[Wien] errors during instalation.

Zahra Talebi talebi_z2011 at yahoo.com
Thu Nov 10 15:23:19 CET 2011


thanks for your explenation. 
please tell me where can I find my logof intalation to send it to you. I am very beginer in installing wien2k. 

can you send the file of composerxe-2011.3.174. because I think our ifort doesn`t stable with our wien2k. 

Then tell me how to put it as a source. 

thank you. 



________________________________
From: Maxim Rakitin <rms85 at physics.susu.ac.ru>
To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
Sent: Tuesday, November 8, 2011 6:39 AM
Subject: Re: [Wien] errors during instalation.


Did you source Intel environment variables? They can be found in intel install dir in bin directory.

Could you please provide a log of the installation?

Best regards, Maxim Rakitin South Ural State University Chelyabinsk, Russia  Email: rms85 at physics.susu.ac.ru Web: http://www.susu.ac.ru
08.11.2011 7:21, Gavin Abo пишет: 
The latest version of ifort (Composer XE 2011 Update 7) will likely not compile Wien2k correctly.  Try Composer XE 2011 Update 3 (composerxe-2011.3.174), it seems stable for Wien2k. 
> 
>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.
>
>In the directory of Wien2k files, try the following command to
        rerun the installation in the terminal: ./siteconfig_lapw
>
>Alternatively, you can type: ./siteconfig
>- Selecting the O option should take you where you can check or set the compiler flag to -O1.
>
>Also, try searching the mailing list archive (http://www.wien2k.at/reg_user/index.html)
        for similar discussions.
>
>Hope this helps.
>
>On 11/7/2011 2:08 PM, Zahra Talebi wrote: 
>Hi dear user,
>>We tried to instal the new version of wien with the latest version of ifort on our university computer. our 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. 
>>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. 
>>I am sorry if my question is so bad, I just don`t know how I have to explaina bout my problem. 
>>thanks for your help    
>>
>
>
>
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