铁电的起源在两个原型混合有机-无机矿中
Kai Li1, Zhi-Gang Li1, Jun Xu1
1School of Materials Science and Engineering & Tianjin Key Laboratory of Metal and Molecule-Based Material Chemistry, Nankai University, Tianjin 300350, China.
Journal of the American Chemical Society
|January 10, 2022
概括
振动驱动混合有机-无机矿 (HOIP) 的铁电过渡. 了解这些原子动力学是操作HOIP用于先进的铁电应用的关键.
科学领域:
- 材料科学
- 固态物理
- 晶体学
背景情况:
- 由于其高性能和易于合成,混合有机-无机矿 (HOIP) 是有前途的铁电材料.
- 在HOIP中基础的热力学机制需要进一步研究.
研究的目的:
- 阐明移位性[CH3) 2NH2][Mn(N3) 3和秩序-混乱类型[CH3) 2NH2][Mn(HCOO) 3HOIP中的铁电相变的性质.
- 确定这些材料中控制铁电性的关键热力学因素.
主要方法:
- 在空间上进行结构分析.
- 一开始的格子动态计算.
主要成果:
- [CH3) 2NH2][Mn(N3) 3中的铁电转换是由矿网的振动变化驱动的.
- 振动变化和A位点旋转变化对[]2NH2[]中的铁电过渡有很大影响.
- 原子动态,包括局部和扩展的格子波动,在HOIP中的铁电中起着至关重要的作用.
结论:
- 这项研究表明,格子振动和A位点动态对于HOIP中的铁电过渡至关重要.
- 这些发现突出了在HOIP中操纵原子,电子和声音自由度的潜力,以设计铁电性质.
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