[Pw_forum] Problem in Si band structure

MSaqlain saqlain at bilkent.edu.tr
Mon Aug 15 09:54:53 CEST 2016


Dear Users

I am learning on how to do band structure calculations using QE and for 
this I have tried to calculate Si band structure. Using the nscf as 
given in example01 and using my own one (kpath from xcrysden), I end-up 
with a weired band structure. Can any one tell me where am I going wrong?

*msaqalian*

*Bilknet Uni. Ankara*

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