[CPMD-list] cannot find -llapack-ifc

[Axel Kohlmeyer]

On Thu, 3 May 2007, m_ariesto wrote:

AM> Dear All, 
AM> 
AM> I am a Newbie,
AM> I failed to compile CPMD package. platform of my computer is PC,linux, 
AM> Pentium 4, Intel Fortran Compiler.
AM> I typed  "./mkconfig.sh PC-IFC-P4 > Makefile "
AM> after typing "make" error message appeared:
AM>  -----------------
AM> ...
AM> ov.o shop_adds.o  sysdepend.o    -llapack-ifc -lblas-ifc -latlas-ifc -Vaxlib
AM> ld: cannot find -llapack-ifc
AM> make: *** [cpmd.x] Error 1
AM>  -------------------
AM> could anyone give me hint/suggestion? 

dear ariesto,

please note, that the mkconfig.sh simply assembles 
a makefile from templates. since almost no linux 
machine looks alike (too many compiler, BLAS/LAPACK
library combinations around), it so happened, that
the template does not match your machine (it was actually
taken from a rather unusual configuration).

for an intel linux fortran setup with p4, you may
want to try out the intel mkl for blas/lapack.

the best way to link with it is to change in the makefile:

FFLAGS = -c -O2 -unroll -warn all -tpp7 -pc64
LFLAGS = -L/opt/intel/mkl/9.0/lib/32/ -lmkl_lapack -lmkl_ia32
LD = ifort -i-static -openmp -Wl,--allow-multiple-definition

(if you have a different version of mkl or installed it into
a different directory, you have to change the path after -L )

good luck,
   axel.

AM> 
AM> Best reagards, 
AM> 
AM> Ariesto 
AM> 
AM> _______________________________________________
AM> CPMD-list mailing list
AM> CPMD-list at cpmd.org
AM> http://cpmd.org/mailman/listinfo/cpmd-list
AM> 

-- 
=======================================================================
Axel Kohlmeyer   akohlmey at cmm.chem.upenn.edu   http://www.cmm.upenn.edu
   Center for Molecular Modeling   --   University of Pennsylvania
Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323
tel: 1-215-898-1582,  fax: 1-215-573-6233,  office-tel: 1-215-898-5425
=======================================================================
If you make something idiot-proof, the universe creates a better idiot.