[Wien] Question about WIEN2k_07 siteconfig_lapw compiling

Tue Aug 7 17:18:34 CEST 2007

Seems you gave the files *.a and not just the path in the ld.so.config file
/opt/intel/mkl/9.1.021/lib/em64t
should be enough.
don't forget to run ldconfig after you made the changes

Gerhard

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Von: wien-bounces at zeus.theochem.tuwien.ac.at im Auftrag von leestand12
Gesendet: Di 07.08.2007 16:59
An: wien at zeus.theochem.tuwien.ac.at
Betreff: [Wien] Question about WIEN2k_07 siteconfig_lapw compiling

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To Whom It May Concern : 

Hi. My name is Ki-joon Lee. And I am senior at Kwangwoon University in Seoul KOREA. 

My major is Electronic material engineering. Nowadays I am studying Wien2k.

The purpose of my calculations is to get DOS of materials.

I am using;

WIEN2k_07

CPU : AMD Athlon X2 3600+

RAM : 1 Gb

intel fortran : 10.0.023

intel c++ : 10.0.023

intel mkl : 9.1.021

OS : SUSE LINUX enterprise server 64-bit

specify compiler : ifort , icc

option : 

 current:FOPT:-FR -mp1 -w -prec_div -pad -ip -DINTEL_VML

current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML

current:LDFLAGS:$(FOPT) -L/opt/intel/fce/10.0.023/lib -L/opt/intel/mkl/9.1.021/lib/em64t -i-static -lguide_stats -lsvml -lpthread -pthread

current:DPARALLEL:'-DParallel'

current:R_LIBS:-L/opt/intel/mkl/9.1.021/lib/em64t -lmkl_lapack64 -lmkl_em64t -lguide -lguide_stats -lpthread

current:RP_LIBS:-L /usr/local/SCALAPACK -L /usr/local/BLACS/LIB -lpblas -lredist -ltools -lscalapack -lfblacs -lblacs -lmpi

profile.local (I make this file in /etc/) :

#

PATH="/opt/intel/fce/10.0.023/bin:${PATH}"

PATH="/opt/intel/idbe/10/0/023/bin:${PATH}"

export PATH

#

MANPATH="/opt/intel/idbe/10/0/023/man:${MANPATH}"

MANPATH="/opt/intel/fce/10.0.023/man:${MANPATH}"

export MANPATH

#

LD_LIBRARY_PATH="/opt/intel/mkl/9.1.021/lib/em64t:$LD_LIBRARY_PATH"

LD_LIBRARY_PATH="/opt/intel/fce/10.0.023/lib:$LD_LIBRARY_PATH"

export LD_LIBRARY_PATH

#

INCLUDE="/opt/intel/mkl/9.1.021/include:$INCLUDE"

export INCLUDE

#

INTEL_LICENSE_FILE="/opt/intel/licenses"

export INTEL_LICENSE_FILE

#

ld.so.config :

/usr/X11R6/lib64/Xaw3d

/usr/X11R6/lib64

/usr/lib64/Xaw3d

/usr/X11R6/lib/Xaw3d

/usr/X11R6/lib

/usr/lib/Xaw3d

/usr/x86_64-suse-linux/lib

/usr/local/lib

/opt/kde3/lib

/opt/gnome/lib

/lib64

/lib

/usr/lib64

/usr/lib

/usr/local/lib64

/opt/kde3/lib64

/opt/gnome/lib64

/opt/intel/fce/10.0.023/lib

/opt/intel/cce/10.0.023/lib

/opt/intel/mkl/9.1.021/lib/em64t/libmkl_em64t.a

/opt/intel/mkl/9.1.021/lib/em64t/libmkl_lapack64.a

include /etc/ld.so.conf.d/*.conf

compile errors :

Compile time errors (if any) were:

SRC_aim/compile.msg:make[1]: *** [aim] Error 1

SRC_aim/compile.msg:make: *** [real] Error 2

SRC_aim/compile.msg:make[1]: *** [aimc] Error 1

SRC_aim/compile.msg:make: *** [complex] Error 2

SRC_filtvec/compile.msg:make[1]: *** [filtvec] Error 1

SRC_filtvec/compile.msg:make: *** [real] Error 2

SRC_filtvec/compile.msg:make[1]: *** [filtvecc] Error 1

SRC_filtvec/compile.msg:make: *** [complex] Error 2

SRC_lapw1/compile.msg:make[1]: *** [lapw1] Error 1

SRC_lapw1/compile.msg:make: *** [real] Error 2

SRC_lapw1/compile.msg:make[1]: *** [lapw1c] Error 1

SRC_lapw1/compile.msg:make: *** [complex] Error 2

SRC_lapw2/compile.msg:make[1]: *** [lapw2] Error 1

SRC_lapw2/compile.msg:make: *** [real] Error 2

SRC_lapw2/compile.msg:make[1]: *** [lapw2c] Error 1

SRC_lapw2/compile.msg:make: *** [complex] Error 2

SRC_lapw7/compile.msg:make[1]: *** [lapw7] Error 1

SRC_lapw7/compile.msg:make: *** [real] Error 2

SRC_lapw7/compile.msg:make[1]: *** [lapw7c] Error 1

SRC_lapw7/compile.msg:make: *** [complex] Error 2

SRC_lapwdm/compile.msg:make[1]: *** [lapwdm] Error 1

SRC_lapwdm/compile.msg:make: *** [real] Error 2

SRC_lapwdm/compile.msg:make[1]: *** [lapwdmc] Error 1

SRC_lapwdm/compile.msg:make: *** [complex] Error 2

SRC_lapwso/compile.msg:make: *** [lapwso] Error 1

SRC_mini/compile.msg:make: *** [mini] Error 1

SRC_pairhess/compile.msg:make: *** [pairhess] Error 1

SRC_qtl/compile.msg:make: *** [qtl] Error 1

SRC_structeditor/compile.msg:make[1]: *** [ncmsymmetry] Error 1

SRC_structeditor/compile.msg:make: *** [all] Error 2

My problem is it cannot find -lmkl_lapack64.

- I am looking for this case at Mailing list in www.wien2k.at web site.

But, I can't solve this problem.

I will look forward to your reply. 

Thank you.

Sincerely,

Ki-joon Lee

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