Engineering the magnetic properties of hybrid organic-ferromagnetic interfaces by molecular chemical functionalization
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Atodiresei-2011-Engineering the magnetic properties of hybrid organic.pdf
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Author(s) • • •
Lazic, Predrag
Atodiresei, Nicolae
Caciuc, Vasile
Blügel, Stefan
Date Issued
November 2011
Journal
Physical Review B
Publisher
American Physical Society
Citation
Atodiresei, Nicolae et al. “Engineering the Magnetic Properties of Hybrid Organic-ferromagnetic Interfaces by Molecular Chemical Functionalization.” Physical Review B 84.17 (2011): Web. 18 May 2012. © 2011 American Physical Society
Version
Final published version
Abstract
We have performed systematic first-principles calculations to tailor the magnetic properties at a hybrid organic-ferromagnetic interface by adsorbing organic molecules containing π(p[subscript z]) electrons onto a magnetic substrate. For such hybrid systems, magnetic properties such as molecular magnetic moments and their spatial orientation can be specifically tuned by substituting the H atoms with more electronegative atoms such as Cl and F. This chemical functionalization process surprisingly reveals the importance of the spin-orbit coupling present at the magnetic surface–molecule interface. As a key result, our simulations indicate a direct connection between substituent electronegativity and these magnetic properties which can be exploited to design more efficient organic spintronic devices.
MIT Department
Massachusetts Institute of Technology. Department of Materials Science and Engineering
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DOI of Published Version
https://doi.org/10.1103/PhysRevB.84.172402