[QE-users] NON CONVERGENCE OF TRANSPORT CALCULATIONS

Abiodun Odusanya aaodusanya at aggies.ncat.edu
Fri Apr 5 14:00:36 CEST 2024


Here are my input and output files, the epw1 run cleanly exits but epw2 run
has non-convergence errors.

On Fri, Apr 5, 2024 at 7:39 AM Abiodun Odusanya <aaodusanya at aggies.ncat.edu>
wrote:

> Good day All,
>
> I've been trying to conduct hole mobility using EPW but when I run my
> calculations, it doesn't converge after 300 iterations.
>
> Please advise.
>
> Abiodun Odusanya
>
> Graduate Assistant of Mechanical Engineering
>
> North Carolina A & T State University
>
> 1601 East Market Street
>
> Greensboro, NC 27411
>
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