[SIESTA-L] Problemas with band structure

Tue, 26 Jan 2010 10:22:56 -0800 

Hi all
I am calculating the band structure for crystalline polymer. I am
interested to calculated it along b and c axis. For this, I use the next
labels in the input file:

WriteBands          true

BandLinesScale   ReciprocalLatticeVector
%block Bandlines
1   0.0   0.5    0.0  X
40  0.0   0.0    0.0  \Gamma
40  0.0   0.0    0.5  X'
%endblock Bandlines

The job finishes withoout problems.
Then, I use gnubands, but I obtain  0.000000 in the first column. I add a
some piece of gnubands output file:
      0.000000     10.427000
      0.000000     10.427000
      0.000000     10.427000
      0.000000     10.427000
      0.000000     10.427000
      0.000000     10.427000
      .....
      ....
The first columns always are 0.0

I have checked my input file, but I haven't found errors.

Thanks in advance.

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