[Pw_forum] error message - problems computing cholesky decomposition

Paolo Giannozzi giannozz at democritos.it
Mon Jun 16 18:54:26 CEST 2008


shruba at gmail.com wrote:

>      from  pzpotrf  : error #       358
>       problems computing cholesky decomposition

please try "pw.x -ndiag 1": it will use serial instead of parallel
subspace diagonalization

> when I was checking the forum for similar error I saw Dr Giannozzis 
> mail, according to that I am providing the details, I am sorry if I have 
> missed any

you missed to provide atomic positions. If this is a real problem,
it has to be reproduced.

Paolo
-- 
Paolo Giannozzi, Democritos and University of Udine, Italy



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