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Grain boundaries are Brownian ratchets

Caihao Qiu, Maik Punke, Yuan Tian, Ying Han, Siqi Wang, Yishi Su, Marco Salvalaglio, Xiaoqing Pan, David J. Srolovitz, Jian Han

2024Science29 citationsDOI

Abstract

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 nonsymmetric GBs but not for symmetric ones. Our observations build on 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.

Topics & Concepts

Grain boundaryRatchetBrownian motionMicrostructureThermalMarkov chainMolecular dynamicsAnnealing (glass)Brownian dynamicsCrystalliteMaterials scienceStatistical physicsCondensed matter physicsChemical physicsPhysicsComposite materialThermodynamicsWork (physics)Computer scienceMetallurgyQuantum mechanicsMachine learningSolidification and crystal growth phenomenaTheoretical and Computational PhysicsMicrostructure and mechanical properties
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