[Pw_forum] PW.X WORKS ONCE AND NEXT TIME DOESN'T.. FOR THE SAME INPUT FILE..

[Pang Rui]

You just need to set ecutrho = 160. I can run your input with this
correction smoothly on my machine.
On Tue, 15 Jul 2014 11:00:39 +0530, siddheshwar chopra
<sidhusai at gmail.com>
wrote:
> Dear Dr. Giovanni Pizzi,
> I re ran the i/p file.. i corrected the ecutrho value. But unfortunately
> the same error persists. Please find attached the i/p, o/p and crash
files.
> I have tried running it from a script and also directly from terminal
using
> "mpirun -n 3 pw.x -i graphene.scf20.in" .
> 
> Regards,
> 
> 
> On Mon, Jul 14, 2014 at 9:39 PM, Giovanni Pizzi <giovanni.pizzi at epfl.ch>
> wrote:
> 
>>  Dear Siddheshwar,
>> it is quite improbable that this error did not occur in your first run.
>> You must have changed something between the two runs (and probably
>> forgotten about it).
>>
>> In any case, in the input file you wrote 'ecutrho=' but did not specify
>> any value. This for sure is (one of the possible) causes of the error.
>>
>> Best,
>> Giovanni
>>
>>
>>
>> On 07/14/2014 02:01 PM, siddheshwar chopra wrote:
>>
>>   Dear Users,
>>  I ran the pw.x successfully using 4 processors. But again when I am
>> running the same i/p file, I am getting this error:
>>
>>
>>
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>      Error in routine  read_namelists (5010):
>>       reading namelist system
>>
>> 
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>
>>      stopping ...
>>
>>
>>
===================================================================================
>> =   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
>> =   EXIT CODE: 1
>> =   CLEANING UP REMAINING PROCESSES
>> =   YOU CAN IGNORE THE BELOW CLEANUP MESSAGES
>>
>>
===================================================================================
>>
>>  Please tell me how to resolve this issue.
>>
>>  Regards,
>>
>> --
>>  *Dr. Siddheshwar chopra,*
>>
>>
>> *M.Sc., Ph.D (Physics) Assistant Professor (Physics), *
>> *Amity University, Noida, India.*
>>
>>
>>
>> _______________________________________________
>> Pw_forum mailing
>> listPw_forum at pwscf.orghttp://pwscf.org/mailman/listinfo/pw_forum
>>
>>
>>
>> --
>> Giovanni Pizzi
>> Post-doctoral Research Scientist
>> EPFL STI IMX THEOS
>> MXC 340 (Bâtiment MXC)
>> Station 12
>> CH-1015 Lausanne (Switzerland)
>> Phone: +41 21 69 31124
>>
>>
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>>

-- 
PostDoc
Department of Physics, South University of Science and Technology of China