CET 2006


Dear user:

     I took some AFM (antiferromagnetic) calculations. But I can't run it
with LDA+U. When I do it, it gives me the error message.

error: command  /wien2k/orb uporb.def   failed

     I don't know how to solve it. Please give me some advice. Thank you!

 

 

Kongshi 

 

 

-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20061121/5830b38f/attachment-0001.html


More information about the Wien mailing list