[Wien] Fw: Re: problem in execution
Yurko Natanzon
yurko.natanzon at gmail.com
Wed Sep 8 14:20:56 CEST 2010
1. Please kindly show your compilation options in siteconfig (RP_LIBS and
others)
2. Maybe, you're using a shell other than bash? Check it by typing
echo $SHELL
3. Check, if LD_LIBRARY_PATH is set up properly by typing
export
and checking its value (however, it should be) . If your shell is (t)csh,
then type "setenv" instead of "export".
Cannot suggest more unless you show the compilation options.
Regards,
Yurko
2010/9/8 Pooja Rana <pooja_fizix at ymail.com>
> Sir :
>
> Yes Sir, the compilation was successful without any error.
>
> I successfully run the userconfig_lapw.
>
> The contains of the .bashrc are as follows :
>
> # .bashrc
>
> # User specific aliases and functions
>
> # Source global definitions
> if [ -f /etc/bashrc ]; then
> . /etc/bashrc
> fi
>
> export PATH=$PATH:/opt/intel/fc/10.1.018/bin bash
> export PATH=$PATH:/opt/intel/idb/10.1.018/bin bash
>
> export MANPATH=$MANPATH:/opt/intel/idb/10.1.018/man bash
> export MANPATH=$MANPATH:/opt/intel/fc/10.1.018/man bash
>
> export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/intel/mkl/9.1.023/lib/32
> bash
> export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/intel/fc/10.1.018/lib bash
>
> export INCLUDE=$INCLUDE:/opt/intel/mkl/9.1.023/include bash
>
> export INTEL_LICENSE_FILE=$INTEL_LICENSE_FILE:/opt/intel/licenses bash
>
> export IFLPATH=$IFLPATH:/opt/intel/fc/10.1.018/lib bash
> export MKLPATH=$MKLPATH:/opt/intel/mkl/9.1.023/lib/32 bash
> # added by WIEN2k: BEGIN
> # --------------------------------------------------------
> alias lsi="ls -aslp *.in*"
> alias lso="ls -aslp *.ou*"
> alias lsd="ls -aslp *.def"
> alias lsc="ls -aslp *.cl*"
> alias lss="ls -aslp *.sc*"
> alias lse="ls -aslp *.error"
> alias pslapw="ps -ef |grep "lapw""
> alias cdw="cd /home/gga/data"
> export OMP_NUM_THREADS=1
> #export LD_LIBRARY_PATH=.....
> export EDITOR="emacs"
> export SCRATCH=./
> export WIENROOT=/home/gga/wien2k
> export W2WEB_CASE_BASEDIR=/home/gga/data
> export STRUCTEDIT_PATH=$WIENROOT/SRC_structeditor/bin
> export PDFREADER=acroread
> export PATH=$PATH:$WIENROOT:$STRUCTEDIT_PATH:.
> export OCTAVE_EXEC_PATH=${PATH}::
> export OCTAVE_PATH=${STRUCTEDIT_PATH}::
>
> export PATH=$PATH:$WIENROOT:.
> ulimit -s unlimited
> alias octave="octave -p $OCTAVE_PATH"
> # --------------------------------------------------------
> # added by WIEN2k: END
>
> Many thanks Sir for your kind attention and quick reply.
>
> I tried to recompile again but failed to remove the error.
>
> Kindly help me by guiding.
>
> Regards,
>
>
>
>
> *Pooja Rana
> **Research Scholar
> Condensed Matter Theory Group
> School of Studies In Physics
> Jiwaji University, GWALIOR - 474011 (M.P.), INDIA*
>
> -
>
>
>
> --- On *Tue, 7/9/10, Peter Blaha <pblaha at theochem.tuwien.ac.at>* wrote:
>
>
> From: Peter Blaha <pblaha at theochem.tuwien.ac.at>
> Subject: Re: [Wien] problem in execution
> To: "A Mailing list for WIEN2k users" <wien at zeus.theochem.tuwien.ac.at>
> Date: Tuesday, 7 September, 2010, 8:30 PM
>
>
> Was siteconfig_lapw successful and without errors ???
>
> Did you use: userconfig_lapw ???
>
> What is in your .bashrc file ?
> What says echo $LD_LIBRARY_PATH ?
>
> Am 07.09.2010 14:48, schrieb Pooja Rana:
> > Respected Prof. Blaha,
> >
> > Sir, I am getting the following message when i am trying to run Wien2k .
> >
> > Commandline: *x nn *
> > Program input is: *"2 "*
> >
> > /home/gga/new-wien/nn: error while loading shared libraries: libguide.so:
> cannot open shared object file: No such file or directory
> > 0.000u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0w
> > error: command /home/gga/new-wien/nn nn.def failed
> >
> > Further that during execution of the programme I also am unable to find
> the mixer file genereted during initialisation.
> >
> > Kindly help me by guiding so that I can run the programme successfully
> and complete my work.
> >
> > With kind regards and thanks,
> >
> >
> > /Pooja Rana
> > //Research Scholar
> > Condensed Matter Theory Group
> > School of Studies In Physics
> > Jiwaji University, GWALIOR - 474011 (M.P.), INDIA/
> >
> >
> >
> >
> > _______________________________________________
> > Wien mailing list
> > Wien at zeus.theochem.tuwien.ac.at<http://in.mc948.mail.yahoo.com/mc/compose?to=Wien@zeus.theochem.tuwien.ac.at>
> > http://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<http://in.mc948.mail.yahoo.com/mc/compose?to=blaha@theochem.tuwien.ac.at>
> WWW: http://info.tuwien.ac.at/theochem/
> --------------------------------------------------------------------------
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>
>
>
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>
--
Yurko (aka Yuriy, Iurii, Jurij etc) Natanzon
PhD student
Department for Structural Research (NZ31)
Henryk Niewodniczański Institute of Nuclear Physics
Polish Academy of Sciences
ul. Radzikowskiego 152,
31-342 Krakow, Poland
E-mail: Yurii.Natanzon at ifj.edu.pl, yurko.natanzon at gmail.com
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