[Wien] Installing Wien2k_08 on Mac: library not found for-lmkl_lapack64

[Ivas Toni]

Dear Bill,
 
First stupid suggestion, did you try to see if libmkl_lapack64.so is in
/opt/intel/mkl/Current/Libraries/em64t (probably it is :))).
I would try to play with compile sentence which you have in the
compile.msg, for example you can link the library directly:
 
ifort -o ./aimc moduls.o charge.o  gbass.o  gener.o  aim.o main1.o
outin.o  radial.o  reduc.o  rsur
.o rotat.o  rotate.o  rotato.o  rotdef1.o sternb.o sum.o  vnorm.o  ylm.o
dtylm.o  sumd.o  grhosphe.
o dradial.o  gen_change.o  rotat_back.o  rotate_back.o gen_brav.o
interst.o  sphere.o  init.o  ones
tep.o rsurf.o  gauleg.o  critic.o  surf.o integrho.o follow.o interp.o
cputim.o jacobi.o ludcmp.o sp
line.o doit.o dtdtylm.o sumdd.o hrhosphe.o matprod.o readcs.o dipole.o
rho.o cossin.o  intlib.o davi
nt.o d1mach.o sortag.o follown.o SplineFit.o CheckCSpline.o  -FR -mp1 -w
-prec_div -pc80 -pad -ip -D
INTEL_VML -L/opt/intel/mkl/Current/Libraries/em64t
-l(or)-L/opt/intel/mkl/Current/Libraries/em64t/libmkl_lapack64.so
-lpthread -lmkl_em64t -lguide -lvm
l -pthread
 
and see what compiler or loader returns as error, otherwise I think your
compile sentence looks fine, the warning :
ipo: warning #11023: file format not recognized for cputim.o
ipo: warning #11023: file format not recognized for d1mach.o
Probably comes from that you have compiled cputim and d1mach with c
compiler and the ifort don't know how to link them,
look at manual of ifort for your platform and see how to link c
object-files.
 
Regards,
Toni

________________________________

From: wien-bounces at zeus.theochem.tuwien.ac.at
[mailto:wien-bounces at zeus.theochem.tuwien.ac.at] On Behalf Of A Bill
Sent: Thursday, January 31, 2008 3:50 AM
To: wien at zeus.theochem.tuwien.ac.at
Subject: [Wien] Installing Wien2k_08 on Mac: library not found
for-lmkl_lapack64


Dear Wien users, 

I am trying to install Wien2k 08 for the first time on my MacPro 8-core
but encounter a problem with the library for lmkl_lapack64. Here is what
I did: (sorry if there is too much information...)

1) The formatting of my disk is case-sensitive and so I do not encounter
the problems others had with that issue.

2) I use the latest ifort compiler + mkl 10.1.007.

3) I therefore chose option J "Linux Intel ifort 9 or 10 " and had to
specify that mkl is not under /opt/intel but /Library/Framework and had
to replace 'find /opt -name 'libmkl*' with 'find -L /opt -name 'libmkl*'

4) I changed the flag as follows:
Recommended options for system linuxif8 are:
     Compiler options:        -FR -mp1 -w -prec_div -pc80 -pad -ip
-DINTEL_VML
     Linker Flags:            $(FOPT) -L/opt/intel/mkl/9.0/lib/em64t
-lpthread
     Preprocessor flags:      '-DParallel'
     R_LIB (LAPACK+BLAS):     -lmkl_lapack64 -lmkl_em64t -lguide -lvml
-pthread

Current settings:
 O   Compiler options:        -FR -mp1 -w -prec_div -pc80 -pad -ip
-DINTEL_VML
 L   Linker Flags:            $(FOPT)
-L/opt/intel/mkl/Current/Libraries/em64t -lpthread
 P   Preprocessor flags       '-DParallel'
 R   R_LIB (LAPACK+BLAS):     -lmkl_lapack64 -lmkl_em64t -lguide -lvml
-pthread
 
5) It is not a shared memory, no MPI, no Scalapack (I don't quite
understand that one...)

6) I didn't change the parameters

7) I try compiling all programs. That's where I get into trouble...

compile.msg in all SRC_* have an error related to the library for
-lmkl_lapack64 not found. For example, the compile.msg in SRC_aim has
the following last lines:

ifort -o ./aimc moduls.o charge.o  gbass.o  gener.o  aim.o main1.o
outin.o  radial.o  reduc.o  rsur
.o rotat.o  rotate.o  rotato.o  rotdef1.o sternb.o sum.o  vnorm.o  ylm.o
dtylm.o  sumd.o  grhosphe.
o dradial.o  gen_change.o  rotat_back.o  rotate_back.o gen_brav.o
interst.o  sphere.o  init.o  ones
tep.o rsurf.o  gauleg.o  critic.o  surf.o integrho.o follow.o interp.o
cputim.o jacobi.o ludcmp.o sp
line.o doit.o dtdtylm.o sumdd.o hrhosphe.o matprod.o readcs.o dipole.o
rho.o cossin.o  intlib.o davi
nt.o d1mach.o sortag.o follown.o SplineFit.o CheckCSpline.o  -FR -mp1 -w
-prec_div -pc80 -pad -ip -D
INTEL_VML -L/opt/intel/mkl/Current/Libraries/em64t -lpthread
-lmkl_lapack64 -lmkl_em64t -lguide -lvm
l -pthread
ipo: warning #11023: file format not recognized for cputim.o
ipo: warning #11023: file format not recognized for d1mach.o
ld: library not found for -lmkl_lapack64
make[1]: *** [aimc] Error 1
make: *** [complex] Error 2


Any help on the question is appreciated.

Regards,
Andreas





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