[Wien] no executable found in SRC_*
Peter Blaha
pblaha at theochem.tuwien.ac.at
Tue Nov 18 08:58:11 CET 2008
Now you told us, that your "supercomputer" is an IBM RS6000 !!!!
So why are you using "generic" ???
There is an IBM-AIX option (which may need adaptation,
since we don't have access to your specific installation), but it should be
a good starting point.
Furthermore, using -lblas_lapw instead of the highly optimized ESSL-library
would make the code as slow as using and old Pentium-III processor, but not a
"supercomputer".
Typically the problem could be that you are not using the 64-bit option, but
when using the AIX template it should be a step into the proper direction.
Often, "supercomputers" have very special compiler/library installations and
often only your support people can help for compilation problems.
Donghui Guo schrieb:
> Dear Prof. Blaha,
>
> I got many warnings in compile.msg of lapw1 like following.
>
> "501-245 Warning: Hard ulimit has been reduced to less than RLIM_INFINITY. There may not be enough space to complete the compilation."
>
> I searched maillist but got nothing. Could you please give me some suggestion?
>
> #############################################################
> My condition:
> Supercomputer:IBM RS6000
> Generic to specify the system
> Compiler: xlf90 for Fortran and xlC (gcc was also tried) for C
> Memory:shared
> Compile option
> Recommended options for system generic are:
> Compiler options: -O
> Linker Flags: -L../SRC_lib
> Preprocessor flags: '-DParallel'
> R_LIB (LAPACK+BLAS): -llapack_lapw -lblas_lapw
>
> Current settings:
> O Compiler options: -O
> L Linker Flags: -L../SRC_lib
> P Preprocessor flags '-DParallel'
> R R_LIB (LAPACK+BLAS): -llapack_lapw -lblas_lapw
>
>
> Best regards,
>
> Yours
> Donghui Guo
> 2008-11-18
>
>
>
> ======= At 2008-11-15, 19:52:10 you wrote: =======
>
>> You must change into the individual SRC_* subdirectories and check the
>> file compile.msg
>> There you should find the reason why it could not compile/link the programs.
>>
>> Donghui Guo schrieb:
>>> Dear Prof. Blaha and all,
>>>
>>> Recently, I am trying to run WIen2k on supercomputer.
>>> The compiler f90 and gcc were used.
>>> For "specify a system", I chose "Generic" and got some information about enviroment.
>>> "
>>> Selection: g
>>> CC gcc
>>> DPARALLEL '-DParallel'
>>> FC f90
>>> FOPT -O
>>> FPOPT -O
>>> LDFLAGS -L../SRC_lib
>>> MPF f90
>>> MPIRUN ()
>>> RP_LIBS ()
>>> R_CC gcc
>>> R_DPARALLEL '-DParallel'
>>> R_FC f90
>>> R_FOPT -O
>>> R_FPOPT -O
>>> R_LDFLAGS -L../SRC_lib
>>> R_LIBS (-llapack_lapw -lblas_lapw)
>>> R_MPF f90
>>> R_MPIRUN (mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_)
>>> R_RP_LIBS ()
>>> R_R_LIBS (-llapack_lapw -lblas_lapw)
>>> argv ()
>>> bin /home/c20321/wien2k
>>> c77 gcc
>>> counter 0
>>> cpfile generic
>>> cwd /home/c20321/wien2k
>>> f77 f90
>>> home /home/c20321
>>> instdate (Fri Nov 14 17:42:18 JST 2008)
>>> logfile :log
>>> name siteconfig
>>> next system
>>> nextlist (intro system compiler compopts2 parallel dimension recompile perl bye)
>>> oldsystem generic
>>> path (. /opt/ofort90/bin /opt/optc/bin /opt/optscxx/bin /usr/lpp/LoadL/full/bin /usr/bin /usr/local/bin /usr/sbin /usr/ucb /usr/bin/X11 /sbin /usr/java14/jre/bin /usr/java14/bin /usr/vac/bin /usr/vacpp/bin /usr/lpp/mmfs/bin /opt/ansys_inc/v100/ansys/bin /opt/cfx/CFX-10.0/bin /opt/common/Fluent.Inc/bin /opt/common/mopac/mopac2002/bin /opt/ofort90/lbin /opt/optc/lbin /opt/ofort90/bin /opt/optc/bin /opt/optscxx/bin /usr/lpp/LoadL/full/bin /usr/local/bin /usr/bin /etc /usr/sbin /usr/ucb /usr/bin/X11 /sbin /usr/java14/jre/bin /usr/java14/bin /usr/vac/bin /usr/vacpp/bin /usr/lpp/mmfs/bin)
>>> recompile
>>> remote ssh
>>> select g
>>> shell /usr/bin/csh
>>> status 0
>>> system generic
>>> term xterm
>>> test (0 0 0)
>>> user c20321
>>> version (WIEN2k_08.3 (Release 18/9/2008))
>>> System generic is already selected
>>> "
>>>
>>> After I compiled the program, no error but many warnings were gotten.
>>>
>>>
>>>
>>> "Copying programs
>>> WARNING: no executable found in SRC_afminput. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_aim. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_broadening. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_cif2struct. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_clmaddsub. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_clmcopy. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_dstart. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_eosfit. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_eosfit6. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_filtvec. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_initelnes. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_initxspec. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_irrep. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_joint. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_kgen. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_kram. Check compile.msg in this directory
>>> 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
>>> WARNING: no executable found in SRC_lapw3. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_lapw5. Check compile.msg in this directory
>>> 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
>>> WARNING: no executable found in SRC_lcore. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_lib. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_lorentz. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_lstart. Check compile.msg in this directory
>>> 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
>>> WARNING: no executable found in SRC_nn. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_optic. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_optimize. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_orb. Check compile.msg in this directory
>>> 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
>>> WARNING: no executable found in SRC_reformat. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_sgroup. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_spacegroup. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_spaghetti. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_structeditor. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_sumpara. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_supercell. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_symmetry. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_symmetso. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_telnes2. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_templates. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_tetra. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_txspec. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_usersguide_html. Check compile.msg in this directory
>>> SRC_w2web/w2web
>>> cp: 0653-435 /home/c20321/wien2k/w2web と SRC_w2web/w2web は票办です (コピ〖されませ?蟆?
>>> WARNING: no executable found in SRC_structeditor/SRC_ncmsymmetry. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_structeditor/SRC_readwrite. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_structeditor/SRC_struct2mol. Check compile.msg in this directory
>>> WARNING: no executable found in SRC_structeditor/SRC_structgen. Check compile.msg in this directory
>>>
>>> Could you please tell me how to fix it?
>>>
>>> Best regards,
>>> Yours,
>>> Donghui Guo
>>> 2008-11-14
>>>
>>>
>>> ************************************************
>>> Donghui Guo
>>> Catalysis Research Center (CRC)
>>> Hokkaido University
>>> 21-10 Kita, Sapporo 001-0021
>>> Japan
>>> dhguo at cat.hokudai.ac.jp
>>> TEL: +81-11-706 9114 (office)
>>> ******************************************************
>>> _______________________________________________Wien mailing listWien at zeus.theochem.tuwien.ac.athttp://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
> = = = = = = = = = = = = = = = = = = = =
>
> ************************************************
> Donghui Guo
> Catalysis Research Center (CRC)
> Hokkaido University
> 21-10 Kita, Sapporo 001-0021
> Japan
> dhguo at cat.hokudai.ac.jp
> TEL: +81-11-706 9114 (office)
> ******************************************************
> _______________________________________________Wien mailing listWien at zeus.theochem.tuwien.ac.athttp://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
--
P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671 FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/
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