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Dr. Yuta Tsuji, Takayuki Semoto and Prof. Kazunari Yoshizawa A Bipodal Dicyano Anchor Unit for Single-Molecule Spintronic Devices ChemPhysChem 14

Article first published online: 5 JUN 2013 | DOI: 10.1002/cphc.201300136

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Get a grip! A new type of anchor unit based on the dicyano group is proposed by using sophisticated first-principles quantum chemical calculations. The energy of the LUMO is lowered by the electron-withdrawing dicyano anchor group. This low-lying LUMO level plays a crucial role in determining the spin filtering efficiency of molecular junctions (see picture).

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