[Wien] klist for rhombohedral systems

Zhiyong Zhang zyzhang at stanford.edu
Sun Apr 25 06:49:16 CEST 2010


Dear All, 

I am trying to generate a klist for band structure calculations for rhombohedral systems with symmetry group:167 R-3c. 
Since wien2k use hcp for rhombohedral instead, do I use hcp k points for the klist_band or do I use rhombohedral? If rhombohedral, does any body have a template for the kpath points? 

Thanks!
Zhiyong


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