. 2024 Mar 18;14(13):8896–8904. doi: 10.1039/d4ra01310g

Computed bond distances (Å), lattice constant (a (Å)), changes in bond lengths (Δ (Å)), binding energies (E_b (eV)) and volume ((Å)³) of fullerene and 2D III-nitrides composites.

Composite	X–C	X–N	C–N	a	Δ	E _b	V
C₆₀@BN	2.9	1.48	3.07	12.78	0.03	−0.94	2903.19
C₆₀@AlN	3.17	1.82	3.18	15.64	0.02	−1.8	4241.9
C₆₀@GaN	3.24	1.87	3.29	15.94	0.07	−2.17	4445.8
C₆₀@InN	3.0	2.11	2.92	17.75	0.06	−2.20	5713.49

Computed bond distances (Å), lattice constant (a (Å)), changes in bond lengths (Δ (Å)), binding energies (Eb (eV)) and volume ((Å)3) of fullerene and 2D III-nitrides composites.