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arXiv · 2606.21266

Strain induced magnetic phase transitions in Fe3GeTe2 monolayer

Anjali Jyothi Bhasu·Satish Kumar·Mátyás Török·Dániel Tibor Pozsár·Bendegúz Nyári·László Udvardi·Gabriel Martínez-Carracedo·Balázs Nagyfalusi·Amador García-Fuente·Jaime Ferrer·Zoltán Tajkov·László Oroszlány·Levente Rózsa·László Szunyogh
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Abstract

We investigate the magnetic properties of a monolayer of Fe3GeTe2 as a function of the lattice constant by combining first-principles calculations with atomistic spin dynamics simulations. The calculated magnetic exchange interactions reveal a competition between ferromagnetic and antiferromagnetic couplings, with the latter being significantly strengthened under compressive strain. Stochastic Landau-Lifshitz-Gilbert simulations reveal a substantial decrease in the Curie temperature with decreasing lattice constant, and predict a transition of the magnetic ground state from a ferromagnetic configuration to a conical spin-spiral state. We introduce a simple spin-model which explains the stabilization of the spiral phase due to competing exchange interactions. We found multiple magnetic phase transitions involving ferromagnetic, conical spin-spiral, and planar Neel states, depending on both the lattice constant and the temperature. The absence of Dzyaloshinskii-Moriya interactions is found to significantly reduce the Neel temperature, while leaving the Curie temperature largely unaffected. Our findings reveal the importance of lattice distortions in controlling complex magnetic phases and their evolution with temperature.

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Anjali Jyothi Bhasu, Satish Kumar, Mátyás Török, Dániel Tibor Pozsár, Bendegúz Nyári, László Udvardi, Gabriel Martínez-Carracedo, Balázs Nagyfalusi, Amador García-Fuente, Jaime Ferrer, Zoltán Tajkov, László Oroszlány, Levente Rózsa, László Szunyogh. 2026-06-19. Strain induced magnetic phase transitions in Fe3GeTe2 monolayer. https://arxiv.org/abs/2606.21266

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