Limited Ferromagnetic Interactions in Monolayers of MPS3(M = Mn and Ni)

We present a systematic study of the electronic and magnetic properties of two-dimensional ordered alloys, consisting of two representative hosts (MnPS3 and NiPS3) of transition metal phosphorus trichalcogenides doped with 3d elements. For both hosts, our DFT + U calculations are able to qualitative...

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Bibliographic Details
Main Authors: Agrapidis, C.E (Author), Autieri, C. (Author), Birowska, M. (Author), Cuono, G. (Author), Kotur, K.M (Author), Noce, C. (Author), Rybak, M. (Author), Wohlfeld, K. (Author)
Format: Article
Language:English
Published: American Chemical Society 2022
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