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2D Material Properties
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2D Material Properties
Midwest Nano Infrastructure Corridor
BP – Boron phosphide – Group III-V
Crystal Structure
BP Crystal Structure
a
1
3.21 Å
a
2
3.21 Å
Buckling Δ
0.00 Å
d
1
1.85 Å
Bandstructure
BP Brillouin Zone
BP Band Plot (HSE)
PBE
HSE
Valence Band Maximum
-5.08 eV
-5.43 eV
Conduction Band Minimum
-4.18 eV
-3.84 eV
Band Gap
0.90 eV
1.59 eV