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RE: [abinit-forum] Error in anaddb/ifc


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  • From: "Ramirez-Cuesta, AJ (Timmy) " <A.J.Ramirez-Cuesta@rl.ac.uk>
  • To: "'forum@abinit.org'" <forum@abinit.org>
  • Subject: RE: [abinit-forum] Error in anaddb/ifc
  • Date: Fri, 28 Mar 2003 11:57:12 -0000

Martin.
Possibly you are right. However, I cannot see how on earth you'll need a
file 2GB big, to calculate the vibration frecuencies of a system with 12
atoms, if we are talking of 1000, but just 12?

regards,
Timmy


>
> Timmy,
>
> just guessing here, but I have had similar problems when running
> such large jobs on a 32-bit machine (Pentium under linux).
> I guess that the output file is slightly over 2 Gigabytes...?
>
> If so, run the problem on a 64-bit machine and you should have any
> problems.
>
> Regards,
> Martin Tijssens
>
> "Ramirez-Cuesta, AJ (Timmy)" wrote:
> >
> > Hi there
> > I am running a calculation with 12 atoms in the unit cell.
> I want to obtain
> > the free energies and eventually the phonon dispersion curves
> >
> > This is the error message I am getting
> >
> > Input/Output Error 169: Output file capacity exceeded
> >
> > In Procedure: wght9
> > At Line: 131
> >
> > Statement: Formatted WRITE
> > Unit: Internal File
> > Record Number: 1
> >
> > End of diagnostics
> >
> > If someone can share some light, I'll be grateful
> >
> > The input file and the DDB are attached
> >
> > <<ifc-dos.in>> <<NaAlH4-00.ddb>>
> >
> > -------------------------------------------
> > Dr. Anibal Javier Ramirez-Cuesta
> > ISIS Facility
> > Rutherford Appleton Laboratory
> > Building R3, Room 1-42
> > Chilton
> > Didcot
> > Oxon
> > OX11 0QX
> > UNITED KINGDOM
> > email: a.j.ramirez-cuesta@rl.ac.uk
> >
> > Office: +44 (0)1235-445414
> > Cabin: +44 (0)1235-446356
> > Home: +44 (0)1235-768575
> > "Please note new mobile number"
> > Mobile: +44 (0)778 710 5335
> > Fax: +44 (0)1235-44-5720
> > --------------------------------------------
> >
> >
> --------------------------------------------------------------
> ----------
> > Name: ifc-dos.in
> > ifc-dos.in Type: unspecified type (application/octet-stream)
> > Encoding: BASE64
> >
> > Name: NaAlH4-00.ddb
> > NaAlH4-00.ddb Type: unspecified type
> (application/octet-stream)
> > Encoding: QUOTED-PRINTABLE
>
> --
> Dr. M.G.A. Tijssens T: +31 15 278 9552
> Delft University of Technology F: +31 15 261 1465
> Dept. of Aerospace Engineering E:
> M.G.A.Tijssens@lr.tudelft.nl
> Postbus 5058 O: 1.54
> 2600 GB Delft U:
> http://www.em.lr.tudelft.nl/~tijssens
> The Netherlands
>



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