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Growth prediction method for new biocompatible piezoelectric thin films

机译:新型生物相容性压电薄膜的生长预测方法

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We have focused on MgSiO (Magnesium Silicate) which is a new biocompatible piezoelectric material having large spontaneous polarization. Then, crystal thin film growth prediction method was improved in order to predict growth orientation of the non-preferred orientation direction. Calculated total energy in each orientation of distorted crystal by the buffer layer was compared to the value in the stable structure. Total energy difference between the stable state and each crystal orientation pattern showed a trend similar to that of the X-ray peak intensity. Then, energy difference needed to be below 0.001 eV for crystal to be grown.
机译:我们已经聚焦于MgSiO(硅酸镁),这是一种具有大自然极化的新型生物相容性压电材料。然后,改进了晶体薄膜生长预测方法,以预测非优选取向方向的生长取向。将缓冲层在扭曲晶体的每个方向上计算出的总能量与稳定结构中的值进行比较。稳态和每个晶体取向图案之间的总能量差显示出与X射线峰强度相似的趋势。然后,晶体生长所需的能量差必须低于0.001 eV。

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