[Wien] error during compilation (siteconfig_lapw)

shamik chakrabarti shamikphy at gmail.com
Tue May 31 18:26:44 CEST 2011 

Dear Dr. Gerhard Fecher, Dr. Ramkumar Thapa and wien2k users,

                      We have tried to install the compilers come in same
package in the laptop but always get failed to install mkl. Then we have
downloaded the above mentioned version of mkl (composerxe-2011.4.191) and
able to install it in this system. We have previously installed fc and mkl
under home directory in other systems and we have found no problems there.
It is in this laptop only we are facing problem. Sir is anything wrong in
the given compiler options?..... we can guess the problem is coming from the
two links below

*(1) LDFLAGS:-L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel
-Bstatic -lguide -lguide_stats -lsvml -Bdynamic -lpthread*
*
*
*(2) R_LIBS:-L/home/avijitghosh/intel/composerxe-2011.4.191/mkl/lib/ia32
-Bstatic -lmkl_lapack -lmkl_ia32 -Bdynamic -lpthread*
*
*
We are still getting the errors and not able to figure it out. Any response
in this regard will be appreciated. Thanking you,

with best regards,

Shamik Chakrabarti

2011/5/31 Ramkumar Thapa <r.k.thapa at gmail.com>

> Dear Dr. Gerhard,
> You are right but then usually compilers like ifc and mkl's are installed
> under root only.
> R.K.Thapa
> ===========
>
> On Tue, May 31, 2011 at 1:00 PM, Gerhard Fecher <fecher at uni-mainz.de>wrote:
>
>> Thats a matter of taste,
>> there is no need that the compiler is in a special directory,
>> you just have to ensure that your environment variables are set correctly.
>>
>> Ciao
>> Gerhard
>>
>> ====================================
>> Dr. Gerhard H. Fecher
>> Institut of Inorganic and Analytical Chemistry
>> Johannes Gutenberg - University
>> 55099 Mainz
>> ________________________________________
>> Von: wien-bounces at zeus.theochem.tuwien.ac.at [
>> wien-bounces at zeus.theochem.tuwien.ac.at]&quot; im Auftrag von
>> &quot;Ramkumar Thapa [r.k.thapa at gmail.com]
>> Gesendet: Dienstag, 31. Mai 2011 09:24
>> Bis: A Mailing list for WIEN2k users
>> Betreff: Re: [Wien] error during compilation (siteconfig_lapw)
>>
>> Dear Shamik,
>> Your options :
>> current:LDFLAGS:-L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel
>> -Bstatic -lguide -lguide_stats -lsvml -Bdynamic -lpthread
>> current:DPARALLEL:'-DParallel'
>> current:R_LIBS:-L/home/avijitghosh/intel/composerxe-2011.4.191/mkl/lib/ia32
>> -Bstatic -lmkl_lapack -lmkl_ia32 -Bdynamic -lpthread
>> ------ in red should be under root NOT in /home/avijitghosh.
>> While installing your compiler and mkl files, you must have been under
>> root.
>> Best wishes,
>> R.K.Thapa
>> Mizoram University
>> ====================
>> 2011/5/31 shamik chakrabarti <shamikphy at gmail.com<mailto:
>> shamikphy at gmail.com>>
>>
>> Dear Dr. Peter Blaha Sir and Wien2k users,
>>
>>                We are trying to install wien2k in a COMPAQ Laptop having
>> core2duo processor. During siteconfig_lapw we have received the following
>> error :
>> 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_cif2struct/compile.msg:make: *** [cif2struct] Error 1
>> 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_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_spacegroup/compile.msg:make: *** [spacegroup] Error 1
>> SRC_structeditor/SRC_ncmsymmetry/compile.msg:make: *** [ncmsymmetry] Error
>> 1
>> SRC_structeditor/SRC_structgen/compile.msg:make: *** [structgen] Error 1
>>
>> We check accordingly compile.msg files and are giving relevant area for
>> your consideration:
>>
>> CheckCSpline.f(162): (col. 17) remark: LOOP WAS VECTORIZED.
>> CheckCSpline.f(173): (col. 17) remark: LOOP WAS VECTORIZED.
>> CheckCSpline.f(1): (col. 18) remark: checkcspline_ has been targeted for
>> automatic cpu dispatch.
>> ifort -o ./aim 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
>>  onestep.o rsurf.o  gauleg.o  critic.o  surf.o integrho.o follow.o interp.o
>> cputim.o jacobi.o ludcmp.o spline.o doit.o dtdtylm.o sumdd.o hrhosphe.o
>> matprod.o readcs.o dipole.o rho.o cossin.o  intlib.o davint.o d1mach.o
>> sortag.o follown.o SplineFit.o CheckCSpline.o
>> -L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel -Bstatic -lguide
>> -lguide_stats -lsvml -Bdynamic -lpthread
>> -L/home/avijitghosh/intel/composerxe-2011.4.191/mkl/lib/ia32 -Bstatic
>> -lmkl_lapack -lmkl_ia32 -Bdynamic -lpthread
>> follown.o: In function `maxeigen_.J':
>> follown.f:(.text+0xcf): undefined reference to `dsyev_'
>> follown.o: In function `maxeigen_.A':
>> follown.f:(.text+0x1e3): undefined reference to `dsyev_'
>> follown.o: In function `stepper_.J':
>> follown.f:(.text+0x320): undefined reference to `dsyev_'
>> follown.o: In function `stepper_.A':
>> follown.f:(.text+0x61f): undefined reference to `dsyev_'
>> follown.o: In function `follown_.J':
>> follown.f:(.text+0xe35): undefined reference to `dsyev_'
>> follown.o:follown.f:(.text+0x1adb): more undefined references to `dsyev_'
>> follow
>> make[1]: *** [aim] Error 1
>> make[1]: Leaving directory
>> `/home/avijitghosh/Desktop/Wien2K_30-12-08/WIEN2k/SRC_aim'
>> make: *** [real] Error 2
>> if [ -f .real ]; then \
>>  make clean; \
>>
>> Below we are giving the compiler options:
>>
>> current:FOPT:-FR -mp1 -w -prec_div -pad -ip -O3 -axTW -traceback
>> current:FPOPT:$(FOPT)
>> current:LDFLAGS:-L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel
>> -Bstatic -lguide -lguide_stats -lsvml -Bdynamic -lpthread
>> current:DPARALLEL:'-DParallel'
>> current:R_LIBS:-L/home/avijitghosh/intel/composerxe-2011.4.191/mkl/lib/ia32
>> -Bstatic -lmkl_lapack -lmkl_ia32 -Bdynamic -lpthread
>> current:RP_LIBS:-lmkl_intel_lp64 -lmkl_scalapack_lp64 -lmkl_blacs_lp64
>> -lmkl_sequential -lmkl_em64t
>>
>> any response in this regard will be very helpful for us. Thanks in
>> advance.
>>
>> with best regards,
>>
>>
>> --
>> Shamik Chakrabarti
>> Research Scholar
>> Dept. of Physics & Meteorology
>> Material Processing & Solid State Ionics Lab
>> IIT Kharagpur
>> Kharagpur 721302
>> INDIA
>>
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>>
>>
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>
>
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>


-- 
Shamik Chakrabarti
Research Scholar
Dept. of Physics & Meteorology
Material Processing & Solid State Ionics Lab
IIT Kharagpur
Kharagpur 721302
INDIA
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