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Please find attached the outputs of the SCF and <br>
(aborted) phonon calculations (Ni case). These <br>
are 4.3.1 results; using 4.3.2, similar results are <br>
obtained. <br>
<br>
Max<br>
<br>
On 10. 04. 12 16:26, Latévi Max LAWSON DAKU wrote:
<blockquote cite="mid:4F844317.7040805@unige.ch" type="cite">Dear QE
developers and users,
<br>
<br>
I would like to run some phonons calculations on a BG/P,
<br>
with QE-4.3.2.
<br>
<br>
I have therefore compiled the code using a make.sys file which
<br>
is adapted from $TOPDIR/INSTALL/Make.BGP (please see the
<br>
attached make.sys file): tThe compilation went fine (excepts
<br>
warning about the sizes of the symbols _pow, _acos, _asin and
<br>
_log, which are not the same in libmass.a and in libxlfmath.a).
<br>
<br>
I have then tried to run testcases taken from examples
<br>
15 (alas.{sch,ph}.in) and 24 (ni.{scf,phG}.in). In both cases,
<br>
the preliminaries SCF calculation completed successfully
<br>
(inferred from the comparison with the reference data),
<br>
while the phonon calculations systematically fail with
<br>
<br>
[...] BE_MPI (ERROR): "killed with signal 11" [...]
<br>
<br>
<br>
The calculation was submitted using a command line like
<br>
<br>
$ mpirun -partition R00-M0-03 -np 128 -mode VN -cwd $PWD \
<br>
-exe $PH_EXE -args "-npool 4 -in ni.phG.in" > ni.phG.out
<br>
<br>
<br>
I have tried also with QE-4.3.1: same behavior.
<br>
<br>
Did someone succeed in running a BG/P-mpixlf90-compiled ph.x
<br>
executable? If so can she/he share his compilation setup with me?
<br>
<br>
Except recompiling with debugging turned on (which supposes being
<br>
confident about the compilation setup), I am somehow at loss on
<br>
how to deal with this issue. I thank you in advance for your
advices
<br>
and suggestions are warmly welcome.
<br>
<br>
Best regards,
<br>
Max
<br>
<br>
<br>
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<br>
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<br>
<pre class="moz-signature" cols="72">--
Latevi Max LAWSON DAKU
Universite de Geneve - Sciences II
Quai Ernest-Ansermet 30 Tel: (41) 22/379 6548
CH-1211 Geneve 4 Fax: (41) 22/379 6103
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