[Wien] Error compile information in Linux 9.0 system

Hongjun Xiang xhongjun at mail.ustc.edu.cn
Wed Nov 8 18:41:54 CET 2006


Dear Li,
I totally agree with Stefaan.
Or you can present more detailed information (e.g. in 
SRC_lapw1/compile.msg) for us to see the problem.
Let me guess: it might be related to the usage of the mkl library.

Best regards,
Hongjun Xiang

crazy Li wrote:
> Dear Hongjun,
>
> Thank you for your suggestion. according your suggestion, i made 
> modification om SRC_pairhess. it is ok about the SRC_pairhess, but the 
> error information about lapw1,lapw1c, lapw2, lapw2c.... (real and 
> complex)are also exist. I don't know how to solve it. (my system is 
> Red Had 9.0 )
> Rgds,
> Li
> On 11/7/06, *Hongjun Xiang* <xhongjun at mail.ustc.edu.cn 
> <mailto:xhongjun at mail.ustc.edu.cn>> wrote:
>
>     Dear Li,
>     I have just compiled wien2k_06 successfully using Intel
>     compiler70+mkl72.
>     I made one modification:
>     Line 74 of matcon.f (in directory SRC_pairhess)should be changed from
>     ANORMI = AMAX1(ANORMI,T)
>     to
>     ANORMI = MAX(ANORMI,T)
>
>     Good luck.
>
>     Best regards,
>     Hongjun Xiang
>
>     =============================================================
>     H. J. Xiang
>     Postdoctoral Research Assistant
>     Department of Chemistry
>     North Carolina State University
>     Raleigh, NC 27695-8204
>     Tel: 001-919-515-8919
>     http://www4.ncsu.edu/~hxiang/ <http://www4.ncsu.edu/%7Ehxiang/>
>     =============================================================
>
>



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