DeepPolaron ML-MD simulations show rutile electrons form Ti-localized polarons hopping along [001] with 39 meV barrier and 4.4e-2 cm2/Vs mobility, while anatase holes form O-localized polarons hopping to second neighbors with 139 meV barrier and 1.4e-3 cm2/Vs mobility.
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2 Pith papers cite this work. Polarity classification is still indexing.
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Nanocrystallization of LiMnBO3 glass produces a nanostructured glass-ceramic whose room-temperature conductivity is six orders of magnitude higher than the parent glass, attributed to electronic transport along grain boundaries.
citing papers explorer
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Polaron Transport in TiO$_{2}$ from Machine Learning Molecular Dynamics
DeepPolaron ML-MD simulations show rutile electrons form Ti-localized polarons hopping along [001] with 39 meV barrier and 4.4e-2 cm2/Vs mobility, while anatase holes form O-localized polarons hopping to second neighbors with 139 meV barrier and 1.4e-3 cm2/Vs mobility.
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Properties of LiMnBO3 glasses and nanostructured glass-ceramics
Nanocrystallization of LiMnBO3 glass produces a nanostructured glass-ceramic whose room-temperature conductivity is six orders of magnitude higher than the parent glass, attributed to electronic transport along grain boundaries.