[Pw_forum] band structure, can't I use hybrid functional?

Davide Tiana d.tiana at bath.ac.uk
Sat Jun 8 09:11:12 CEST 2013


Hello,
I need to perform an hybrid calculation on a 1D polymer. I managed to  
make an optimisation but when I run the bands calc, pw complains  
saying it can't perform a non-scf calc using hybrid.
is there any way to avoid this? I mean, is there a chance to have an  
hybrid band strucutre?

Cheers,
Davide




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