<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:14pt"><div><span>thanks for your explenation. </span></div><div><span>please tell me where can I find my logof intalation to send it to you. I am very beginer in installing wien2k. <br></span></div><div><span>can you send the file of </span><span style="font-size: 12pt;">composerxe-2011.3.174. because I think our ifort doesn`t stable with our wien2k. <br></span></div><div><span style="font-size: 12pt;">Then tell me how to put it as a source. <br></span></div><div><span style="font-size: 12pt;">thank you. <br></span></div><div><br></div><div style="font-family: times new roman,new york,times,serif; font-size: 14pt;"><div style="font-family: times new roman,new york,times,serif; font-size: 12pt;"><font face="Arial" size="2"><hr size="1"><b><span style="font-weight: bold;">From:</span></b> Maxim Rakitin
<rms85@physics.susu.ac.ru><br><b><span style="font-weight: bold;">To:</span></b> A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at><br><b><span style="font-weight: bold;">Sent:</span></b> Tuesday, November 8, 2011 6:39 AM<br><b><span style="font-weight: bold;">Subject:</span></b> Re: [Wien] errors during instalation.<br></font><br>
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Did you source Intel environment variables? They can be found in
intel install dir in bin directory.<br>
<br>
Could you please provide a log of the installation?<br>
<pre class="yiv770435394moz-signature">Best regards,
Maxim Rakitin
South Ural State University
Chelyabinsk, Russia
Email: <a rel="nofollow" class="yiv770435394moz-txt-link-abbreviated" ymailto="mailto:rms85@physics.susu.ac.ru" target="_blank" href="mailto:rms85@physics.susu.ac.ru">rms85@physics.susu.ac.ru</a>
Web: http://www.susu.ac.ru</pre>
<br>
08.11.2011 7:21, Gavin Abo пишет:
<blockquote type="cite">
The latest version of ifort (Composer XE 2011 Update 7) will
likely not compile Wien2k correctly. Try Composer XE 2011 Update
3 (<span style="font-size: 12pt;">composerxe-2011.3.174</span>), it
seems stable for Wien2k.
<div class="yiv770435394moz-text-html" lang="x-western"><span style="font-size: 12pt;"></span> <br>
The lapw0 error is probably because you need to change the
compiler optimization flag to -O1. By default, it might be -O3,
which has been known to break code loops using ifort 12.<br>
<br>
In the directory of Wien2k files, try the following command to
rerun the installation in the terminal: ./siteconfig_lapw<br>
<br>
Alternatively, you can type: ./siteconfig<br>
-
<span style="font-size: 12pt;">Selecting the O option should
take you where you can check or set the compiler flag to -O1.</span><br>
<br>
Also, try searching the mailing list archive (http://www.wien2k.at/reg_user/index.html)
for similar discussions.<br>
<br>
Hope this helps.<br>
</div>
<br>
On 11/7/2011 2:08 PM, Zahra Talebi wrote:
<blockquote type="cite">
<div style="color: rgb(0, 0, 0); background-color: rgb(255, 255, 255); font-family: times new roman,new york,times,serif; font-size: 14pt;">
<div style="">Hi dear user,</div>
<div style="">We tried to instal the new version of
wien with the latest version of ifort on our university
computer. ou<var id="yiv770435394yui-ie-cursor"></var>r computer have
centos 5.5 and is 32 bit. During the instalation, we accept
any recomendation that the program give us, but at the end
of instalation we got alot of errors. we didn`t know how to
solve the errors, for now we can open the wien page after
typing w2web in the terminal but when we try to run an
example in the begining of run it will give an error and
would say it cannot find lapw0. </div>
<div style="">There is a part during instalation
which wien ask us about the address of library and some
things else in that place we just accept what the computer
had recommend, but now we think we have to change it. How
can we go back to that part? Do we have to start instalation
again. </div>
<div style="">I am sorry if my question is so bad,
I just don`t know how I have to explaina bout my problem. </div>
<div style="">thanks for your help<span style="" class="yiv770435394tab"> </span></div>
</div>
<br>
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</blockquote>
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