[Wien] compile errors in wien2k installation

Laurence Marks L-marks at northwestern.edu
Thu Jan 19 04:57:54 CET 2012 

Did you read compile.msg. Please read it.

---------------------------
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu 1-847-491-3996
"Research is to see what everybody else has seen, and to think what nobody
else has thought"
Albert Szent-Gyorgi
 On Jan 18, 2012 9:03 PM, "bruce.tian" <brucetian8080 at gmail.com> wrote:

> Dear Prof. Blaha and Gavin:
>
> Thanks for your reply!
>
> In my .bashrc file there is ' source
> /opt/intel/composer_xe_2011_sp1.8.273/bin/compilervars.sh ia32' . When I
> install WIEN2k_11.1 which complains the variable {MKL_TARGET_ARCH} can not
> be found. So I added 'export MKL_TARGET_ARCH=ia32' in the .bashrc file.
> This time at the beginning of ./siteconfig_lapw wien2k can find the
> MKL_TARGET_ARCH. However when I compile the errors still come out as when
> MKL_TARGET_ARCH can not be found.
>
> My linux system is Ubuntu 10.04 LTS with 32 bit. I successfully compiled
> wien2k 10 with Composerxe_2011 with version 12.01.
>
> My compile options are as following:
>
> Recommended options for system linuxifc are:
>      Compiler options:        -FR -mp1 -w -prec_div -pc80 -pad -ip
> -DINTEL_VML -traceback
>      Linker Flags:            $(FOPT) -L$(MKLROOT)/lib/$(MKL_TARGET_ARCH)
> -pthread
>      Preprocessor flags:      '-DParallel'
>      R_LIB (LAPACK+BLAS):     -lmkl_lapack95_lp64 -lmkl_intel_lp64
> -lmkl_intel_thread -lmkl_core -openmp -lpthread
>
> Current settings:
>  O   Compiler options:        -FR -mp1 -w -prec_div -pc80 -pad -ip
> -DINTEL_VML -traceback
>  L   Linker Flags:            $(FOPT) -L$(MKLROOT)/lib/$(MKL_TARGET_ARCH)
> -pthread
>  P   Preprocessor flags       '-DParallel'
>  R   R_LIB (LAPACK+BLAS):     -lmkl_lapack95 -lmkl_intel
> -lmkl_intel_thread -lmkl_core -lpthread
>
> The reported errors and warnings still are:
>
>   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_dipan/compile.msg:make: *** [dipan] Error 1
> 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_lapw0/compile.msg:make[1]: *** [lapw0] Error 1
> SRC_lapw0/compile.msg:make: *** [seq] 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_mixer/compile.msg:make: *** [mixer] 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
> SRC_vecpratt/compile.msg:make[1]: *** [vecpratt] Error 1
> SRC_vecpratt/compile.msg:make: *** [real] Error 2
> SRC_vecpratt/compile.msg:make[1]: *** [vecprattc] Error 1
> SRC_vecpratt/compile.msg:make: *** [complex] Error 2
> SRC_structeditor/SRC_ncmsymmetry/compile.msg:make: *** [ncmsymmetry] Error
> 1
>
> WARNING: no executable found in SRC_aim. Check compile.msg in this
> directory
>   SRC_arrows/arrows
>   SRC_broadening/broadening
>   SRC_cif2struct/cif2struct
>   SRC_clmaddsub/clmaddsub
>   SRC_clmcopy/clmcopy
> WARNING: no executable found in SRC_dipan. Check compile.msg in this
> directory
>   SRC_dstart/dstart
>   SRC_eosfit/eosfit
>   SRC_eosfit6/eosfit6
> WARNING: no executable found in SRC_filtvec. Check compile.msg in this
> directory
>   SRC_initxspec/initxspec
>   SRC_irrep/irrep
>   SRC_joint/joint
>   SRC_kgen/kgen
>   SRC_kram/kram
> WARNING: no executable found in SRC_lapw0. Check compile.msg in this
> directory
> WARNING: no executable found in SRC_lapw1. Check compile.msg in this
> directory
> WARNING: no executable found in SRC_lapw2. Check compile.msg in this
> directory
>   SRC_lapw3/lapw3
>   SRC_lapw3/lapw3c
>   SRC_lapw5/lapw5
>   SRC_lapw5/lapw5c
> WARNING: no executable found in SRC_lapw7. Check compile.msg in this
> directory
> WARNING: no executable found in SRC_lapwdm. Check compile.msg in this
> directory
> WARNING: no executable found in SRC_lapwso. Check compile.msg in this
> directory
>   SRC_lcore/lcore
>   SRC_lorentz/lorentz
>   SRC_lstart/lstart
> WARNING: no executable found in SRC_mini. Check compile.msg in this
> directory
> WARNING: no executable found in SRC_mixer. Check compile.msg in this
> directory
>   SRC_nn/nn
>   SRC_optic/optic
>   SRC_optic/opticc
>   SRC_optimize/optimize
>   SRC_orb/orb
> WARNING: no executable found in SRC_pairhess. Check compile.msg in this
> directory
> WARNING: no executable found in SRC_qtl. Check compile.msg in this
> directory
>   SRC_reformat/reformat
>   SRC_sgroup/sgroup
>   SRC_spacegroup/spacegroup
>   SRC_spaghetti/spaghetti
>   SRC_sumpara/sumpara
>   SRC_supercell/supercell
>   SRC_symmetry/symmetry
>   SRC_symmetso/symmetso
>   SRC_telnes3/telnes3
>   SRC_tetra/tetra
>   SRC_txspec/txspec
> WARNING: no executable found in SRC_vecpratt. Check compile.msg in this
> directory
>   SRC_w2web/w2web
> cp: `SRC_w2web/w2web' and `/home/tianfeng/WIEN2k/w2web' are the same file
> WARNING: no executable found in SRC_structeditor/SRC_ncmsymmetry. Check
> compile.msg in this directory
>   SRC_structeditor/SRC_readwrite/readwrite
>   SRC_structeditor/SRC_struct2mol/struct2mol
>   SRC_structeditor/SRC_structgen/structgen
>
>
>
> Thanks!
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
>
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