[Pw_forum] from seqopn : error # 1 error opening gra.restart in nscf calculations

[Kamaraj M]

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.
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