Skip to main content
. 2024 Nov 15;14(49):36538–36545. doi: 10.1039/d4ra06674j

Lattice constant a (Å), band gaps Eg (eV), gap type, and defect formation energy Ef of pure and doped boron nitride monolayers.

Monolayer a (Å) E g (eV) Gap type E f (Ha)
44BN 9.997 4.252 Indirect N/A
C-BN 10.047 3.177 Direct 0.072
O-BN 10.118 1.805 Indirect 0.207
Si-BN 10.400 1.532 Indirect 0.911
P-BN 10.346 0.692 Direct 0.746