[DFTB-Plus-User] Compiling Error
Marcelo Zimmer
mzsflores at gmail.com
Fri Jun 13 16:00:00 CEST 2008
Dear Dr. Balint and Benjamin,
Thank you for your quick answer. I could manage to compile the code with
both
LIB_BLAS = -lmkl
LIB_LAPACK = -lmkl_lapack -lmkl -lguide -lpthread
and
LIB_BLAS = -lmkl -lguide -lpthread
LIB_LAPACK = -lmkl_lapack
suggestions, however I couldn't compile when the flag -lmkl_em64t is
present. I don't think it's a problem, it's just to report which
combinations were successful and which were not.
Best regards,
Marcelo Zimmer
2008/6/13 Balint Aradi <balint.aradi at bccms.uni-bremen.de>:
> Dear Marcelo,
>
> as Ben already pointed out, the settings for the MKL 10 differs from
> those for the MKL 9 (which was the stable version of MKL when we
> released DFTB+ 1.0.1).
>
> On our x86_64 machines I ususally set in Makefile.user the variables
> LIB_BLAS and LIB_LAPACK the following way:
>
> LIB_BLAS = -lmkl -lguide -lpthread
> LIB_LAPACK = -lmkl_lapack
>
> That should very likely work for you as well.
>
>
> Best regards,
>
> Bálint
>
> --
> Dr. Bálint Aradi
> Bremen Center for Computational Materials Science, University of Bremen
> TAB A/3.10, Am Fallturm 1, 28359 Bremen, Germany, Tel.: +49 421 2187421
> http://www.bccms.uni-bremen.de/en/people/home/b_aradi/
>
>
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>
>
--
===================================================
Marcelo Zimmer S. Flores
(PhD Physics Student)
Address:
Universidade Estadual de Campinas - UNICAMP
Instituto de Fisica Gleb Wataghin - IFGW
Grupo de Solidos Organicos e Novos Materiais - GSONM
Departamento de Fisica Aplicada (DFA) - Room 61
Campinas - Sao Paulo - Brazil
13083-970
Caixa Postal: 6165
zimmer at ifi.unicamp.br
===================================================
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