Electronic transport properties of (fluorinated) metal phthalocyanine

The magnetic and transport properties of the metal phthalocyanine (MPc) and F _16 MPc (M = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn and Ag) families of molecules in contact with S–Au wires are investigated by density functional theory within the local density approximation, including local electronic c...

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Bibliographic Details
Main Authors: M M Fadlallah, U Eckern, A H Romero, U Schwingenschlögl
Format: Article
Language:English
Published: IOP Publishing 2015-01-01
Series:New Journal of Physics
Subjects:
Online Access:https://doi.org/10.1088/1367-2630/18/1/013003