[QE-users] wrong total_weight error

Mohamed Ahmed Abd-Elati maa at niles.edu.eg
Mon Feb 14 15:03:57 CET 2022


Dear Professor Lorenzo
Attached are all of the inputs (scf.in, ph.in, q2r.in, and matdyan.in) that
provide all of the specifics about the MoSiN structure.
Best regards
*Mohammed A. Abdelati*
*Assistant Lecturer*
Laser Applications in Metrology Photochemistry and Agriculture (LAMPA)
Department, National Institute of Laser Enhanced Sciences (NILES), Cairo
University, Giza, Egypt.
Mobile   +20 1009752922
Home    +201152605076
E-mail    ma1986ff at yahoo.com


On Sun, Feb 13, 2022 at 11:48 AM Mohamed Ahmed Abd-Elati <maa at niles.edu.eg>
wrote:

> Dear all
> I want to calculate the phonon dispersion for MoSiN structure.
> The steps  scf, ph, and q2r have completed successfully.
> During matdyan step I faced the following error
> ...........................................
> Error in routine frc_blk (1):
>      wrong total_weight
> *........................................*
> I've included all of the inputs here.* .*
> *Best regards*
>
> *Mohammed A. Abdelati*
> *Assistant Lecturer*
> Laser Applications in Metrology Photochemistry and Agriculture (LAMPA)
> Department, National Institute of Laser Enhanced Sciences (NILES), Cairo
> University, Giza, Egypt.
> Mobile   +20 1009752922
> Home    +201152605076
> E-mail    ma1986ff at yahoo.com
>
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