通过格子振动和离子扩散介导的塑料晶体中的巨大可逆的巴罗卡洛里效应
Ming Zeng1, Carlos Escorihuela-Sayalero1, Tamio Ikeshoji2
1Grup de Caracterizació de Materials, Departament de Física, EEBE and Barcelona Research Center in Multiscale Science and Engineering Universitat Politècnica de Catalunya, Av. Eduard Maristany 10-14, Barcelona, 08019, Catalonia, Spain.
概括
在LiCB11H12中发现巨大的热量效应 (BCE),以实现可持续的固态冷却. 这种材料在相位过渡附近表现出大,可逆的温度和变化,为传统冷却技术提供了有希望的替代方案.
科学领域:
- 材料科学 材料科学 材料科学
- 热力学是一种热力学.
- 固态物理 固态物理
背景情况:
- 固态冷却/加热为当前技术提供了一个可持续的替代方案.
- 由水位压力 (p) 驱动的巴罗卡洛里效应 (BCE) 对大温度和变化有希望.
- 挑战包括大压力转移和在同一材料中实现显著的 ΔT 和 ΔS.
研究的目的:
- 在LiCB11H12.12中展示巨大的和可逆的 BCE.
- 为了调查 BCE 接近物质的顺序-混乱阶段过渡在~380 K.
- 量化格子振动,分子重定向和离子扩散对 BCE 的贡献.
主要方法:
- 实验测量在水静压下对亚热热温度变化 (水静ΔT下) 和同热变化 (水静ΔS下) 的测量.
- 利用分子动力学模拟来分析 BCE 的潜在机制.
- 研究格子振动,分子重定位和离子扩散的作用.
主要成果:
- 巨大的和可逆的BCE在LiCB11H12中显示在380K附近.
- 实现了 ΔS_rev 下载 = 280 J K-1 kg-1 和 ΔT_rev 下载 = 32 K 的 Δp ≈ 0.23 GPa.
- ≈2 J K-1 kg-1 MPa-1 的高可逆热量强度观察到 Δp ≈0.1 GPa.
- 格子振动显著促进了ΔS,而离子扩散对于相位过渡至关重要.
结论:
- LiCB11H12表现出最先进的巨大热量效应,与当前的基准标准相竞争.
- 该材料为高效和可持续的固态冷却和加热应用提供了一个有前途的途径.
- 了解格子动力学和离子扩散的相互作用是优化 BCE 材料的关键.
相关概念视频
Trends in Lattice Energy: Ion Size and Charge
23.9K
An ionic compound is stable because of the electrostatic attraction between its positive and negative ions. The lattice energy of a compound is a measure of the strength of this attraction. The lattice energy (ΔHlattice) of an ionic compound is defined as the energy required to separate one mole of the solid into its component gaseous ions. For the ionic solid sodium chloride, the lattice energy is the enthalpy change of the process:
23.9K
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
Crystal Field Theory - Octahedral Complexes
26.4K
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...
26.4K
X-ray Crystallography
23.9K
The size of the unit cell and the arrangement of atoms in a crystal may be determined from measurements of the diffraction of X-rays by the crystal, termed X-ray crystallography.
Diffraction
Diffraction is the change in the direction of travel experienced by an electromagnetic wave when it encounters a physical barrier whose dimensions are comparable to those of the wavelength of the light. X-rays are electromagnetic radiation with wavelengths about as long as the distance between neighboring...
Diffraction
Diffraction is the change in the direction of travel experienced by an electromagnetic wave when it encounters a physical barrier whose dimensions are comparable to those of the wavelength of the light. X-rays are electromagnetic radiation with wavelengths about as long as the distance between neighboring...
23.9K
Recrystallization: Solid–Solution Equilibria
1.1K
Recrystallization is a purification technique used to separate impurities from solid compounds. In this technique, no chemical reactions occur. Instead, it exploits physical properties only, specifically, the solubility differences between the desired compound and impurities, either at a single temperature or at different temperatures, and under other selected conditions. The solid-solution equilibrium (solubility equilibrium) of each component in the solution represents a binary phase...
1.1K
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


