[Wien] problem in wien2k installation
Laurence Marks
L-marks at northwestern.edu
Wed May 23 19:29:36 CEST 2012
Also "ldd $WIENROOT/lapw1" is sometimes useful, particularly on remote
nodes. (Do "man ldd" for more information.)
On Wed, May 23, 2012 at 12:12 PM, Peter Blaha
<pblaha at theochem.tuwien.ac.at> wrote:
>> I think the problem is not in w2web. Because I got the same error message while running in terminal also.
>> [root at localhost TiC]$ run_lapw -cc 0.0001 -NI
>> /home/james/wien2k/lapw0: error while loading shared libraries: libmkl_intel_lp64.so: cannot open shared object file: No such file or directory
>> > stop error
>> Would you please tell me the necessary files that are required for wien2k to run properly. Is it a problem in glibc?
>
> It is rather obvious which library you need: libmkl_intel_lp64.so
>
> This file should be in a directory which you have in your LD_LIBRARY_PATH
>
> Is it there ??? Is the library path set ??? (echo $LD_LIBRARY_PATH)
> do a ls -als of all directories in this variable.
>
> Alternatively, recompile WIen2k (siteconfig) with a linker-option -static-intel
> It should the statically link the necessary libraries.
>
> --
> -----------------------------------------
> Peter Blaha
> Inst. Materials Chemistry, TU Vienna
> Getreidemarkt 9, A-1060 Vienna, Austria
> Tel: +43-1-5880115671
> Fax: +43-1-5880115698
> email: pblaha at theochem.tuwien.ac.at
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--
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu 1-847-491-3996
"Research is to see what everybody else has seen, and to think what
nobody else has thought"
Albert Szent-Gyorgi
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