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Structures and properties of self-assembled monolayers of bistable [2]rotaxanes on Au (111) surfaces from molecular dynamics simulations validated by experiment

Structures and properties of self-assembled monolayers of bistable [2]rotaxanes on Au (111) surfaces from molecular dynamics simulations validated by experiment, (S. S. Jang, Y. H. Jang, Y. -H. Kim, W. A. Goddard III, A. H. Flood, B. W. Laursen, H. -R. Tseng, J. F. Stoddart, J. O. Jeppesen, J. W. Choi, D. W. Steuerman, E. DeIonno, J. R. Heath), J. Am. Chem. Soc. 2005, 127, 1563–1575.