[DFTB-Plus-User] Error
Sarah Gamal
s.abouelhasab at gmail.com
Thu Feb 21 15:09:14 CET 2019
Dear users,
I was trying to calculate DOS for a structure and I get this error,
"ERROR!
-> Failure in diagonalisation routine ZHEEVR, unable to complete Cholesky
factorization of B 281"
what does this mean?
Regards
Sarah Gamal
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://mailman.zfn.uni-bremen.de/pipermail/dftb-plus-user/attachments/20190221/916d46e5/attachment.htm>
More information about the DFTB-Plus-User
mailing list