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000188913 1001_ $$0P:(DE-Juel1)157874$$aFriedrich, Rico$$b0$$eCorresponding Author
000188913 245__ $$aChemically functionalized magnetic exchange interactions of hybrid organic-ferromagnetic metal interfaces
000188913 260__ $$aCollege Park, Md.$$bAPS$$c2015
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000188913 520__ $$aWe theoretically explore through systematic multiscale ab initio and Monte Carlo calculations how the surface magnetism of a ferromagnetic surface can be fine-tuned by nonmagnetic organic molecules containing a single π bond. We demonstrate that a magnetic hardening or softening can be induced depending on the electronegativity of the heteroatom or when the π-bond “bridges” the magnetic surface atoms. Finally, the Monte Carlo simulations revealed taylored macroscopic hysteresis loops corresponding to soft and hard molecule-surface magnets.
000188913 536__ $$0G:(DE-HGF)POF3-142$$a142 - Controlling Spin-Based Phenomena (POF3-142)$$cPOF3-142$$fPOF III$$x0
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000188913 542__ $$2Crossref$$i2016-03-24$$uhttp://link.aps.org/licenses/aps-default-accepted-manuscript-license
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000188913 7001_ $$0P:(DE-Juel1)130583$$aCaciuc, Vasile$$b1
000188913 7001_ $$0P:(DE-Juel1)145390$$aKiselev, Nikolai$$b2
000188913 7001_ $$0P:(DE-Juel1)130513$$aAtodiresei, Nicolae$$b3
000188913 7001_ $$0P:(DE-Juel1)130548$$aBlügel, Stefan$$b4
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000188913 773__ $$0PERI:(DE-600)2844160-6$$a10.1103/PhysRevB.91.115432$$gVol. 91, no. 11, p. 115432$$n11$$p115432$$tPhysical review / B$$v91$$x1098-0121$$y2015
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