[Wien] lapw1 error

[Laurence Marks]

You need to do some more investigation before anyone can help you.
1) Look at the relevant case.output1 file. Does it contain more
information as to what the error was? Where does it stop?
2) Look at the standard output. One way to do this is to run "x lapw1"
at the terminal and see what it says. (If you are running parallel you
may need to look at case.output1_1 and use x lapw1 -p .)

On Wed, Jul 16, 2008 at 7:08 AM, Santhy Jaiker <k_santhy79 at yahoo.co.in> wrote:
> Dear user,
> SCF stops at lapw1 of the first or second cycle for larger jobs, but it
> always
> runs well for small jobs.  I am running a calculation for a unitcell having
> 12 atoms.
> Fe2Ti system space group=194 RMT=2.0 for Fe and Ti Gmax=14 RKmax=9
> k.point=5000
>
> ....................................................
> 1. I am using standalone workstation without quene.
> 2. Memory allocated for me is 2GB
> 3. Wien2k_08.2 version
> 4. no detailed information in the error file, just says" error in lapw1"
> 5. In dayfile, it mentions lapw1.def failed
> .................................................................
>
> I had gone through the mailing list.
>
> 1.  I checked the memory space allocation
>     It was already set to unlimted
> 2.  I tried with setting OMP-NUM-THREAD=1
>
> Still i am facing the same problem.
>
> Any suggestion will be appreciated
>
> Thanks in advance
>
> Regards,
> santhy
>  jaiker
>
>
>
>
>
> Regards,
> Santhy Jaiker
>
> Research Scholar
> Materials Thermodynamics Lab
> Department of Metallurgical and Materials Engineering
> Indian Institute of Technology Madras
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> India
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-- 
Laurence Marks
Department of Materials Science and Engineering
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Northwestern University
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email: L-marks at northwestern dot edu
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