[Wien] compilation problem for the installation of wien2k
Ramkumar Thapa
r.k.thapa at gmail.com
Tue Feb 7 03:43:24 CET 2012
Dear MPG,
We will start with Dibya's i5 machine. I will get back to you with
suggestions later ok.
Prof.R.K.Thapa
Mizoram University
Aizawl INDIA
===============
2012/2/7 Madhav Ghimire <ghimire.mpg at gmail.com>
> Dear Wien users,
> I have installed centos 6 in my pc and successfully installed the fortran
> compiler as /opt/intel/composer_xe_2011_sp1/bin/ifort. But then when I
> tried to install wien2k 11.1 version or less, it shows 27 errors in various
> steps of lapw and others. Is there any specific reason why the compilation
> to wien2k is not possible or something else.
> Could anyone help me to solve this problem. I will be very grateful to you
> all.
> *For your information,
> the .bash_profile I have used is;*
> # .bash_profile
>
> # Get the aliases and functions
> if [ -f ~/.bashrc ]; then
> . ~/.bashrc
> fi
>
> # User specific environment and startup programs
>
> PATH=$PATH:$HOME/bin
> PATH="/opt/intel/composerxe-2011.5.220/bin/intel64/":${PATH}
> #PATH="/opt/intel/composerxe-2011.5.220/bin/intel64/":${PATH}
> export PATH
> MANPATH="/opt/intel/composerxe-2011.5.220/man/en_US/man1:${MANPATH}"
> export PATH
>
> LD_LIBRARY_PATH="/opt/intel/composerxe-2011.5.220/compiler/lib/intel64/":$LD_LIBRARY_PATH
>
> LD_LIBRARY_PATH="/opt/intel/composerxe-2011.5.220/mkl/lib/intel64/":$LD_LIBRARY_PATH
> export LD_LIBRARY_PATH
> INCLUDE="/opt/intel/composerxe-2011.5.220/mkl/include/":$INCLUDE
> export INCLUDE
> INTEL_LICENSE_FILE="/opt/intel/licenses"
> export INTEL_LICENSE_FILE
> *and my PC is i5 HP-laptop and workstation.*
>
> Regards
> --
> M. P. Ghimire
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120207/83e91c4c/attachment.htm>
More information about the Wien
mailing list