. 2016 Nov 1;1(5):765–772. doi: 10.1021/acsomega.6b00249

Table 7. DF-MP2/6-31+G* Reaction Energies (kcal/mol) for the Formation of Noble Gas Molecules on Coronene.

reactions	energy
coronene + Ne → coroneneNe	–5.6
coroneneNe + CCH⁺ → coronene + NeCCH⁺	–38.4
coroneneNe + ^•H₂⁺ → coronene + ^•NeH₂⁺	47.1
coroneneNe + H₃⁺ → coronene + NeH₃⁺	3.7
coroneneNe + OH⁺ → coronene + NeOH⁺	–10.1
coroneneNe + ^•NH⁺ → coronene + ^•NeNH⁺	2.7
coronene + Ar → coroneneAr	–8.8
coroneneAr + CCH⁺ → coronene + ArCCH⁺	–94.0
coroneneAr + ^•H₂⁺ → coronene + ^•ArH₂⁺	11.9
coroneneAr + H₃⁺ → coronene + ArH₃⁺	4.6
coroeneAr + OH⁺ → coronene + ArOH⁺	–70.8
coroneneAr + ^•NH⁺ → coronene + ^•ArNH⁺	–28.5
coroneneAr + CN⁺ → coronene + ArCN⁺	–42.5