[Pw_forum] electron-phonon interaction in QE 4.3

Nandan Tandon nandan.tandon at gmail.com
Thu May 5 16:49:04 CEST 2011


Hello,

Could you please elaborate on the "better alternatives". I want to
calculate electron phonon
coupling in semiconductors.

Regards,

Nandan.

On Thu, May 5, 2011 at 4:37 AM, Paolo Giannozzi <giannozz at democritos.it> wrote:
>
> On May 5, 2011, at 5:57 , Jeffrey M. McMahon wrote:
>
>>      from efermig : error #         1
>>      internal error, cannot bracket Ef
>
> there is something wrong in the electron-phonon code. That code
> is actually obsolete (there are much better alternatives) but of
> course it has to work until it is there. It will be fixed as soon as
> possible.
>
> P.
> ---
> Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
>
>
>
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-- 
***********************************************************************************************
Nandan Tandon
Department of Physics,
Worcester Polytechnic Institute,
100 Institute Road,
Worcester, MA
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