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Computational investigations on the microstructure formation in real alloy systems based on the phase field method

机译:基于相场法的实际合金系统微观结构形成的计算研究

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The kinetic simulation based on the non-linear diffusion equation becomes a very powerful method in fundamental understanding the dynamics of phase transformation with recent remarkable development of the computer. In the present study, we calculate the dynamics of microstructure changes in real alloy systems, i.e. Fe-Mo, Al-Zn and Fe-Al-Co based on the phase field method. The composition dependencies of atomic interchange energy are taken into account so as to be applicable for the phase diagram of the real alloy systems. The elasticity and mobility of atoms are assumed to depend on the local order parameters such as the composition, the degree of order, etc. Time dependent morphological changes of the microstructure such as formation of modulated structure by spinodal decomposition, strain induced morphological changes of precipitates, the order-disorder phase transition with phase decomposition will be demonstrated. The results simulated are quantitatively in good agreement with the experimental results in the real alloy systems.
机译:基于非线性扩散方程的动力学模拟成为了基本上理解相变动态的基础知识的方法,其计算机近似显着发展。在本研究中,我们基于相现场方法计算真实合金系统中的微观结构变化的动态,即Fe-Mo,Al-Zn和Fe-Al-Co。考虑原子交换能量的组成依赖性,以适用于真正合金系统的相图。假设原子的弹性和迁移率取决于局部秩序参数,例如组合物,顺序程度等。通过旋光性分解的沉淀物的形态变化,沉淀物的形态变化,诸如组合物的局部顺序等的局部顺序参数。 ,将证明具有相位分解的秩序紊乱相转变。模拟的结果与真正合金系统中的实验结果非常吻合。

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