forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

IBM crash in afterscfloop

From: Matthieu Verstraete <mjv500@york.ac.uk>
To: forum@abinit.org
Subject: IBM crash in afterscfloop
Date: Thu, 25 Oct 2007 13:46:23 +0100 (BST)

abinit v5.4.4 compiled on IBM power5 / xlf crashes at the end of the scf cycles, with the attached input file. Something in afterscfloop.F90, strange. It doesn't depend on the job size (ecut, kpt) or the method for using SO psp or not.

attached is the io etc. Same as for previous mail to devel.

Cheers

Matthieu

--
================================================================
Dr. Matthieu Verstraete mailto:mjv500@york.ac.uk
Dept. of Physics, University of York, tel: +44 1904 43 22 08
Heslington, YO10 5DD York, United Kingdom fax: +44 1904 43 22 14

Attachment: pbs.tar.gz
Description: GNU Zip compressed data

IBM crash in afterscfloop, Matthieu Verstraete, 10/25/2007