[gmx-users] Weird error message from QM/MM run.

[yoochan,myung]

QM/MM calculation requested.
there we go!
Layer 0
nr of QM atoms 30
QMlevel: RHF/STO-3G

number of CPUs for gaussian = 1
memory for gaussian = 50000000
accuracy in l510 = 8
NOT using cp-mcscf in l1003
Level of SA at start = 0
[yoochancal2-desktop:09740] *** Process received signal ***
[yoochancal2-desktop:09740] Signal: Segmentation fault (11)
[yoochancal2-desktop:09740] Signal code: Address not mapped (1)
[yoochancal2-desktop:09740] Failing at address: (nil)
[yoochancal2-desktop:09740] [ 0] /lib/libpthread.so.0 [0x7f3d70cd5080]
[yoochancal2-desktop:09740] [ 1] /lib/libc.so.6(strlen+0x30) [0x7f3d709d4c60]
[yoochancal2-desktop:09740] [ 2] /lib/libc.so.6(fputs+0x1e) [0x7f3d709bcb3e]
[yoochancal2-desktop:09740] [ 3] mdrun(init_gaussian+0x4eb) [0x52709b]
[yoochancal2-desktop:09740] [ 4] mdrun(init_QMMMrec+0x10e0) [0x51fb10]
[yoochancal2-desktop:09740] [ 5] mdrun(mdrunner+0xf59) [0x435339]
[yoochancal2-desktop:09740] [ 6] mdrun(main+0x3da) [0x43bd2a]
[yoochancal2-desktop:09740] [ 7] /lib/libc.so.6(__libc_start_main+0xe6) [0x7f3d709725a6]
[yoochancal2-desktop:09740] [ 8] mdrun [0x41c4d9]
[yoochancal2-desktop:09740] *** End of error message ***
Segmentation fault

QM/MM (Gaussian 03, Gromacs 4.0.5)

I edited gaussian03 link files by under link.

http://wwwuser.gwdg.de/~ggroenh/qmmm.html


I have no Idea what the error message mean.

Any suggestions?


regard.

yoochan.