在半液态层的冰层中,分子动力学的内层不均性
Ikki Yasuda1, Katsuhiro Endo1, Noriyoshi Arai1
1Department of Mechanical Engineering, Keio University, Yokohama, Japan.
Communications chemistry
|May 29, 2024
概括
冰面上的半液体层表现出动态异质性,而不是简单的固体液体混合物. 分子形成过渡域,揭示了对冰面性质的新见解.
科学领域:
- 表面科学是一门学科.
- 物理化学 物理化学
- 材料科学 材料科学 材料科学
背景情况:
- 冰面上的准液态层 (QLL) 影响其性能.
- 在分子层面上对QLL异质性的理解是有限的.
- 之前的模型在QLL中提出了部分类似冰的结构.
研究的目的:
- 为了研究QLL中的分子动力学异质性.
- 为了澄清QLLs在分子水平上的性质.
- 为了解冰的表面特性提供洞察力.
主要方法:
- 使用了分子动力学模拟.
- 在模拟数据上使用机器学习分析.
- 进行了分子动力学和域形成的检查.
主要成果:
- QLL显示动态异质性,而不是固体和液体水分子的混合物.
- 分子形成具有类似行为的动态域,类似于超冷水.
- 域大小不是固定的,但订单取决于温度和晶体面.
结论:
- QLLs表现出异质的分子动态,而不是静态的固体类和液体类区域.
- 在QLL中分子的移动性是动态的,频繁的状态切换.
- 这些发现为冰面特性提供了分子层面的理解.
相关概念视频
Molecular Comparison of Gases, Liquids, and Solids
41.0K
Particles in a solid are tightly packed together (fixed shape) and often arranged in a regular pattern; in a liquid, they are close together with no regular arrangement (no fixed shape); in a gas, they are far apart with no regular arrangement (no fixed shape). Particles in a solid vibrate about fixed positions (cannot flow) and do not generally move in relation to one another; in a liquid, they move past each other (can flow) but remain in essentially constant contact; in a gas, they move...
41.0K
Phase Transitions: Melting and Freezing
12.4K
Heating a crystalline solid increases the average energy of its atoms, molecules, or ions, and the solid gets hotter. At some point, the added energy becomes large enough to partially overcome the forces holding the molecules or ions of the solid in their fixed positions, and the solid begins the process of transitioning to the liquid state or melting. At this point, the temperature of the solid stops rising, despite the continual input of heat, and it remains constant until all of the solid is...
12.4K
Molecular and Ionic Solids
17.1K
Crystalline solids are divided into four types: molecular, ionic, metallic, and covalent network based on the type of constituent units and their interparticle interactions.
Molecular Solids
Molecular crystalline solids, such as ice, sucrose (table sugar), and iodine, are solids that are composed of neutral molecules as their constituent units. These molecules are held together by weak intermolecular forces such as London dispersion forces, dipole-dipole interactions, or hydrogen bonds, which...
Molecular Solids
Molecular crystalline solids, such as ice, sucrose (table sugar), and iodine, are solids that are composed of neutral molecules as their constituent units. These molecules are held together by weak intermolecular forces such as London dispersion forces, dipole-dipole interactions, or hydrogen bonds, which...
17.1K
Phase Transitions: Sublimation and Deposition
17.1K
Some solids can transition directly into the gaseous state, bypassing the liquid state, via a process known as sublimation. At room temperature and standard pressure, a piece of dry ice (solid CO2) sublimes, appearing to gradually disappear without ever forming any liquid. Snow and ice sublimate at temperatures below the melting point of water, a slow process that may be accelerated by winds and the reduced atmospheric pressures at high altitudes. When solid iodine is warmed, the solid sublimes...
17.1K
Intermolecular Forces and Physical Properties
20.8K
20.8K
Boundary Layer Characteristics
68
When a fluid encounters a solid surface, a boundary layer forms due to the interaction between the fluid's motion and the stationary surface. This phenomenon is characterized by a thin region adjacent to the surface where viscous forces dominate, influencing the fluid's velocity profile. The development of the boundary layer begins at the leading edge of the surface and evolves as the fluid moves downstream.As the fluid flows over the surface, friction between the fluid and the wall slows down...
68


