[Wien] k-points of supercell

2015-08-30 Thread Seyyed Amir Abbas Emami
​Dear users. I am trying to calculate band structure of A2 B1-x Cx (x=0, 0.25, 0.5, 0.75) compounds.But for compound x=0.25, 0.5, 0.75 supercell was created. Now can i use different k-points for each of compound. I mean for for x=0.25, 0.5 and 0.75 is it possible to use less k -points because

Re: [Wien] k-points of supercell

2015-08-30 Thread delamora
@zeus.theochem.tuwien.ac.at Asunto: [Wien] k-points of supercell Dear users. I am trying to calculate band structure of A2 B1-x Cx (x=0, 0.25, 0.5, 0.75) compounds.But for compound x=0.25, 0.5, 0.75 supercell was created. Now can i use different k-points for each of compound. I mean for for x=0.25, 0.5