[Wien] error during compilation (siteconfig_lapw)
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model, you like to use The composer should come with IFORT and MKL, so I do not see any reason why you use an old outdated fc 10.1 version.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]quot; im Auftrag von quot;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.commailto: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.demailto: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.atmailto:wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.atmailto:wien-bounces at zeus.theochem.tuwien.ac.at]quot; im Auftrag von quot;Ramkumar Thapa [r.k.thapa at gmail.commailto: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.commailto:shamikphy at gmail.commailto:shamikphy at gmail.commailto: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
[Wien] error during compilation (siteconfig_lapw)
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 -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110531/f55a9855/attachment-0001.htm
[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 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 ___ Wien mailing list Wien at zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien -- next part
[Wien] error during compilation (siteconfig_lapw)
why do you try to mix libraries from completely different compiler/mkl versions instead of using ifort and mkl that come in one package ? check http://software.intel.com/en-us/articles/intel-mkl-link-line-advisor/ for the correct mkl settings 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;shamik chakrabarti [shamikphy at gmail.com] Gesendet: Dienstag, 31. Mai 2011 08:57 Bis: A Mailing list for WIEN2k users Betreff: [Wien] error during compilation (siteconfig_lapw) 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
[Wien] error during compilation (siteconfig_lapw)
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.commailto: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
[Wien] error during compilation (siteconfig_lapw)
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.commailto: 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
[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 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.dewrote: 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.commailto: 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
