[Pw_forum] Error in routine read_rho_xml (1): dimensions do not match

[Surender]

Hi,

May be because, you have changed ecutrho from 320 Ry (in scf) to 160 Ry
(in nscf).

Surender Kumar

> Dear all,
>
> I am now calculating the DOS of CsPbI3 using espresso-5.2.0 and would like
> to know the contribution of each atom. I succeeded in the calculation of
> Pb2+ and I3-, but I failed when I proceeded Cs+ nscf calculation.
>
> The error was as written on the title:
>
> Error in routine read_rho_xml (1):
>      dimensions do not match
>
> It was my first time to have an error in nscf calculation. Since the scf
> calculation was going well, I have no idea why this error appeared. I have
> followed a discussion on
> http://qe-forge.org/pipermail/pw_forum/2014-October/105331.html but it is
> different case.
>
> Please find below my scf (input and output) and nscf input files.
>
> I would really appreciate your help on this case.
>
> Thank you in advance.
>
> Sincerely,
>
> Efi
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