Dear siesta users:
 
I calculated the band structure of nitrogen doped ZnO nanowire and showing a 
acceptor defect level just above the highest occupied state, knowing that the 
Fermi level is below the highest occupied level. I want to know if this looks 
like a semi-metallic character and how to calculate the energy of the system at 
charge state q (-1) in siesta.
I'll be very grateful if someone can help
 
slimane, 


      

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