Molecular dynamics simulation of fatigue damage formation in single-crystal/polycrystalline aluminum

Abstract

The fatigue plasticity mechanisms and local defect characteristics of engineering materials are critical for addressing fatigue damage. This study aims to identify the formation mechanisms of fatigue damage and delineate the microstructural characteristics that resisted or facilitated fatigue-induced plastic accumulation. The fatigue mechanical properties and microstructural evolution processes of single-crystal/polycrystalline aluminum were investigated through strain-controlled fatigue testing, considering three distinct strain amplitudes. The initiation and cumulative occurrence of local plasticity in single-crystal aluminum occur at the intersections of slip planes, which serve as sources of dislocations. The cumulative formation of irreversible surface steps results in local stress concentration, ultimately leading to fatigue damage at the free surface. Polycrystalline aluminum undergoes grain rotation and merging during cyclic loading, leading to a gradual increase in grain size during plastic deformation. The initiation and cumulative occurrence of local plasticity occur at grain boundaries, ultimately leading to fatigue damage at the grain boundaries.