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. 2022 Mar 11;13(13):3837–3844. doi: 10.1039/d1sc06666h

Fig. 1. (a–c) Transient diffusion from the CH3-cavity to the 1OH-cavity; (d–f) transition from the 2OH-cavity to the 4OH-cavity. Color code: carbon (grey), oxygen (red), hydrogen (white) and positive spin density (blue), negative density (yellow) where the isovalue is 0.001 a.u.

Fig. 1