We need more details, nobody can help with such an error message.
Where does it happen: lapw2 ?? or which program ...
First iteration, or after a couple of scf cycles ..??
Any info on how far the failing program came (how long did it run ?
case.dayfile); is there anything in the outputXX file ? ...
What is your struct file ?? "A single Ti atom" could mean a big calculation if
you are using a too large supercell and small RMTs
Am 17.04.2014 03:19, schrieb eagle ying:
Dear oleg:
Thanks for your response. The memory usage is neglectable cause the
calculation is only about one atom and my memory is 3G. As I do the command
line:ulimit -s
unlimited as you suggested, the stack size is unlimited as ulimit -a suggested.
But the same error still occurs.
2014-4-16 下午8:08于 "Oleg Rubel" <oru...@lakeheadu.ca
<mailto:oru...@lakeheadu.ca>>写道：
The problem could be related to the stacksize. Consider setting it to
unlimited. The command line looks different under different environments. Here
is one possibility:
$ ulimit -s
$ ulimit -s unlimited
You can also check the memory usage during the run via
$ top
Oleg
On Wed, Apr 16, 2014 at 3:57 AM, leith...@gmail.com <mailto:leith...@gmail.com>
<leith...@gmail.com <mailto:leith...@gmail.com>> wrote:
Dear users:
When I am trying to do a test of total energy and EFG as a
function of RmtKmax for a single Ti atom, errors happened after seting rkmax
as 9.0 and any value
bigger: forrtl:severe(174):SIGSEGV,segmentation fault occured; stack
trace terminated abnormally.
Any help will be appreciated. Thanks in advance.
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Getreidemarkt 9, A-1060 Vienna, Austria
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