在二维D_{3d}晶体中的平面柔电性
Matteo Springolo1, Miquel Royo1, Massimiliano Stengel1,2
1Institut de Ciència de Materials de Barcelona (ICMAB-CSIC), Campus UAB, 08193 Bellaterra, Spain.
研究人员预测,由于曲,三角形二维晶体的平面极化反应会显著. 这种柔电效应对于电子应用至关重要,比以前观察到的平面外反应更大.
科学领域:
- 凝聚物质物理学 凝聚物质物理学
- 材料科学 材料科学 材料科学
- 纳米技术 纳米技术
背景情况:
- 二维 (2D) 晶体具有独特的电子和机械性能.
- 柔电性,即通过应变诱导极化,是介电材料中的一个关键现象.
- 了解2D材料的应变诱导极化对于新型设备应用至关重要.
研究的目的:
- 预测和量化三角形2D晶体曲的平面极化反应.
- 从第一原则计算中计算柔电系数.
- 探索这种平面内响应的拓学和声学含义.
主要方法:
- 使用原始晶体细胞进行第一原则计算.
- 线性响应理论用于确定柔电系数.
- 在曲和波纹结构中分析极化纹理.
- 计算曲折声子诱导的电场.
主要成果:
- 在各种三角形2D晶体 (例如,SnS2,,,RhI3,h-BN双层) 中,预测了对曲的很大平面极化反应.
- 发现在平面内的柔电系数比在平面外的对应系数高出一个数量级.
- 计算了与曲和波纹相关的拓极化纹理.
- 通过曲声子诱导的纵向电场被确定.
结论:
- 三角形2D晶体表现出显著的平面内柔电效应,为应变工程电子提供了新的途径.
- 这种飞机内反应的巨大程度超过了典型的飞机外贡献.
- 这些发现对2D材料的拓性质和语音介导电子现象有影响.
更多相关视频
09:06Visualizing Uniaxial-strain Manipulation of Antiferromagnetic Domains in Fe1+YTe Using a Spin-polarized Scanning Tunneling Microscope
Published on: March 24, 2019
10:40A Fabrication and Measurement Method for a Flexible Ferroelectric Element Based on Van Der Waals Heteroepitaxy
Published on: April 8, 2018
相关概念视频
Crystal Field Theory - Tetrahedral and Square Planar Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
Crystal Field Theory - Octahedral Complexes
To explain the observed behavior of transition metal complexes (such as colors), a model involving electrostatic interactions between the electrons from the ligands and the electrons in the unhybridized d orbitals of the central metal atom has been developed. This electrostatic model is crystal field theory (CFT). It helps to understand, interpret, and predict the colors, magnetic behavior, and some structures of coordination compounds of transition metals.
CFT focuses on...
X-ray Crystallography
Diffraction
Diffraction is the change in the direction of travel experienced by an electromagnetic wave when it encounters a physical barrier whose dimensions are comparable to those of the wavelength of the light. X-rays are electromagnetic radiation with wavelengths about as long as the distance between neighboring...
Electrostatic Boundary Conditions in Dielectrics
Consider a case where both the mediums across a boundary are two different dielectric materials. Recall that the electric field and electric displacement are proportional and related through the material's...
Dielectric Polarization in a Capacitor
Three-Dimensional Analysis of Strain
