Multiscale simulation data for demonstrating the analogy between grain boundaries and Brownian ratchets

We demonstrate that grain boundaries (GBs) behave as Brownian ratchets, exhibiting direction-dependent mobilities and unidirectional motion under oscillatory driving forces or cyclic thermal annealing. We observed these phenomena for nearly all non-symmetric GBs but not for symmetric ones. Our obser...

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Hauptverfasser: Qiu, Caihao, Punke, Maik, Tian, Yuan, Han, Ying, Wang, Siqi, Su, Yishi, Salvalaglio, Marco, Pan, Xiaoqing, Srolovitz, David, Han, Jian
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Sprache:eng
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Zusammenfassung:We demonstrate that grain boundaries (GBs) behave as Brownian ratchets, exhibiting direction-dependent mobilities and unidirectional motion under oscillatory driving forces or cyclic thermal annealing. We observed these phenomena for nearly all non-symmetric GBs but not for symmetric ones. Our observations build upon molecular dynamics and phase-field crystal simulations for a wide range of GB types and driving forces in both bicrystal and polycrystalline microstructures. We corroborate these simulation results through in situ experimental observations. We analyze these results with a Markov chain model and explore the implications of GB ratchet behavior for materials processing and microstructure tailoring.
DOI:10.5061/dryad.0k6djhb8v