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. 2024 May 30;146(23):16184–16193. doi: 10.1021/jacs.4c04045

Figure 3.

Figure 3

(a) Relative energy of the polaritonic ground states between the ortho intermediate and the meta intermediate Inline graphic when the cavity polarization is Inline graphic. (b) Relative energy of the para intermediate and the meta intermediate Inline graphic for Inline graphic. These relative energies are reported as functions of the cavity mode volume Inline graphic and cavity frequency ωc. The color scales indicate the relative energy, with red showing thermodynamic favorability for the meta-substituted cation and blue for the other. The black open circles correspond to a cavity volume of Inline graphic = 0.15 nm3 and a cavity frequency of ωc = 1.8 eV. This volume corresponds to A0 = 0.3 a.u. and Inline graphic a.u.