[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
=======================================================

_________________________________________________________________
FREE online classifieds from Windows Live Expo – buy and sell with people 
you know 
http://clk.atdmt.com/MSN/go/msnnkwex0010000001msn/direct/01/?href=http://expo.live.com?s_cid=Hotmail_tagline_12/06



More information about the Wien mailing list