The ABINIT Users Mailing List ( CLOSED )

[Matthieu Verstraete <mjv500@york.ac.uk>]

PS: you'll see in your log file that there is no reference to normsq_xxx
These are the routines which process the matrix elements once all have 
been read in for a given qpoint, so basically the code is reading in data, 
throwing it away because it's not complete for a given qpoint, and going 
on to the next one. Then it gets to the end and tries to do something, but 
no data has been preserved. Crash.

PPS: to everyone. There may be cases where you don't want to broadcast to 
the entire internet what you are working on. You can either try to 
reproduce the bug or problem with a different system before writing the 
forum, or remove specific mention of the elements you use, but we can't do 
anything if we don't know what you're simulating (space group, cutoffs, 
etc...). So as a rule, if you want a diagnostic you'll end up telling us 
the whole truth anyway. You should watch "House M.D." for inspiration.

Matthieu


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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