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Graphical representation of the results of the theoretical work function analysis for (a) Cs(TCNQ)4, (b) K(TCNQ)4, (c) K(TCNQ)2, and (d) KTCNQ. The work function of the clean surface, ϕ, ΔEbond (light blue), ΔEMOF (light red), as defined in eq 2, the work function after adsorption, ϕads and the change in work function ΔΦ. All values are calculated at the PBE+MBD-NL level.
