[Wien] Runtime error in WIENNCM

Fecher, Gerhard fecher at uni-mainz.de
Fri Sep 25 11:53:30 CEST 2015


Dear Bramhachari,
It seems this is an issue of the ifort 13 compiler,
I don't have the problem with the 11 version that i used a long time ago, but only with 13 (actually I don't have other versions installed, unfortunately)

I did not find fast where the problem is located, maybe you can use a newer version of ifort to see whether the memory problem still persists

Ciao
Gerhard

DEEP THOUGHT in D. Adams; Hitchhikers Guide to the Galaxy:
"I think the problem, to be quite honest with you,
is that you have never actually known what the question is."

====================================
Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
and
Max Planck Institute for Chemical Physics of Solids
01187 Dresden
________________________________________
Von: wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at] im Auftrag von Bramhachari Khamari [bramhachari.khamari at gmail.com]
Gesendet: Dienstag, 22. September 2015 09:40
An: wien at zeus.theochem.tuwien.ac.at
Betreff: [Wien] Runtime error in WIENNCM

Dear friends,

                I have successfully compiled the WIENNCM package. But when I run an exmple (UO2) , I got the following message

in cycle 1    ETEST: 0   CTEST: 0
 LAPW0 END
*** glibc detected *** /home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c: free(): invalid next size (fast): 0x00000000016afd90 ***
======= Backtrace: =========
/lib/x86_64-linux-gnu/libc.so.6(+0x7db26)[0x2b718c00db26]
/home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c[0x4cfd0c]
/home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c[0x432233]
/home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c[0x41e4a1]
/home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c[0x453eb9]
/home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c[0x404946]
/lib/x86_64-linux-gnu/libc.so.6(__libc_start_main+0xed)[0x2b718bfb176d]
/home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c[0x404839]
======= Memory map: ========
00400000-005c4000 r-xp 00000000 08:06 2127077                            /home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c
007c3000-007cf000 rw-p 001c3000 08:06 2127077                            /home/bramha/Documents/WIEN_NCM/WIENNCM/lapw1c
007cf000-0092f000 rw-p 00000000 00:00 0
00f0c000-023ab000 rw-p 00000000 00:00 0                                  [heap]
2b71884f8000-2b718851a000 r-xp 00000000 08:06 1071060                    /lib/x86_64-linux-gnu/ld-2.15.so<http://ld-2.15.so>
2b718851a000-2b718851c000 rw-p 00000000 00:00 0
2b718871a000-2b718871b000 r--p 00022000 08:06 1071060                    /lib/x86_64-linux-gnu/ld-2.15.so<http://ld-2.15.so>
2b718871b000-2b718871d000 rw-p 00023000 08:06 1071060                    /lib/x86_64-linux-gnu/ld-2.15.so<http://ld-2.15.so>
2b7188720000-2b7188c55000 r-xp 00000000 08:06 5653507                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_lp64.so
2b7188c55000-2b7188e54000 ---p 00535000 08:06 5653507                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_lp64.so
2b7188e54000-2b7188e56000 r--p 00534000 08:06 5653507                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_lp64.so
2b7188e56000-2b7188e62000 rw-p 00536000 08:06 5653507                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_lp64.so
2b7188e62000-2b7188e67000 rw-p 00000000 00:00 0
2b7188e68000-2b7189b13000 r-xp 00000000 08:06 5653516                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_thread.so
2b7189b13000-2b7189d13000 ---p 00cab000 08:06 5653516                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_thread.so
2b7189d13000-2b7189d14000 r--p 00cab000 08:06 5653516                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_thread.so
2b7189d14000-2b7189e4e000 rw-p 00cac000 08:06 5653516                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_intel_thread.so
2b7189e4e000-2b7189e53000 rw-p 00000000 00:00 0
2b7189e58000-2b718b2c5000 r-xp 00000000 08:06 5653505                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_core.so
2b718b2c5000-2b718b4c5000 ---p 0146d000 08:06 5653505                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_core.so
2b718b4c5000-2b718b50c000 r--p 0146d000 08:06 5653505                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_core.so
2b718b50c000-2b718b518000 rw-p 014b4000 08:06 5653505                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_core.so
2b718b518000-2b718b536000 rw-p 00000000 00:00 0
2b718b550000-2b718b568000 r-xp 00000000 08:06 1069073                    /lib/x86_64-linux-gnu/libpthread-2.15.so<http://libpthread-2.15.so>
2b718b568000-2b718b767000 ---p 00018000 08:06 1069073                    /lib/x86_64-linux-gnu/libpthread-2.15.so<http://libpthread-2.15.so>
2b718b767000-2b718b768000 r--p 00017000 08:06 1069073                    /lib/x86_64-linux-gnu/libpthread-2.15.so<http://libpthread-2.15.so>
2b718b768000-2b718b769000 rw-p 00018000 08:06 1069073                    /lib/x86_64-linux-gnu/libpthread-2.15.so<http://libpthread-2.15.so>
2b718b769000-2b718b76d000 rw-p 00000000 00:00 0
2b718b770000-2b718b86b000 r-xp 00000000 08:06 1060727                    /lib/x86_64-linux-gnu/libm-2.15.so<http://libm-2.15.so>
2b718b86b000-2b718ba6a000 ---p 000fb000 08:06 1060727                    /lib/x86_64-linux-gnu/libm-2.15.so<http://libm-2.15.so>
2b718ba6a000-2b718ba6b000 r--p 000fa000 08:06 1060727                    /lib/x86_64-linux-gnu/libm-2.15.so<http://libm-2.15.so>
2b718ba6b000-2b718ba6c000 rw-p 000fb000 08:06 1060727                    /lib/x86_64-linux-gnu/libm-2.15.so<http://libm-2.15.so>
2b718ba6c000-2b718ba6d000 rw-p 00000000 00:00 0
2b718ba70000-2b718bb55000 r-xp 00000000 08:06 4481953                    /opt/intel/composer_xe_2013_sp1.2.144/compiler/lib/intel64/libiomp5.so
2b718bb55000-2b718bd55000 ---p 000e5000 08:06 4481953                    /opt/intel/composer_xe_2013_sp1.2.144/compiler/lib/intel64/libiomp5.so
2b718bd55000-2b718bd60000 rw-p 000e5000 08:06 4481953                    /opt/intel/composer_xe_2013_sp1.2.144/compiler/lib/intel64/libiomp5.so
2b718bd60000-2b718bd88000 rw-p 00000000 00:00 0
2b718bd88000-2b718bd8a000 r-xp 00000000 08:06 1071599                    /lib/x86_64-linux-gnu/libdl-2.15.so<http://libdl-2.15.so>
2b718bd8a000-2b718bf8a000 ---p 00002000 08:06 1071599                    /lib/x86_64-linux-gnu/libdl-2.15.so<http://libdl-2.15.so>
2b718bf8a000-2b718bf8b000 r--p 00002000 08:06 1071599                    /lib/x86_64-linux-gnu/libdl-2.15.so<http://libdl-2.15.so>
2b718bf8b000-2b718bf8c000 rw-p 00003000 08:06 1071599                    /lib/x86_64-linux-gnu/libdl-2.15.so<http://libdl-2.15.so>
2b718bf90000-2b718c144000 r-xp 00000000 08:06 1071595                    /lib/x86_64-linux-gnu/libc-2.15.so<http://libc-2.15.so>
2b718c144000-2b718c343000 ---p 001b4000 08:06 1071595                    /lib/x86_64-linux-gnu/libc-2.15.so<http://libc-2.15.so>
2b718c343000-2b718c347000 r--p 001b3000 08:06 1071595                    /lib/x86_64-linux-gnu/libc-2.15.so<http://libc-2.15.so>
2b718c347000-2b718c349000 rw-p 001b7000 08:06 1071595                    /lib/x86_64-linux-gnu/libc-2.15.so<http://libc-2.15.so>
2b718c349000-2b718c34f000 rw-p 00000000 00:00 0
2b718c350000-2b718c365000 r-xp 00000000 08:06 1054262                    /lib/x86_64-linux-gnu/libgcc_s.so.1
2b718c365000-2b718c564000 ---p 00015000 08:06 1054262                    /lib/x86_64-linux-gnu/libgcc_s.so.1
2b718c564000-2b718c565000 r--p 00014000 08:06 1054262                    /lib/x86_64-linux-gnu/libgcc_s.so.1
2b718c565000-2b718c566000 rw-p 00015000 08:06 1054262                    /lib/x86_64-linux-gnu/libgcc_s.so.1
2b718c566000-2b718c65a000 rw-p 00000000 00:00 0
2b718ccd4000-2b71936d8000 rw-p 00000000 00:00 0
2b7196a40000-2b7197d99000 r-xp 00000000 08:06 5653522                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_def.so
2b7197d99000-2b7197f99000 ---p 01359000 08:06 5653522                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_def.so
2b7197f99000-2b719806c000 r--p 01359000 08:06 5653522                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_def.so
2b719806c000-2b7198072000 rw-p 0142c000 08:06 5653522                    /opt/intel/composer_xe_2013_sp1.2.144/mkl/lib/intel64/libmkl_def.so
2b7198072000-2b719bffe000 rw-p 00000000 00:00 0
7ffd5a5a8000-7ffd5a6ba000 rw-p 00000000 00:00 0                          [stack]
7ffd5a7c8000-7ffd5a7c9000 r-xp 00000000 00:00 0                          [vdso]
ffffffffff600000-ffffffffff601000 r-xp 00000000 00:00 0                  [vsyscall]

I do not know what it means and how to solve this issue. Any kind of suggestion will be appreciated.

Regards,
Bramha


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