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Computer Simulation of Hydride Precipitation in Bi-crystalline Zirconium

机译:双晶锆中氢化物沉淀的计算机模拟

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摘要

γ-hydride precipitation and growth in a zirconium bi-crystal were simulated using a phase field kinetic model. The temporal evolution of the spatially dependent field variables is determined by numerically solving the time-dependent Ginzburg-Landau equations for the structural variables and the Cahn-Hilliard diffusion equation for the concentration variable. The morphology evolution of γ-hydride with and without external load was simulated. It is demonstrated that nucleation density of the hydride at the grain boundary increases as compared to the bulk and favorable hydride precipitation at the grain boundary become weaker when an external load is applied.
机译:使用相场动力学模型模拟了锆双晶体中γ-氢化物的沉淀和生长。通过数值求解结构变量的时间相关Ginzburg-Landau方程和浓度变量的Cahn-Hilliard扩散方程,可确定空间相关场变量的时间演化。模拟了有和没有外载荷时γ-氢化物的形貌演化。结果表明,与大块相比,晶界处氢化物的成核密度增加,当施加外载荷时,在晶界处有利的氢化物沉淀变弱。

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