[Wien] empty case.inclmcopy_st file

[Konstantin Nefedev]

 Dear all,

I wish calculate the antiferromagnetic compound LaMnO3.
 Why if  I start afminput, I recieve empty   *case.inclmcopy_st*  file.
What does it mean?


The answer of x *afminput is down:*
**

case.struct_supergroup present

Symmetry operation found! Click on Execute

  After the Executing I see



Commandline: *x afminput -c -up *
Program input is: *" "*

   case.struct_supergroup present
 The super and subgroups are TRANSLATIONENGLEICH
 Found a symmetry operation:
  -1   0   0   0.50000
   0  -1   0   0.00000
   0   0   1   0.50000
rrot not found0.068u 0.007s 0:00.10 60.0%	0+0k 0+0io 0pf+0w



What does mean "rrot not found"?


And then of course
if I want to edit case.in2 for change EMIN to truncate semicore
I have
   System ErrorCan't read file //work/knefedev/A_afm/A_afm.in2.

*back to last page <http://140.109.214.68:8000/exec/rho.pl?SID=236963>*
(because A_afm.in2.  is absent)


Thanks in advance,
Konstantin Nefedev,
Academia Sinica
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