[Pw_forum] GWW issue

Manoar Hossain manoarphy at niser.ac.in
Wed Mar 29 14:15:12 CEST 2017


Hi All,

I'm trying to do the gww calculations for CH4 (from the tutorial of GWW)
with increasing polarizability basis but for NUMW_PROD = 300 and more I'm
getting error which is attached below

pw4gww.x:7015 terminated with signal 11 at PC=2b80b1bdb0bf
SP=7fffc12a8310.  Backtrace:
/opt/intel/openmpi-intel/lib/libopen-pal.so.6(opal_memory_ptmalloc2_int_free+0xaf)[0x2b80b1bdb0bf]
/opt/intel/openmpi-intel/lib/libopen-pal.so.6(opal_memory_ptmalloc2_free+0xad)[0x2b80b1bdcd3d]
/home/manoar/Packages/espresso-5.3.0/bin/pw4gww.x(for_dealloc_allocatable+0x107)[0xa7d6e7]
/home/manoar/Packages/espresso-5.3.0/bin/pw4gww.x[0x4cbc72]
/home/manoar/Packages/espresso-5.3.0/bin/pw4gww.x[0x41a29c]
/home/manoar/Packages/espresso-5.3.0/bin/pw4gww.x[0x410f70]
/home/manoar/Packages/espresso-5.3.0/bin/pw4gww.x[0x41005e]
/lib64/libc.so.6(__libc_start_main+0xfd)[0x3fa241ed1d]
/home/manoar/Packages/espresso-5.3.0/bin/pw4gww.x[0x40ff69]


I'm unable to resolve it. Can anybody help me out in this regard.



Thanks,

-- 
Manoar Hossain
Research Scholar
School of Physical Sciences
NISER, Bhubaneswar
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