在自组装纳米晶体超级网格中的定向顺序
Zhaochuan Fan1, Michael Grünwald1
1Department of Chemistry , University of Utah , Salt Lake City , Utah 84112 , United States.
Journal of the American Chemical Society
|January 11, 2019
概括
分子动力学模拟揭示了连接体长度和溶剂条件如何控制纳米晶体的自我组装成各种各样的超结构. 这些因素的微妙变化决定了最终的布局,指导了目标材料设计.
科学领域:
- 材料科学
- 纳米技术
- 计算化学
背景情况:
- 对溶液中纳米粒子相互作用的精确控制对于自组装功能材料至关重要.
- 在纳米晶体表面上的有机配体主导着粒子间相互作用.
- 实验研究显示了来自截断八面体纳米晶体的多种超结构,但其起源尚不清楚.
研究的目的:
- 通过分子动力学模拟来研究纳米晶体的自我组装.
- 了解连接体长度和溶剂条件对上层结构形成的影响.
- 在纳米晶体自组合中观察到的结构多样性的合理化.
主要方法:
- 粗粒度分子动力学计算机模拟.
- 连接体长度和溶剂条件的系统变化.
- 纳米粒子相互作用和自由能量的分析.
主要成果:
- 模拟模型成功地复制了实验观察到的超级结构,包括具有部分方向顺序的超级格子.
- 纳米粒子形状,配体特性和溶剂条件的小变化导致了自我组装结构的显著差异.
- 细微的变化在配体相互作用的自由能量被确定为结构多样性的原因.
结论:
- 体介导的相互作用和溶剂效应是纳米晶体自组结果的关键决定因素.
- 这些发现解释了由类似的纳米晶体形成的各种超级晶体.
- 这项工作为先进材料的纳米晶体超结构的定向设计提供了框架.
相关概念视频
Location and Orientation of the Heart
10.1K
The human heart, despite its modest size and weight, is an organ of remarkable strength and endurance. Roughly the size of a fist, the heart weighs between 250 and 350 grams and is nestled within the mediastinum, the medial cavity of the thorax. It extends obliquely for about 12 to 14 cm, resting on the superior surface of the diaphragm. The heart is positioned anterior to the vertebral column and posterior to the sternum, with two-thirds of its mass lying to the left of the midsternal line.
10.1K
Protein Complex Assembly
16.7K
Proteins can form homomeric complexes with another unit of the same protein or heteromeric complexes with different types. Most protein complexes self-assemble spontaneously via ordered pathways, while some proteins need assembly factors that guide their proper assembly. Despite the crowded intracellular environment, proteins usually interact with their correct partners and form functional complexes.
Many viruses self-assemble into a fully functional unit using the infected host cell to...
Many viruses self-assemble into a fully functional unit using the infected host cell to...
16.7K
Protein Complex Assembly
2.6K
2.6K
Methods of Documentation I: Source-Oriented Records
1.7K
Source-oriented records, or SOR, are medical record-keeping organized by the data source. The SOR system was first developed in the mid-1900s to organize the growing patient data in hospitals and other healthcare facilities.
In an SOR, each discipline involved in patient care maintains a separate medical record section. This record-keeping method enables easy tracking of patient progress and ensures healthcare staff have access to up-to-date information.
Key Attributes include the following:
In an SOR, each discipline involved in patient care maintains a separate medical record section. This record-keeping method enables easy tracking of patient progress and ensures healthcare staff have access to up-to-date information.
Key Attributes include the following:
1.7K
Spindle Assembly
4.3K
Spindle assembly occurs through three, often coexisting, pathways – the centrosome-mediated pathway, the chromatin-mediated pathway, and the microtubule-mediated pathway – collectively contributing to form a robust spindle apparatus.
In most cells, centrosomes are the primary microtubule nucleation centers. In the centrosome-mediated pathway, the G2-prophase transition triggers centrosome maturation and increased microtubule nucleation. Progressive nucleation results in a...
In most cells, centrosomes are the primary microtubule nucleation centers. In the centrosome-mediated pathway, the G2-prophase transition triggers centrosome maturation and increased microtubule nucleation. Progressive nucleation results in a...
4.3K
Oligosaccharide Assembly
3.7K
Protein glycosylation starts in the ER lumen and continues in the Golgi apparatus. Glycosyltransferases catalyze the addition of sugar molecules or glycosylation of proteins. Usually, these enzymes add sugars to the hydroxyl groups of selected serine or threonine residues to form O-linked glycans or the amino groups of asparagine residues to form N-linked glycans. Different positions on the same polypeptide chain can contain differently linked glycans.
Multiple sugar molecules that may or may...
Multiple sugar molecules that may or may...
3.7K


