<div dir="ltr"><div><div><div><div><div><div>Dear wien2k experts,<br><br></div>I have reinstalled wien2k_12 version in ubuntu 11.0 with ifort compiler (version 13.0) and mkl liberary . I have compiled all the programmes with no error . In the last step of ./siteconfigure_lapw I have chosen the perl path as /usr/bin/perl. After I did the userconfig_lapw > when I am trying to connect w2web I am getting this error <br>
<br>-bash: /opt/wien/w2web: q: bad interpreter: No such file or directory<br><br><br></div>I am in root directory.<br><br></div>My bashrc in directory is <br><br># added by WIEN2k: BEGIN<br># --------------------------------------------------------<br>
alias lsi="ls -aslp *.in*"<br>alias lso="ls -aslp *.ou*"<br>alias lsd="ls -aslp *.def"<br>alias lsc="ls -aslp *.cl*"<br>alias lss="ls -aslp *.sc*"<br>alias lse="ls -aslp *.error"<br>
alias pslapw="ps -ef |grep "lapw""<br>alias cdw="cd /root/WIEN2k"<br>export OMP_NUM_THREADS=1<br>#export LD_LIBRARY_PATH=.....<br>export EDITOR="emacs"<br>export SCRATCH=./<br>export WIENROOT=/opt/wien<br>
export W2WEB_CASE_BASEDIR=/root/WIEN2k<br>export STRUCTEDIT_PATH=$WIENROOT/SRC_structeditor/bin<br>export PDFREADER=acroread<br>export PATH=$PATH:$WIENROOT:$STRUCTEDIT_PATH:.<br>export OCTAVE_EXEC_PATH=${PATH}::<br>export OCTAVE_PATH=${STRUCTEDIT_PATH}::<br>
<br>export PATH=$PATH:$WIENROOT:.<br>ulimit -s unlimited<br>alias octave="octave -p $OCTAVE_PATH"<br># --------------------------------------------------------<br># added by WIEN2k: END <br><br><br></div>Please help me.<br>
<br></div>Regards<br></div>wasim<br><div><div><div><br><br><br><br><br><br><br><br><br></div></div></div></div>