[Pw_forum] GWW-WANNIER part
Ngoc Linh Nguyen
nnlinh at sissa.it
Mon Mar 22 10:09:22 CET 2010
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> from davcio : error # 99
> error while reading from file
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> What is the reason ?
> I read several time in the fourom that the davcio error is originate from some problem like : (disk is full ,or ....) but i checked several time my tmp directories and also the my voulum of the disk, but everything is ok. I can not understand what can I do
>
The davcio problem normally relates to reading from output files.
In your calculation, if you see in PW/matrix_wannier_gamma.f90, it is
corrupted when reading the wavefunctions (wfc) of previous run (scf or
nscf), and the wcf maybe get problem.
Therefore, I think it is better to rerun the scf and nscf before
rechecking if GW work or not.
Good luck,
Linh
> Thanks a lot
>
>
>
> Ali Kazempour
> Physics Department, Isfahn University of Technology
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