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Spin-phonon relaxation rates can now be accurately computed for molecular crystals using a fraction of the basis functions, revolutionizing the study of magnetic materials.
Forget simple rules: tweaking a molecule's structure to improve spin qubit coherence is far more complex than previously thought, demanding advanced computational methods.
Three-phonon contributions to spin relaxation are typically negligible, but a small increase in spin-phonon coupling could change that, potentially opening new avenues for manipulating spin systems.
Generate novel molecules with targeted properties using generative AI while slashing the need for expensive simulations by 100x.