[Wien] SECLR errors (was "about compile)

[Michael Gurnett]

Recents tests have lead me to the belief that it may be the connections
between the computers that is causing the trouble (thanks for pointing this
possibility out). So I was wondering if a linux expert (or at least someone
who has a stable system) could make some suggestions if the following that I
have done is incorrect to setup nfs.

On the server
Edited the file /etc/exports
added the line

/home/dftuser/Wien2k

on the clients, edited /etc/fstab

server:/home/dftuser/Wien2k    /home/dftuser/Wien2k  nfs timeo=20,intr


This does not work straight off (a small fault on the server) so after boot
I run the ./nfs restart and ./netfs restart scripts.

Am I doing this correctly?

Torsten, where are these timing parameters you mentioned? Maybe I could have
a look at those as well

Thanks

Michael
----- Original Message ----- 
From: "Michael Gurnett" <michael.gurnett at kau.se>
To: <wien at zeus.theochem.tuwien.ac.at>
Sent: Sunday, January 18, 2004 5:44 PM
Subject: [Wien] SECLR errors (was "about compile)


> Was running mini on the new cluster. After 9 iterations I got a lapw1
> error.
>
>
> Cholesky INFO =         5061
>  'SECLR4' - POTRF (Scalapack/LAPACK) failed.
>
> This occured after a dramatic change in charge distance
>
> :DIS  :  CHARGE DISTANCE       0.0008871
> :DIS  :  CHARGE DISTANCE       3.3156765  <<==
>
> If I use lapw_clean and remove the broyden files after this error it
> doesn't help. It
> will always crash in the first iteration unless ~I delete the entire
> folder except struct
> file and start again.My mixing factor is 0.1, and the same calculation
> is running on a
> different system without a problem. What causes these SECLR errors
>
> The new system is running redhat 7.3 with ifc7.1 with mkl6.0 mkl_ia32
> lib linked using -static
>
>
> Hope someone has some idea
>
> Michael
>
> ps sorry for posting under the wrong subject before
>
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