[Wien] Got an error when running the aim program
naivebamboo Huang
naivebamboo at hotmail.com
Mon Feb 12 22:12:25 CET 2007
Dear Wien2K users,
I am trying to get bader charges for Bi2Te3. But when I ran aim
code (SURF), an error appeared as following:
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image PC Routine Line Source
aim 0807AEC5 Unknown Unknown Unknown
aim 08080089 Unknown Unknown Unknown
aim 08061F2A Unknown Unknown Unknown
aim 0804E8A9 Unknown Unknown Unknown
aim 0804E376 Unknown Unknown Unknown
aim 0804C8AA Unknown Unknown Unknown
libc.so.6 009E5DE3 Unknown Unknown Unknown
aim 0804C7E1 Unknown Unknown Unknown
282.565u 0.473s 4:43.07 99.9% 0+0k 0+0io 0pf+0w
error: command /home/huang/wien2k/aim aim.def failed
There was no problem when I found the critical points. Please see my input
attached. Is there any problem with the input file? Any reply will be
appreciated.
Thanks
Baoling
Bi2Te3.inaim
===========================================
CRIT
3
ALL
3 3 3
SURF
3
30 0.0 3.1415926536
30 0.0 6.2831853072
0.08 1.0 4
1.6 0.1
3 3 3
IRHO
WEIT
30
END
=======================================================
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