[Wien] Spin-orbit calculation error in lapw2

[priya]

Dear Wien users,

I am doing a spin-polarised calculation including spin-orbit for a system
which has inversion symmetry. The calculation without spin-orbit runs through
without any problem.When I include spin-orbit, the programme crashes out of
lapw2c with the error message given at the end of this mail. When I looked at
the uplapw2.def file I find that it needs the case.in1c file. However since
the system has inversion symmetry the real version of lapw1 is accessed. I
tried to copy the case.in1 file into case.in1c but that did not solve the problem.

I also attach the struct file. Could someone tell me where I am going wrong?
For the spin-orbit calculation I use

runsp_lapw -so

Thanks in advance for your help.

Best wishes,

Priya

    start       (Fri Aug 18 13:42:38 IST 2006) with lapw0 (40/40 to go)
                                                                                
    cycle 1     (Fri Aug 18 13:42:38 IST 2006)  (40/40 to go)
                                                                                
>   lapw0       (13:42:38) 11.720u 0.990s 0:12.71 100.0%        0+0k 0+0io
390pf+0w
>   lapw1  -up          (13:42:51) 194.160u 0.980s 3:15.52 99.8%        0+0k
0+0io 681pf+0w
>   lapw1  -dn          (13:46:06) 190.560u 0.900s 3:11.69 99.8%        0+0k
0+0io 681pf+0w
>   lapwso -up          (13:49:18) 47.450u 0.950s 0:48.58 99.6% 0+0k 0+0io
665pf+0w
>   lapw2 -c -up -so    (13:50:06) Segmentation fault
0.120u 0.170s 0:00.24 120.8%    0+0k 0+0io 444pf+0w
error: command   /home/lapw/wien2k/lapw2c uplapw2.def   failed



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