Data archive of Proximity effects in graphene on monolayers of transition-metal phosphorus trichalcogenides MPX3

URN to cite this document:: urn:nbn:de:bvb:355-epub-593225
DOI to cite this document:: 10.5283/epub.59322

Zollner, Klaus ; Fabian, Jaroslav

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Date of publication of this fulltext: 09 Oct 2024 08:11

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Abstract

We investigate the electronic band structure of graphene on a series of two-dimensional magnetic transition -metal phosphorus trichalcogenide monolayers, MPX3 with M = {Mn,Fe,Ni,Co} and X = {S,Se}, with first-principles calculations. A symmetry-based model Hamiltonian is employed to extract orbital parameters and sublattice resolved proximity-induced exchange couplings (lambda(A)(ex) and ...