Dear all,
We are glad to inform that we have successfully installed WIEN2k_14.2
in the SAMSUNG laptop computer having openSUSE Linux. We could
successfully compute the DOS, band structure and electron density of
TiC example. We hope to go well with rest of examples and get into our
specific problem of interest. Our sincere thanks to every one and
specially to Dr. Lyudmila Dobysheva and Dr. Gavin Abo who offered some
helping instructions in response to our post in the Mailing list for
WIEN2k.
With regards
K. Balamurugan
Quoting Lyudmila Dobysheva <lyuk...@mail.ru>:
On 04.06.2015 13:38, Dr. K. Balamurugan wrote:
/WIEN2k/dstart: error while loading shared libraries:
libmkl_intel_lp64.so: cannot open shared object file: No such file or
directory
0.000u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0w
error: command /WIEN2k/dstart dstart.def failed
I usually put a job through batch/at command and in the head of
executing file I must put two lines:
(this is one line!)
setenv LD_LIBRARY_PATH
_YourPathToFortran_/compiler/lib/intel64:_YourPathToFortran_/mkl/lib/intel64
setenv MKL_TARGET_ARCH intel64
in the file .bashrc I have the following:
source ___YourPathToFortran___/bin/compilervars.sh intel64
Without this I see the same diagnostic.
Best wishes
Lyudmila Dobysheva
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RUSSIA
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