[QE-users] nscf calculation for an insulator

[Diship Srivastava]

Hi,
I am trying to do bands  and dos calculation on BN- sheet. Literature
reported value of band gap is b/w 4.5 and 6 ev and classified as
insulator. My question is this - for dos calculation during nscf
calculations do I take occupation as tetrahedra or nothing?
Thanks in advance.

-- 
Diship Srivastava
JRF
Department of Chemistry
IIT(ISM) - Dhanbad
India