<div>Dr Gerhard,</div>
<div>Thank you very much.</div>
<div>The nn file problem was sloved yesterday, which was caused by the f90 compiler. Initially, it was download directly from Intel ifort compiler instead of the offered executables in WIEN2k website.</div>
<div> </div>
<div>Best regards</div>
<div>yours </div>
<div>ZZY<br><br> </div>
<div><span class="gmail_quote">On 10/16/07, <b class="gmail_sendername">Gerhard Fecher</b> <<a href="mailto:fecher@uni-mainz.de">fecher@uni-mainz.de</a>> wrote:</span>
<blockquote class="gmail_quote" style="PADDING-LEFT: 1ex; MARGIN: 0px 0px 0px 0.8ex; BORDER-LEFT: #ccc 1px solid">If nn is not in the Wien directory then probably something went wrong<br>during siteconfig_lapw.<br>Go to the SRC_NN directory and check
compile.msg if errors occured during compilation.<br><br>Are the other programms (lapw0, etc) in the Wien directory ?<br>Did you receive serious (!) errors during compilation ? (not those about clean)<br><br>Actually it may be not a good idea to install in the /root directory (did you install as root, if so, why ?), do it in youre user home directory.
<br><br>Check if all environment variables needed by Wien are correctly set in youre bash.rc (hidden file).<br><br>Ciao<br>Gerhard<br><br><br>-----Ursprüngliche Nachricht-----<br>Von: <a href="mailto:wien-bounces@zeus.theochem.tuwien.ac.at">
wien-bounces@zeus.theochem.tuwien.ac.at</a> im Auftrag von li ding<br>Gesendet: Mo 15.10.2007 18:51<br>An: <a href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>Betreff: [Wien] nn command not found
<br><br>Dear WIEN2k users,<br><br>I am a freshman of wien2k.<br>A problem happened to me while running wien2k as the first time.<br>When I was running "initialize calc." and clicking and executing "x<br>nn"(nn-bondlength factor was 2), Wien2k showed below:
<br>/root/WIEN2k/nn: Command not found<br>0.000u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0w<br>error: command /root/WIEN2k/nn nn.def failed<br><br>Someone met with the same problem in the searching results of group emails.<br>
I redid the siteconfig_lapw following the experenced person's suggestion.<br>But still I got the same wrong results. In fact, in the directory<br>/root/WIEN2k no nn file exists.<br>Profiles of system environment:<br>OS is SUSE linux
10.1<br>WIEN2k was installed in /root/WIEN2k/<br>Working directroy is /root/case/TiC/<br>sample file was named TiC<br>specify compiler is f90<br>c compiler is gcc<br><br><br>I need your helps.<br>Please!<br><br>yours sincerely
<br>Zhong<br>Brooklyn College of CUNY, NY, USA<br><br><br>_______________________________________________<br>Wien mailing list<br><a href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br><a href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien">
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</a><br><br><br></blockquote></div><br>