可见范围等离子体的二维多态:第一原则的探索
Yuefei Huang1, Sharmila N Shirodkar1, Boris I Yakobson1
1Department of Materials Science and NanoEngineering, Rice University , Houston, Texas 77005, United States.
Journal of the American Chemical Society
|November 2, 2017
概括
烯是一种新的二维材料,由于其高电子度,具有独特的等离子特性. 这些等离子体在高频率上运行,即使在可见光谱中,也不需要使用剂.
科学领域:
- 材料科学
- 凝聚物质物理学
- 纳米技术
背景情况:
- 二维 (2D) 材料具有独特的电子特性.
- 烯是一种最近发现的二维基,具有金属特性.
- 玻罗中高的自由电荷载体度表明可能存在等离子体行为.
研究的目的:
- 为了研究玻罗的等离子特性.
- 在烯结构中计算等离子频率和分散关系.
- 探索烯在纳米塑应用中的潜力.
主要方法:
- 介电函数的初始线性响应计算.
- 对选定的烯结构的等离子频率 (ω) 的计算.
- 在小波导体 (q) 极限中的等离子分散的分析.
主要成果:
- 烯电子表现得像一个二维电子气体.
- 等离子分散遵循预测的 ω √q 依赖.
- 没有减压的等离子频率延伸到近红外和可见区域.
结论:
- 烯是第一个支持高频率二维等离子体的材料.
- 烯的金属性和异构性允许微调等离子体的行为.
- 烯在纳米塑料中的应用具有显著的前景.
相关概念视频
Atomic Orbitals
An atomic orbital represents the three-dimensional regions in an atom where an electron has the highest probability to reside. The radial distribution function indicates the total probability of finding an electron within the thin shell at a distance r from the nucleus. The atomic orbitals have distinct shapes which are determined by l, the angular momentum quantum number. The orbitals are often drawn with a boundary surface, enclosing densest regions of the cloud.
VSEPR Theory and the Basic Shapes
Overview of VSEPR Theory
VSEPR Theory
Valence shell electron-pair repulsion theory (VSEPR theory) enables us to predict the molecular structure around a central atom from an examination of the number of bonds and lone electron pairs in its Lewis structure. The VSEPR model assumes that electron pairs in the valence shell of a central atom will adopt an arrangement that minimizes repulsions between these electron pairs by maximizing the distance between them. The electrons in the valence shell of a central atom form either bonding...
Two-Dimensional (2D) NMR: Overview
The 1D NMR spectrum of large and complex molecules like natural products has complicated splitting patterns and overlapping signals, which can be easily interpreted using 2-dimensional (2D) NMR. Unlike 1D NMR, 2D NMR has two frequency axes that provide the coupling information between the nucleus A and nucleus B in a molecule. The process from which 2D spectra are obtained has four steps.
The first step is the preparation period, during which nucleus A is excited with a radiofrequency pulse.
The first step is the preparation period, during which nucleus A is excited with a radiofrequency pulse.
First Law: Particles in One-dimensional Equilibrium
Newton's first law of motion states that a body at rest remains at rest, or if in motion, remains in motion at constant velocity, unless acted on by a net external force. It also states that there must be a cause for any change in velocity (a change in either magnitude or direction) to occur. This cause is a net external force. For example, consider what happens to an object sliding along a rough horizontal surface. The object quickly grinds to a halt, due to the net force of friction. If we...
First Law: Particles in Two-dimensional Equilibrium
Recall that a particle in equilibrium is one for which the external forces are balanced. Static equilibrium involves objects at rest, and dynamic equilibrium involves objects in motion without acceleration; but it is important to remember that these conditions are relative. For instance, an object may be at rest when viewed from one frame of reference, but that same object would appear to be in motion when viewed by someone moving at a constant velocity.
Newton's first law tells us about the...
Newton's first law tells us about the...


