[Wien] AFM

[Antonio Vanderlei dos Santos - Fisica]

dear users
I'm trying to run a calculation antiferromagnetic and the
following error appears.

Some could help me.

Commandline: X AFMINPUT
-UP 
Program input is: "1.0 0.0 0.0 0.5 0.0 1.0 0.0 0.5 0.0 0.0 1.0 0.5
" 

At line 227 of file afminput.f (unit = 5, file = 'stdin')
Fortran
runtime error: Bad integer for item 1 in list input

case.struct_supergroup NOT present!!!
 It is strongly recommended that
you copy the (nonmagnetic) supergroup 
 struct file to
case.struct_supergroup (unless they are KLASSENGLEICH)
 Otherwise:
 You
must specify a symmetry operation (rotation + translation vector) 

which transforms the spin-up into the spin-dn atom (e.g. for AFM bcc
Cr:)!
 1 0 0 0.5
 0 1 0 0.5
 0 0 1 0.5
0.0u 0.0s 0:00.00 0.0% 0+0k 0+8io
0pf+0w
error: command /home/wien2k/afminput upafminput.def failed

 
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