[CPMD-list] CPMD-list IFC compilation under SuSE 8.0

[Christian Tuma]

Hi Alessandro,

you may have to build LAPACK by yourself. You can get it from

http://www.netlib.org/lapack

I would recommend that you also build an optimized BLAS ("ATLAS"):

http://math-atlas.sourceforge.net

Follow the instructions given there to turn your (old) LAPACK into
a (new) LAPACK containing the optimized ATLAS routines. (The liblapack.a
contained in ATLAS is incomplete.)

Don't forget to include the path to your libraries with the "-L" option
in your Makefile.

Good luck,
Christian.


On Fri, Nov 22, 2002 at 01:11:42PM +0100, Alessandro Contini wrote:
> Hi,
> I'm trying to compile CPMD using IFC (compiler6) under SuSE 8.0, but I get
> an error:
> 
> ........cpmd_ext_pot_f77.o  sysdepend.o shmemory.o -llapack -lf77blas
> -latlas -Vaxlib
> ld: cannot find -llapack
> make: *** [cpmd.x] Error 1
> 
> It look like it does not find libraries -llapack -lf77blas -latlas -Vaxlib
> 
> Does somebody can tell me where those libraries are?
> Thanks
> 
> Alessandro
> 
> Dott. Alessandro Contini
> Istituto di Chimica Organica "Alessandro Marchesini"
> Facoltà di Farmacia Università degli Studi di Milano
> Via Venezian, 21 20133 Milano
> Tel. +390250314480  Fax +390250314476
> http://users.unimi.it/istchimorg/pagconthtm.htm
> 
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-- 
Christian Tuma             Humboldt-Universitaet Berlin
ct at chemie.hu-berlin.de     Arbeitsgruppe Quantenchemie (Prof. Sauer)
phone: +49-30-20937140     Brook-Taylor-Str. 2, 12489 Berlin, GERMANY
fax:   +49-30-20937136     http://www.chemie.hu-berlin.de/ag_sauer