热力学和联流体中的集体模式
Cillian Cockrell1, Aleksandra Dragović2
1Department of Materials, Imperial College London, Exhibition Road, London SW7 2AZ, United Kingdom.
The Journal of chemical physics
|March 15, 2024
概括
一个新的理论使用声子热力学来解释简单流体在液体,超临界和气体状态的行为. 这种方法使它们与复杂的结液体有区别.
科学领域:
- 热力学是一种热力学.
- 流体动力学 流体动力学
- 凝聚物质物理学 凝聚物质物理学
背景情况:
- 液体和超临界流体热力学缺乏一般理论,与晶体固体不同.
- 将声子和配置等固态概念扩展到液体是具有挑战性的,特别是对于水等异常液体.
- 超临界流体在能源和环境应用中至关重要,但它们的特性仍然不太清楚.
研究的目的:
- 开发一个理论框架,以了解液体,超临界和气态状态的简单流体的热力学.
- 从声子光谱中确定一个关键参数,该参数支配流体热力学.
- 为了区分简单流体与键流体的热力学行为.
主要方法:
- 利用声子传播的光谱来定义流体热力学.
- 从声子光谱中推导出单个参数来确定非理想的.
- 将声子理论与过度缩和流体中相应的状态联系起来.
主要成果:
- 来自声子光谱的单个参数成功地描述了简单流体的热力学在相位过渡的过程中.
- 基于它们的热力学行为,在简单的流体和与结合的流体之间建立了明确的区别.
- 波热力学解释了流体相图中的相应状态,并与过度缩有关.
结论:
- 声波热力学为简单流体提供了一个统一的理论框架,包括超临界状态.
- 这项研究突出了对与结合的流体的声子频谱分析的局限性.
- 这些发现为超临界流体提供了关键的理论见解,有助于它们在环境和能源技术中的应用.
相关概念视频
Hydrogen Bonds
8.5K
A hydrogen bond is formed when a weakly positive hydrogen atom already bonded to one electronegative atom (for example, the oxygen in the water molecule) is attracted to another electronegative atom from another polar molecule, such as water (H2O), hydrogen fluoride (HF), or ammonia (NH3). The huge electronegativity difference between the H atom (2.1) and the atom to which it is bonded (4.0 for an F atom, 3.5 for an O atom, or 3.0 for an N atom), combined with the very small size of an H atom...
8.5K
Comparing Intermolecular Forces: Melting Point, Boiling Point, and Miscibility
44.3K
Intermolecular forces are attractive forces that exist between molecules. They dictate several bulk properties, such as melting points, boiling points, and solubilities (miscibilities) of substances. Molar mass, molecular shape, and polarity affect the strength of different intermolecular forces, which influence the magnitude of physical properties across a family of molecules.
Temporary attractive forces like dispersion are present in all molecules, whether they are polar or nonpolar. They...
Temporary attractive forces like dispersion are present in all molecules, whether they are polar or nonpolar. They...
44.3K
IR Spectrum Peak Broadening: Hydrogen Bonding
980
The vibrational frequency of a bond is directly proportional to its bond strength. As a result, stronger bonds vibrate at higher frequencies, while weaker bonds vibrate at lower frequencies. The stretching vibration of the strong O–H bond in alcohols and phenols (very dilute solution or gas phase) appears as a sharp peak at 3600–3650 cm−1.
However, the extent of hydrogen bonding influences the observed stretching frequency and band broadening. Intermolecular or intramolecular...
However, the extent of hydrogen bonding influences the observed stretching frequency and band broadening. Intermolecular or intramolecular...
980
Molecular Orbital Theory II
19.2K
Molecular Orbital Energy Diagrams
19.2K
Intermolecular Forces and Physical Properties
20.8K
20.8K
States of Water
50.7K
Water exists in any one of the three classical states: solid (ice), liquid (water), and gas (steam or water vapor). The state of water depends on i) the intermolecular forces that draw molecules together and ii) the kinetic energy that leads to movements that pull them apart.
Water freezes when the intermolecular forces are greater than the kinetic energy. Unlike most other substances, water is less dense in its solid state than in its liquid state. This is because each water molecule can form...
Water freezes when the intermolecular forces are greater than the kinetic energy. Unlike most other substances, water is less dense in its solid state than in its liquid state. This is because each water molecule can form...
50.7K


