at theochem.tuwien.ac.at
To: A Mailing list for WIEN2k users wien at zeus.theochem.tuwien.ac.at
Sent: Thursday, July 17, 2008 1:58 PM
Subject: Re: [Wien] About executable version
A new WIEN2k_08_executables.tar.gz (updated qtl) is on the web.
Oleg Artamonov schrieb:
Dear Wien2k team
Dear Wien2k team leaders,
May I ask you to update the executable version of the Wien2k for
downloading, especially I need the new QTL version.
The reason for this, that I still have problems with Wien2k compilation and
work temporary with executable version.
I tried to compile QTL separately,
A new WIEN2k_08_executables.tar.gz (updated qtl) is on the web.
Oleg Artamonov schrieb:
Dear Wien2k team leaders,
May I ask you to update the executable version of the Wien2k for
downloading, especially I need the new QTL version.
The reason for this, that I still have problems with Wien2k
While this will probably work, a word of caution. In some recent linux
versions LD_LIBRARY_PATH is not exported when you run a job using the
at command, so this may not work in all cases. The best solution
is probably to ensure that the ifort/mkl libraries are appropriately
added. Some options:
1)
Dear Peter Blaha and S.J. Hashemifar,
Thanks for quick replies, Oleg
- Original Message -
From: Javad hashemifar
To: A Mailing list for WIEN2k users
Sent: Thursday, July 17, 2008 1:42 PM
Subject: Re: [Wien] About executable version
a possible solution:
please run
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