A continual fine-tuning protocol for machine-learned interatomic potentials enables large-scale simulation of amino-silane passivation at hybrid perovskite surfaces, revealing coverage-dependent lattice disruption.
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Data-driven atomistic modelling of hybrid halide perovskite passivation
A continual fine-tuning protocol for machine-learned interatomic potentials enables large-scale simulation of amino-silane passivation at hybrid perovskite surfaces, revealing coverage-dependent lattice disruption.