Table 1 Cohesive energies and total magnetic moments of considered boron nanowires and of bulk α-B and β-B
Nanostructure | E c (eV/atom) | M (μB) |
|---|---|---|
α-a [100] | −6.88 | 0.02 |
α-b [010] | −6.94 | 0.00 |
α-c [001] | −6.84 | 1.98 |
β-a [100] | −6.75 | 0.00 |
β-b [010] | −6.74 | 0.00 |
β-c [001] | −6.76 | 2.62 |
α-B | −7.42 | 0.00 |
β-B | −7.39 | 0.00 |