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Growth mechanism for nanotips in high electric fields

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arxiv 1909.05825 v2 pith:HNFT6VE3 submitted 2019-09-12 cond-mat.mtrl-sci

Growth mechanism for nanotips in high electric fields

classification cond-mat.mtrl-sci
keywords electricfieldsbeenmodelbiaseddiffusionfieldgrowth
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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In this work we show using atomistic simulations that the biased diffusion in high electric field gradients creates a mechanism whereby nanotips may start growing from small surface asperities. It has long been known that atoms on a metallic surface have biased diffusion if electric fields are applied and that microscopic tips may be sharpened using fields, but the exact mechanisms have not been well understood. Our Kinetic Monte Carlo simulation model uses a recently developed theory for how the migration barriers are affected by the presence of an electric field. All parameters of the model are physically motivated and no fitting parameters are used. The model has been validated by reproducing characteristic faceting patterns of tungsten surfaces that have in previous experiments been observed to only appear in the presence of strong electric fields. The growth effect is found to be enhanced by increasing fields and temperatures.

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