Dear Riya:

 Go to:

http://personales.unican.es/junqueraj/siesta-tutorial.html

 There you can fin many fully self-explained exercises on the practicalities 
and how-to in SIESTA.

 In your particular case, follow the links:

 Set of self-explained SIESTA exercises
 Computing structural and electronic properties of materials
 Exercise number 4: Density of States and Projected Density of States
 
 Hope this helps,

         Javier


 


> Dear all
> 
> How to calculate PDOS at the edge carbon atom of graphene nanoribbon ?
> 
> kindly guide me through.
> 
> Thanking you
> 
> Regard
> Riya

Responder a