[Pw_forum] : error # 1 error opening iotk in nscf calculations

[Dr]

I too am facing similar problem. As suggested by Mr. Kamraj I checked the
compiler. Surprisingly some nscf calculations are running fine, while some
are not. So, I guess it may not be compiler. Pl. help. I am using QE 4-1.2
Thanks
amita
best wishes
Dr B.E.Amitha rani
Principal Scientist
Surface Engineering Division
National Aerospace Laboratories
Bangalore-560 017.
INDIA
Ph:080-25086473/25086252
Fax: 080-25210113
> Dear all,
>
>        While running nscf calculation, i am getting the following error..
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #       127
>      from seqopn : error #         1
>      error opening gra.restart
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
>
> i am using 4.1.2 version of QE with Intel(R) Xeon(R) CPU E5-2670 0 @
> 2.60GHz  machine. i have checked in the working directory, that
> gra.restart
> file is available. the same calculation is running well with 5.1.1 version
> of QE.   i want to add another point here, some other nscf calculations
> are
> running well without any problem with 4.1.2 version. i am not able to
> trace
> the exact solution for this problem. can any one help me?
>
>
> --
> Regards:
> M.Kamaraj
> Chemical Lab
> CSIR-Central Leather Research Institute
> Adyar, Chennai, India. 600 020.
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum


best wishes
amitha
Dr B.E.Amitha rani
Principal Scientist
Surface Engineering Division
National Aerospace Laboratories
Bangalore-560 017.
INDIA
Ph:080-25086473/25086252
Fax: 080-25210113