[Wien] urgent help required

Peter Blaha pblaha at theochem.tuwien.ac.at
Mon Jan 30 09:51:29 CET 2012


No.

What about the answers to:

ls -alsrt *vector   (when you are in the tic subdirectory).

df

If everything looks "normal", we cannot help you from here. Eventually, you would need to
put some print statements into read_vec.f to see what is happening.

Otherwise maybe the problem comes form your ifort compiler. I cannot remember
if there were problems with

ifort compiler 10.1.008 and mkl library is 10.1.0.015

Please check the mailing list.

> now is this information is enough to solve that what is going wrong.
>
> thanks and Regards
> -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
> *From:* Peter Blaha <pblaha at theochem.tuwien.ac.at>
> *To:* A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
> *Sent:* Sunday, January 29, 2012 11:28 PM
> *Subject:* Re: [Wien] urgent help required
>
> We need more information:
>
> Is this error reproducible ? Does it occur again when you run another scf cycle (run_lapw) ?
>
> cat lapw1.def
> cat lapw2.def
>
> ls -alsrt *vector (or if you are using $SCRATCH: ls -alsrt $SCRATCH/*.vector )
>
> do you have enough disk space ( df) ?
>
>
> Am 30.01.2012 07:03, schrieb arqum hashmi:
>  >
>  >
>  > Dear wien2k users ,
>  > my system is Intel(R) Xeon(R) CPU E5440 @ 2.83GHz. i used suse linux.
>  > i used ifort compiler 10.1.008 and mkl library is 10.1.0.015.
>  > i installed the wien2k version 11 succesfully.
>  > after installing succesfully, i run the example of TiC. when i run the Scf cycle it gives this error below.
>  >
>  > LAPW0 END
>  > LAPW1 END
>  > forrtl: severe (174): SIGSEGV, segmentation fault occurred
>  > Image PC Routine Line Source
>  > lapw2 0812197B Unknown Unknown Unknown
>  > lapw2 0809F9CF read_vec_ 99 read_vec_tmp_.F
>  > lapw2 0807FB2E l2main_ 632 l2main_tmp_.F
>  > lapw2 0809344B MAIN__ 564 lapw2_tmp_.F
>  > lapw2 0804A491 Unknown Unknown Unknown
>  > libc.so.6 5620D8AC Unknown Unknown Unknown
>  > lapw2 0804A3D1 Unknown Unknown Unknown
>  >
>  >> stop error
>  >
>  > please tell me why this error occured and whats its solution. i will be very thankful to you.
>  > thanks and regards
>  > arqum hashmi
>  >
>  >
>  >
>  >
>  >
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>
> --
>
> P.Blaha
> --------------------------------------------------------------------------
> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
> Phone: +43-1-58801-165300 FAX: +43-1-58801-165982
> Email: blaha at theochem.tuwien.ac.at <mailto:blaha at theochem.tuwien.ac.at> WWW: http://info.tuwien.ac.at/theochem/
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>
>
>
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-- 

                                       P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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