Strain-induced frustrated helimagnetism and topological spin textures in LiCrTe$_{2}$

TL;DR

This study uses first-principles calculations and Monte Carlo simulations to explore how in-plane compressive strain induces frustrated helimagnetism and topological spin textures in LiCrTe₂, revealing new magnetic phases and defect structures.

Contribution

It demonstrates how strain can induce and control frustrated and topological magnetic states in LiCrTe₂, providing insights for engineering magnetic properties in 2D materials.

Findings

Strain causes a transition from ferromagnetic to antiferromagnetic states.

A highly frustrated helimagnetic phase with disordered spin spirals emerges under moderate strain.

Topological spin defects can be tuned with external magnetic fields.

Abstract

By performing first-principles calculations in conjunction with Monte Carlo simulations, we systematically investigated the frustrated magnetic states induced by in-plane compressive strain in LiCrTe$_{2}$. Our calculations support that the magnetic ground state of LiCrTe$_{2}$ crystal is A-type antiferromagnetic (AFM), with an in-plane ferromagnetic (FM) state and interlayer AFM coupling. Furthermore, it is found that compressive strain can significantly alter the magnetic interactions, giving rise to a transition from an in-plane FM to an AFM state, undergoing a helimagnetic phase. Remarkably, a highly frustrated helimagnetic state with disordered spin spirals under moderate strain arises from the competition between spiral propagation modes along distinct directions. In addition, various topological spin defects emerge in this frustrated helimagnetic phase, which are assembled from various domain wall units. These topological defects can be further tuned with external magnetic fields. Our calculations not only uncover the origin of exotic frustrated magnetism in triangular lattice magnetic systems, but also offer a promising route to engineer the frustrated and topological magnetic state, which is of significance in both fundamental research and technological applications.