Dahbia,
I had the same problem by the beginning of the week - see the emails of
this Tuesday, in which Emilio Artacho gave me a hint as to what the
problem could be. Looks like that if your orbitals are too extended, you
could have orthogonality problems and this crash appears. Looking at your
Hi,
Thanks for your response.
I tested it several times and it stops at the 2nd
iteration. I have not killed it.
I tested it on another machine because i think that it
is the problem of memory but it always gives me the
same problem.
I will try again.
Thank you
Dahbia
--- N H [EMAIL
An stupid question ... are u sure that its not a problem of your queue
system?! ... because tehre is a message stating that your jog was
killed after reaching the LSF run time limit ...
On Thu, Feb 21, 2008 at 2:52 PM, N H [EMAIL PROTECTED] wrote:
Dear Dahbia ...
Looks like you dont have
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