Dear Wien2k users, I am working on MnFe2O4 cubic structure on wien version 17.1 with OS centos7. During initso_lapw I am getting an error in x symmetryso. In certain magnetization directions like (001), (010), (100) )it is working but along (011), (110), (101), (111) I am getting error. I have used the same parameters for all the cases during initialization and I have got similar results from all of them. Here is what the error I am getting
*** Error in `/home/dipraj/wien2k/symmetso': double free or corruption (out): 0x0000000000b44500 *** ======= Backtrace: ========= /lib64/libc.so.6(+0x7c619)[0x2aaae345c619] /home/dipraj/wien2k/symmetso[0x44e01b] /home/dipraj/wien2k/symmetso[0x492653] /home/dipraj/wien2k/symmetso[0x486da1] /home/dipraj/wien2k/symmetso[0x44b808] /home/dipraj/wien2k/symmetso[0x4075af] /home/dipraj/wien2k/symmetso[0x40301e] /lib64/libc.so.6(__libc_start_main+0xf5)[0x2aaae3401c05] /home/dipraj/wien2k/symmetso[0x402f29] ======= Memory map: ======== 00400000-0051b000 r-xp 00000000 fd:02 75646 /home/dipraj/wien2k/symmetso 0071a000-0071c000 r--p 0011a000 fd:02 75646 /home/dipraj/wien2k/symmetso 0071c000-00726000 rw-p 0011c000 fd:02 75646 /home/dipraj/wien2k/symmetso 00726000-00786000 rw-p 00000000 00:00 0 00ae2000-01afb000 rw-p 00000000 00:00 0 [heap] 2aaae2a9a000-2aaae2abb000 r-xp 00000000 fd:00 134250240 /usr/lib64/ld-2.17.so 2aaae2abb000-2aaae2abd000 rw-p 00000000 00:00 0 2aaae2ada000-2aaae2b2b000 rw-p 00000000 00:00 0 2aaae2cbb000-2aaae2cbc000 r--p 00021000 fd:00 134250240 /usr/lib64/ld-2.17.so 2aaae2cbc000-2aaae2cbd000 rw-p 00022000 fd:00 134250240 /usr/lib64/ld-2.17.so 2aaae2cbd000-2aaae2cbe000 rw-p 00000000 00:00 0 2aaae2cbe000-2aaae2dbf000 r-xp 00000000 fd:00 134250255 /usr/lib64/libm-2.17.so 2aaae2dbf000-2aaae2fbe000 ---p 00101000 fd:00 134250255 /usr/lib64/libm-2.17.so 2aaae2fbe000-2aaae2fbf000 r--p 00100000 fd:00 134250255 /usr/lib64/libm-2.17.so 2aaae2fbf000-2aaae2fc0000 rw-p 00101000 fd:00 134250255 /usr/lib64/libm-2.17.so 2aaae2fc0000-2aaae2fd7000 r-xp 00000000 fd:00 134250273 /usr/lib64/libpthread-2.17.so 2aaae2fd7000-2aaae31d6000 ---p 00017000 fd:00 134250273 /usr/lib64/libpthread-2.17.so 2aaae31d6000-2aaae31d7000 r--p 00016000 fd:00 134250273 /usr/lib64/libpthread-2.17.so 2aaae31d7000-2aaae31d8000 rw-p 00017000 fd:00 134250273 /usr/lib64/libpthread-2.17.so 2aaae31d8000-2aaae31dc000 rw-p 00000000 00:00 0 2aaae31dc000-2aaae31de000 r-xp 00000000 fd:00 134250253 /usr/lib64/libdl-2.17.so 2aaae31de000-2aaae33de000 ---p 00002000 fd:00 134250253 /usr/lib64/libdl-2.17.so 2aaae33de000-2aaae33df000 r--p 00002000 fd:00 134250253 /usr/lib64/libdl-2.17.so 2aaae33df000-2aaae33e0000 rw-p 00003000 fd:00 134250253 /usr/lib64/libdl-2.17.so 2aaae33e0000-2aaae3598000 r-xp 00000000 fd:00 134250247 /usr/lib64/libc-2.17.so 2aaae3598000-2aaae3798000 ---p 001b8000 fd:00 134250247 /usr/lib64/libc-2.17.so 2aaae3798000-2aaae379c000 r--p 001b8000 fd:00 134250247 /usr/lib64/libc-2.17.so 2aaae379c000-2aaae379e000 rw-p 001bc000 fd:00 134250247 /usr/lib64/libc-2.17.so 2aaae379e000-2aaae37a3000 rw-p 00000000 00:00 0 2aaae37a3000-2aaae37b8000 r-xp 00000000 fd:00 134217804 /usr/lib64/libgcc_s-4.8.5-20150702.so.1 2aaae37b8000-2aaae39b7000 ---p 00015000 fd:00 134217804 /usr/lib64/libgcc_s-4.8.5-20150702.so.1 2aaae39b7000-2aaae39b8000 r--p 00014000 fd:00 134217804 /usr/lib64/libgcc_s-4.8.5-20150702.so.1 2aaae39b8000-2aaae39b9000 rw-p 00015000 fd:00 134217804 /usr/lib64/libgcc_s-4.8.5-20150702.so.1 2aaae4000000-2aaae4021000 rw-p 00000000 00:00 0 2aaae4021000-2aaae8000000 ---p 00000000 00:00 0 7ffc5151e000-7ffc51596000 rw-p 00000000 00:00 0 [stack] 7ffc515f8000-7ffc515fa000 r-xp 00000000 00:00 0 [vdso] ffffffffff600000-ffffffffff601000 r-xp 00000000 00:00 0 [vsyscall] Abort (core dumped) 0.398u 0.034s 0:01.20 35.0% 0+0k 0+23704io 0pf+0w error: command /home/dipraj/wien2k/symmetso upsymmetso.def failed Please help me solving this issue. Thanking you -- Riyajul Islam Research Scholar National Institute of Technology Nagaland Chumukedima, Dimapur Nagaland 797103, India
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