DFT Study on Adiabatic and Vertical Ionization Potentials of Graphene Sheets

Table 1

Experimental and theoretical data on IPA and IPV of coronene.

Compound	B3LYP/SVP		PBE0/SVP		Experiment
	IPA	IPV	IPA	IPV	IPA	IPV
Coronene	6.930	6.990	7.146	7.210	7.26 ± 0.05 [27]; 7.29 [28]; 7.44 [29]; 7.64 [30]	7.29 [31]; 7.34 [32]