[Wien] error during compilation (siteconfig_lapw)
shamik chakrabarti
shamikphy at gmail.com
Wed Jun 1 11:43:28 CEST 2011
Dear Dr. Gerhard Fecher Sir,
Thank you for your reply. I will follow your
suggestion and use same version of IFORT and MKL.
with best regards,
Shamik Chakrabarti
On Wed, Jun 1, 2011 at 1:00 PM, Gerhard Fecher <fecher at uni-mainz.de> wrote:
> I guess you mix arbitrarily options from different Versions,
> why don't you use the suggestions of Intel
> http://software.intel.com/en-us/articles/intel-mkl-link-line-advisor/
> it is hard to estimate which options you need, without knowing for example
> what memory model,
> you like to use
>
> The composer should come with IFORT and MKL, so I do not see any reason why
> you use an old
> outdated fc 10.1 version.
>
> if you use a 32 bit system (why to use the 32 bit version on a modern core
> duo processor at all ?)
> then I am sure that the next error message that you have will be a
> segmentation fault
> (search this forum and you will find the questions and answers very often)
>
> 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]" im Auftrag von "shamik
> chakrabarti [shamikphy at gmail.com]
> Gesendet: Dienstag, 31. Mai 2011 18:26
> Bis: A Mailing list for WIEN2k users
> Betreff: Re: [Wien] error during compilation (siteconfig_lapw)
>
> 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<mailto: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
> <mailto: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<mailto:
> wien-bounces at zeus.theochem.tuwien.ac.at> [
> wien-bounces at zeus.theochem.tuwien.ac.at<mailto:
> wien-bounces at zeus.theochem.tuwien.ac.at>]" im Auftrag von
> "Ramkumar Thapa [r.k.thapa at gmail.com<mailto: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><mailto: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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> Wien at zeus.theochem.tuwien.ac.at>>
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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
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
--
Shamik Chakrabarti
Research Scholar
Dept. of Physics & Meteorology
Material Processing & Solid State Ionics Lab
IIT Kharagpur
Kharagpur 721302
INDIA
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