Table 1 Absorption edges, calculated optical band gaps, conduction band bottoms, valence band tops and suface area.
BiOBrxI1−x | x = 1.0 | x = 0.8 | x = 0.5 | x = 0.2 | x = 0 |
|---|---|---|---|---|---|
Absorption edge (nm) | 431 | 555 | 607 | 645 | 655 |
Optical band gap (eV) | 2.87 | 2.23 | 2.04 | 1.92 | 1.89 |
CB bottom (eV) | −0.55 | 0.01 | −0.04 | −0.07 | 0.18 |
VB top (eV) | 2.32 | 2.24 | 2.0 | 1.85 | 2.07 |
Suface area (m2 g−1) | 7.8 | 10.8 | 10.3 | 9.8 | 10.0 |