[Wien] WIEN2k_14

Laurence Marks L-marks at northwestern.edu
Wed Sep 17 16:03:11 CEST 2014


Please check to see if your Scalapack includes the Version 2.0.X routines,
see http://netlib.org/scalapack/scalapack-2.0.0 . Older versions may not
have the robust representation in them. It may be simply a case of using a
newer ifort mkl or scalapack.

On Wed, Sep 17, 2014 at 8:48 AM, Osama Yassin <oyassin63 at gmail.com> wrote:

>  Dear Prof Blaha and all
>
>  Earlier I complied Wien2k-13.1 without any problem. But, when compiling
> Wien2k 14.1 everything went well except "lapw1_mpi". I got the following
> message
>
> "seclr4.o: In function `seclr4_':
> seclr4_tmp_.F:(.text+0x6bb): undefined reference to `pdsyevr_'
> seclr4_tmp_.F:(.text+0xd50): undefined reference to `pdsyevr_'
> make[1]: *** [lapw1_mpi] Error 1
> make[1]: Leaving directory `/home/osama/Wien2k-14/SRC_lapw1'
> make: *** [rp] Error 2"
>
>  The final results tells:
> Copying programs
>   SRC_lapw1/lapw1
>   SRC_lapw1/lapw1c
>   SRC_lapw1/lapw1c_mpi
>
> done.
>
> Compile time errors (if any) were:
> SRC_lapw1/compile.msg:make[1]: *** [lapw1_mpi] Error 1
> SRC_lapw1/compile.msg:make: *** [rp] Error 2
>
>  How can I solve this?
>
>  ​O A Yassin​
>
>


-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
Corrosion in 4D: MURI4D.numis.northwestern.edu
Co-Editor, Acta Cryst A
"Research is to see what everybody else has seen, and to think what nobody
else has thought"
Albert Szent-Gyorgi
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