Thanks for the hint, I understand this topic has already been discussed. 
However, after doing all possible variations I still get the same error.

Anyhow, I believe there is not any explicit answer to this issue.



From: users <> on behalf of Lorenzo 
Paulatto <>
Sent: Monday, April 9, 2018 10:00:13 AM
Subject: Re: [QE-users] cholesky Error

On 09/04/18 09:57, Amin Mirzai wrote:
>   %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>       Error in routine  cdiaghg (251):
>        problems computing cholesky
>   %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
This is one of the most regularly asked questions. This error typically
comes from bad geometry (i.e. ions core regions overlapping), bad
pseudopotentials (should not happen with anything from usual libraries)
or problematic input parameters with advanced features (i.e. lda+U, exx,...)

kind regards

Lorenzo Paulatto - Paris
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