[Wien] About executable version

2008-07-21 Thread Peter Blaha
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

[Wien] About executable version

2008-07-17 Thread Oleg Artamonov
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,

[Wien] About executable version

2008-07-17 Thread Peter Blaha
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

[Wien] About executable version

2008-07-17 Thread Laurence Marks
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)

[Wien] About executable version

2008-07-17 Thread Oleg Artamonov
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