Engineering Substrate Interactions for High Luminescence Efficiency of Transition‐Metal Dichalcogenide Monolayers

It is demonstrated that the luminescence efficiency of monolayers composed of MoS 2 , WS 2 , and WSe 2 is significantly limited by the substrate and can be improved by orders of magnitude through substrate engineering. The substrate affects the efficiency mainly through doping the monolayers and facilitating defect‐assisted nonradiative exciton recombinations, while the other substrate effects including straining and dielectric screening play minor roles. The doping may come from the substrate and substrate‐borne water moisture, the latter of which is much stronger than the former for MoS 2 and WS 2 but negligible for WSe 2 . Using proper substrates such as mica or hexagonal boron nitride can substantially mitigate the doping effect. The defect‐assisted recombination depends on the interaction between the defect in the monolayer and the substrate. Suspended monolayers, in which the substrate effects are eliminated, may have efficiency up to 40% at room temperatures. The result provides useful guidance for the rational design of atomic‐scale light emission devices.