2023
DOI: 10.48550/arxiv.2301.05557
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Vibronic Effects on the Quantum Tunnelling of Magnetisation in Single-Molecule Magnets

Abstract: Single-molecule magnets are among the most promising platforms for achieving molecular-scale data storage and processing. Their magnetisation dynamics are determined by the interplay between electronic and vibrational degrees of freedom, which can couple coherently, leading to complex vibronic dynamics. Building on an ab initio description of the electronic and vibrational Hamiltonians, we formulate a non-perturbative vibronic model of the low-energy magnetic degrees of freedom in a single-molecule magnet, whi… Show more

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