[Wien] (no subject)

[wysong]

Dear wien2k users:

Recently, I have encountered a very pulzing question. I have completed GGA successfully. However, when I change it to GGA+SOC. I get L2main - QTL-B Error, in the inistso_lapw, I set Kpoints=100. This may be a very common error. But, if I set K=50 in the initso, I get the desired results and everything seems ok. Meanwhile I have tried the LSDA methods and get same result. So I am writing to you to help me. Thank you in advance.
 
 				
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wysong
2008-12-01