The ABINIT Users Mailing List ( CLOSED )

[Ms Gargi Dutta <gdutta@jncasr.ac.in>]

  Dear Sir,
            i am using
 (1)  Version 4.0.3  of ABINIT
     (sequential version, prepared for a P6/Linux computer)

 (2)  LDA Pseudopotential :-  fhi98PP : OPT-type

 (3)  Some info about the computer i am using :


  vendor_id       : GenuineIntel
  cpu family      : 15
  model           : 2
  model name      : Intel(R) Pentium(R) 4 CPU 2.20GHz
  cpu MHz         : 2192.928
  cache size      : 512 KB

  (4) Platform : Linux

  with regards,
  Gargi



> Dear Ms Gargi Dutta,
>
> Could you give a bit more information : which version of
> ABINIT, which platform, and also which pseudopotentials ?
>
> Thanks,
> Xavier
>
> Ms Gargi Dutta wrote:
>>   Hi,
>>      i am having a problem while doing a surface calculation of CeO2.
>>   The calculation consists of first self - consistent calculation
>>   and then a non-selfconsistent calculation. The error is while
>>   doing the non - selfconsistent calculation.
>>
>>      I am attaching an input file 'ab.in'
>>
>>      I will be highly benefitted if anybody can help me to figure
>>   out the probelm.
>>
>>
>>    The following is the error :
>>
>>    Input/Output Error 161: Write operation failed
>>
>>    In Procedure: rwwf
>>         At Line: 429
>>
>>       Statement: Unformatted WRITE
>>            Unit: 11
>>    Connected To: ab_WF1
>>            Form: Unformatted
>>          Access: Sequential
>> Records Read   : 0
>> Records Written: 2363
>>
>> End of diagnostics
>>
>>
>>