Dear Users

I want to plot the band structure of CsCl cubic lattice. For the same I want to 
know the band lines of the CsCl cubic lattice. In the SIESTA manual band lines 
are given for fcc structure only as given below

%block BandLines
1 1.000 1.000 1.000
20 0.000 0.000 0.000
25 2.000 0.000 0.000
30 2.000 2.000 2.000
%endblock BandLines

Kindly help me in this regard.

With Regard!
Mamta

Responder a