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- From: Samuel Sarholz <sarholz@rz.rwth-aachen.de>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] abinit result stability.
- Date: Tue, 26 Aug 2008 16:51:20 +0200
Hi Alain,
sorry for the late reply. I finally ran the test_acc and then counted the different lines in all the fldiff.report files.
( find ./ -name fldiff.report -exec grep "different lines" {}\;| wc -l )
I get between 68 and 75 differences cases depending depending on the compiler used.
It seems pretty random to me which cases show up with which compiler and how may line in each test differ.
Any hints how may differences are ok (if any)?
best regards,
Samuel
Samuel Sarholz wrote:
Hi Alain,
the minimal tests ran fine, except with the Intel Compiler with -O3. I get core dumps as well with some tests.
I will run the accuracy tests and see whether they report any problems.
best regards,
Samuel
Alain Jacques wrote:
Hello Samuel,
Some aggressive optimization options may produce unstable code and therefore abinit comes with an extensive set of test programs. Can you give some information about how your different builds behave with the "minimal" or "accuracy" test suite?
Kind regards,
Alain
Samuel Sarholz wrote:
Hi,
we are having trouble with abinit (abinis) results. They seem very unstable and differ a lot depending on the compiler used.
I used the 5.5.4 abinit version and 3 different compilers.
Intel 10.1 (10.1.015)
GNU 4.3.1
Sun Compiler (latest express release Sun Ceres Fortran 95 8.3 Linux_i386 2008/07/10)
--
Dipl.-Inform. Samuel Sarholz - High Performance Computing,
RWTH Aachen University, Center for Computing and Communication,
Seffenter Weg 23, 52074 Aachen (Germany), Office: 2.13
Tel: +49 241/80-24915 - Fax: +49 241/80-22134
mailto:sarholz@rz.rwth-aachen.de www.rz.rwth-aachen.de
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- [abinit-forum] Bader charges and electroneutrality, Latévi Max LAWSON DAKU, 08/13/2008
- [abinit-forum] abinit result stability., Samuel Sarholz, 08/14/2008
- Re: [abinit-forum] abinit result stability., Alain Jacques, 08/15/2008
- Re: [abinit-forum] abinit result stability., Samuel Sarholz, 08/15/2008
- Re: [abinit-forum] abinit result stability., Alain Jacques, 08/15/2008
- Re: [abinit-forum] abinit result stability., Samuel Sarholz, 08/26/2008
- Re: [abinit-forum] abinit result stability., Alain Jacques, 08/26/2008
- Re: [abinit-forum] abinit result stability., Samuel Sarholz, 08/27/2008
- Re: [abinit-forum] abinit result stability., Alain Jacques, 08/27/2008
- Re: [abinit-forum] abinit result stability., Samuel Sarholz, 08/27/2008
- Re: [abinit-forum] abinit result stability., Samuel Sarholz, 08/27/2008
- Re: [abinit-forum] abinit result stability., Alain Jacques, 08/26/2008
- Re: [abinit-forum] abinit result stability., Samuel Sarholz, 08/15/2008
- Re: [abinit-forum] abinit result stability., Alain Jacques, 08/15/2008
- [abinit-forum] abinit result stability., Samuel Sarholz, 08/14/2008
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