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Tailoring spin-exchange interactions and topological magnons in 2D ferromagnetic van der Waals bilayer via multiple stacking orders: A first-principles study
Phys. Rev. Materials 10, 024407 – Published 17 February, 2026
DOI: https://doi.org/10.1103/kd5v-grhn
Abstract
Discovery of two-dimensional ferromagnetic van der Waals chromium triiodide () opens new avenues toward tunable terahertz topological magnon via stacking order control in a multilayer system. We theoretically simulated magnetism and topological magnon modulation in multiple stacking orders by means of first-principles and linear spin-wave theory calculations. The first-nearest-neighbor spin-exchange interactions are enhanced up to 100% from those in monolayer due to degeneracy lifting in orbitals induced by broken symmetry from the addition of monolayer. Furthermore, interfacial charge transfer from the monolayer to atom in the bottom sublayer induces finite Dzyaloshinskii-Moriya interactions of first-nearest-neighboring atoms and enhances those of second-nearest-neighboring atoms. Magnon Dirac gaps in bilayer are open wider than those in monolayer at the edge of the Brillouin zone, attributed to the enhanced second-nearest-neighbor Dzyaloshinskii-Moriya interactions. The magnon dispersion in a nanoribbon geometry exhibits localized magnon edge states, and the existence of localized edge states is unique to a certain periodicity direction relative to the crystallographic direction in the stacking order with broken rotational symmetry.
Physics Subject Headings (PhySH)
Corrections
16 March, 2026
Correction: The elements As and I were erroneously set as Bi in several locations throughout the paper and have been fixed.