Adsorption Properties of NF₃ and N₂O on Al- and Ga-Doped Graphene Surface: A Density Functional Theory Study

Table 3

The E_ad, Q_t, and structural parameters of the N₂O-adsorbed Al-Graphene.

Configuration	(eV)	Qt(e)	dads(Å)	dN1-N2(Å)	dN2-O(Å)
M1	-1.376	0.238	2.035	1.143	1.180
M2	-1.407	0.212	2.080	1.148	1.180
M3	-1.240	0.204	2.157	1.214	1.133