在Ag{100}上复杂的甲分子表面扩散机制
Grażyna Antczak1, Wojciech Kamiński1, Agata Sabik1
1Institute of Experimental Physics, University of Wrocław , Wrocław, Poland.
Journal of the American Chemical Society
|November 20, 2015
概括
在银表面上的甲 (CoPc) 分子转换和旋转. 这种由两个扩散通道解释的联合运动,解释了实验中观察到的更高的转换率.
科学领域:
- 表面科学
- 物理化学
- 材料科学
背景情况:
- 了解表面的分子行为对于催化和纳米电子非常重要.
- 甲 (CoPc) 是一个有趣的分子,其电子和磁性特性.
研究的目的:
- 调查甲 (CoPc) 在Ag100表面的基本表面扩散机制.
- 阐明分子运动中的转换和旋转之间的相互作用.
主要方法:
- 在低温度 (4350K) 进行时间间隔扫描道显微镜 (STM).
- 密度函数理论 (DFT) 计算以确定激活能量和扩散途径.
主要成果:
- 在研究的温度范围内,CoPc分子在Ag{100}表面表现出翻译和旋转.
- 只有在考虑组合转移和旋转运动时,DFT计算才能显示与实验观测一致的激活能量.
- 确定了两个不同的传播道:一个仅用于翻译,另一个用于翻译和旋转.
结论:
- 在Ag(100) 上的CoPc表面扩散是一个复杂的过程,涉及合转换和旋转.
- 两个扩散通道的存在解释了实验观察到的分子翻译的更高频率.
更多相关视频
06:28Self-Assembly of Hybrid Lipid Membranes Doped with Hydrophobic Organic Molecules at the Water/Air Interface
Published on: May 1, 2020
4.1K
08:40Synthesis of Metal Nanoparticles Supported on Carbon Nanotube with Doped Co and N Atoms and its Catalytic Applications in Hydrogen Production
Published on: December 6, 2021
4.4K
相关概念视频
Colors and Magnetism
14.6K
Color in Coordination Complexes
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human...
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human...
14.6K
Crystal Field Theory - Octahedral Complexes
31.8K
Crystal Field Theory
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...
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...
31.8K
Colloidal precipitates
6.8K
The high insolubility of some precipitates can result in an unfavorable relative supersaturation. This can lead to colloidal particles with a large surface-to-mass ratio, where adsorption is promoted. For instance, in the precipitation of silver chloride, silver ions are adsorbed on the surface of the colloidal particles, forming a primary layer. This layer attracts ions of opposite charge (such as nitrate ions), forming a diffuse secondary layer of adsorbed ions. This electric double layer...
6.8K
Valence Bond Theory
11.7K
Coordination compounds and complexes exhibit different colors, geometries, and magnetic behavior, depending on the metal atom/ion and ligands from which they are composed. In an attempt to explain the bonding and structure of coordination complexes, Linus Pauling proposed the valence bond theory, or VBT, using the concepts of hybridization and the overlapping of the atomic orbitals. According to VBT, the central metal atom or ion (Lewis acid) hybridizes to provide empty orbitals of suitable...
11.7K
Interfacial Electrochemical Methods: Overview
1.1K
Interfacial electrochemical methods focus on the phenomena occurring at the boundary between an electrode and a solution, as opposed to bulk methods that concentrate on the solution's overall properties. These interfacial methods are classified as either static or dynamic based on the presence of a nonzero current in the electrochemical cell and the consistency of analyte concentrations. Static methods, such as potentiometry, measure the cell's potential without any significant current...
1.1K
Heterogeneous Catalysis
109
Heterogeneous catalysis involves a catalyst in a different phase from the reactants. It is a process where the catalyst and the reactants are in distinct phases, typically solid and gas or liquid.Most heterogeneous catalysts are metals, metal oxides, or acids. The list includes transition metals like iron (Fe), cobalt (Co), nickel (Ni), palladium (Pd), platinum (Pt), chromium (Cr), manganese (Mn), tungsten (W), silver (Ag), and copper (Cu). These metals possess partially vacant d orbitals that...
109
