论文标题

晶粒生长过程中模拟和测量的晶粒体积变化的比较

Comparison of simulated and measured grain volume changes during grain growth

论文作者

Peng, Xiaoyao, Bhattacharya, Aditi, Naghibzadeh, S. Kiana, Kinderlehrer, David, Suter, Robert, Dayal, Kaushik, Rohrer, Gregory S.

论文摘要

在五个退火间隔后观察到的Ni的三维微观结构与使用阈值动力学方法的模拟进行了比较,并将毛细管视为唯一的驱动力。进行谷物的比较使您可以识别模拟和实验之间的差异来源。最显着的差异是最小尺寸的晶粒,模拟预测的晶粒将损失体积并以比实验中观察到的更大的速率消失。谷物的损失在其余谷物的邻居数量中造成了错误,发现模拟晶粒体积中的错误与近邻居数量的错误相关。虽然各向异性晶界特性可能在差异中起作用,但误差的大小依赖性表明,在晶界迁移动力学模型中可能有必要在模型中包含大小依赖性。

The three-dimensional microstructure of Ni, observed after five annealing intervals, was compared to simulations of grain growth using the threshold dynamics method with the assumption of capillarity as the only driving force. A grain-by-grain comparison made it possible to identify the sources of differences between the simulation and experiment. The most significant difference was for grains of the smallest sizes, which the simulation predicted would lose volume and disappear at a greater rate than observed in the experiment. The loss of grains created errors in the numbers of neighbors of the remaining grains, and it was found that errors in the simulated grain volume were correlated to errors in the number of near neighbors. While anisotropic grain boundary properties likely play a role in the differences, the size dependence of the errors suggest that it might be necessary to include a size dependence in the model for grain boundary migration kinetics.

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