As (Puckered) – Arsenene – Group V
Crystal Structure
a1 | 4.72 Å |
a2 | 3.67 Å |
Buckling Δ | 2.41 Å |
d1 | 2.51 Å |
d2 | 3.84 Å |
Bandstructure
PBE | HSE | |
---|---|---|
Valence Band Maximum | -4.41 eV | -4.96 eV |
Conduction Band Minimum | -3.86 eV | -3.71 eV |
Band Gap | 0.55 eV | 1.25 eV |