[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
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