A machine-learning framework for accelerating spin-lattice relaxation simulations

Abstract Molecular and lattice vibrations are able to couple to the spin of electrons and lead to their relaxation and decoherence. Ab initio simulations have played a fundamental role in shaping our understanding of this process but further progress is hindered by their high computational cost. Her...

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Bibliographic Details
Main Authors: Valerio Briganti, Alessandro Lunghi
Format: Article
Language:English
Published: Nature Portfolio 2025-03-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-025-01547-z