Regulating the band gaps of seven stacking patterns of bilayer hexagonal boron nitrides by doping carbon atoms in opposite sites
The band gaps of seven stacking patterns of bilayer hexagonal boron nitrides(h-BNs) are regulated by changing the doping positions of carbon atoms using density functional theory calculations.The calculation results dwell on that the AA1 stacking pattern h-BN has the largest band gap among seven stacking patterns of h-BNs.The influences of five dif