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Experimental characterization and atomistic simulation of grain boundary segregation in Mg-Y alloys

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摘要 As a rare earth solute element in Mg alloys,Y has the beneficial effects of increasing both the strength and the ductility as well as weakening the crystallographic texture.To achieve a more fundamental understanding on how Y addition affects the microstructural evolution and mechanical properties,the Y segregation behavior at grain boundaries was investigated in Mg-1wt.%Y and Mg-7wt.%Y alloys at different conditions.The segregation intensity and its dependence on the grain boundary misorientation angle were experimentally characterized and computationally predicted.Strong segregation at grain boundaries was observed in both low and high Y-containing alloys.Y segregation was found to remain in alloy Mg-7Y after high-temperature annealing heat treatment at 540℃.No direct correlation between the Y segregation intensity and the grain boundary misorientation angle could be established based on either the experimental characterization or the atomistic simulation with a spectral model.We thus conclude that grain boundary segregation of Y is independent of grain boundary misorientation angle.
出处 《Journal of Magnesium and Alloys》 2025年第6期2509-2521,共13页 镁合金学报(英文)
基金 supported by PRISMS(PRedictive Integrated Structural Materials Science)center which is located at University of Michigan and funded by U.S.Department of Energy,Office of Basic Energy Science,Division of Materials Science and Engineering(Grant award number DE-SC0008637) support from Michigan Center for Materials Characterization(MC2)at University of Michigan and Canmet MATERIALS,Natural Resources Canada the Extreme Science and Engineering Discovery Environment(XSEDE)Stampede2 at the TACC through allocation TG-MSS160003 the National Energy Research Scientific Computing Center(NERSC),a U.S.Department of Energy Office of Science User Facility operated under Contract No.DE-AC02-05CH11231。
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