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相关概念视频

Molecular and Ionic Solids02:54

Molecular and Ionic Solids

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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...
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Atomic Nuclei: Nuclear Spin State Population Distribution01:14

Atomic Nuclei: Nuclear Spin State Population Distribution

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Near absolute zero temperatures, in the presence of a magnetic field, the majority of nuclei prefer the lower energy spin-up state to the higher energy spin-down state. As temperatures increase, the energy from thermal collisions distributes the spins more equally between the two states. The Boltzmann distribution equation gives the ratio of the number of spins predicted in the spin −½ (N−) and spin +½ (N+) states.
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Spin–Spin Coupling Constant: Overview01:08

Spin–Spin Coupling Constant: Overview

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In bromoethane, the three methyl protons are coupled to the two methylene protons that are three bonds away. In accordance with the n+1 rule, the signal from the methyl protons is split into three peaks with 1:2:1 relative intensities. The methylene protons appear as a quartet, with the relative intensities of 1:3:3:1.
Qualitatively, any spin plus-half nucleus polarizes the spins of its electrons to the minus-half state. Consequently, the paired electron in the hydrogen–carbon bond must...
923
Spin–Spin Coupling: One-Bond Coupling01:17

Spin–Spin Coupling: One-Bond Coupling

973
Coupling interactions are strongest between NMR-active nuclei bonded to each other, where spin information can be transmitted directly through the pair of bonding electrons. While nuclei polarize their electrons to the opposite spins, the bonding electron pair has opposite spins. Configurations with antiparallel nuclear spins are expected to be lower in energy. When coupling makes antiparallel states more favorable, J is considered to have a positive value. The one-bond coupling constant, 1J,...
973
Phase Transitions: Melting and Freezing02:39

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
Spin–Spin Coupling: Two-Bond Coupling (Geminal Coupling)01:20

Spin–Spin Coupling: Two-Bond Coupling (Geminal Coupling)

1.0K
Two NMR-active nuclei bonded to a central atom can be involved in geminal or two-bond coupling. Geminal coupling is commonly seen between diastereotopic protons in chiral molecules and unsymmetrical alkenes, among others.
The central atom need not be NMR-active because its electrons are affected by the electron polarization of the spin-active atoms. However, spin information is transmitted less effectively than in one-bond coupling, and 2J values are usually weaker than 1J values. The energy of...
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High-Contrast and Fast Photorheological Switching of a Twist-Bend Nematic Liquid Crystal
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具有跨90K调节过渡温度的二维旋转交叉分子固体溶液

Ying-Ying Wu1, Zhao-Yang Li1, Shuang Peng1

  • 1School of Materials Science and Engineering, Nankai University, 38 Tongyan Road, Haihe Educational Park, Tianjin 300350, China.

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|February 27, 2024
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概括

研究人员开发了一种新的旋转交叉 (SCO) 材料,其可调节的过渡温度 (Tc) 跨越了90K. 这一进步扩大了分子设备中双可变分子开关的潜在应用.

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科学领域:

  • 材料科学
  • 超分子化学
  • 固态化学

背景情况:

  • 旋转交叉 (SCO) 材料对双稳定分子开关具有前景.
  • 目前的SCO材料具有有限的旋转过渡温度 (Tc),限制了实际使用.
  • 需要更广泛的Tc范围来覆盖更广泛的应用环境温度范围.

研究的目的:

  • 开发一个新的二维SCO固体溶液系统.
  • 在一个广泛的范围内微调旋转过渡温度 (Tc).
  • 了解SCO材料中的分子相互作用和Tc之间的关系.

主要方法:

  • 一个二维SCO固体溶液系统的合成:[Fe ((HL)) ((HL)) ·H2O.
  • 系统调节连接物分数 (x) 来调整Tc.
  • 单晶X射线衍射和周期密度函数理论 (DFT) 的计算.

主要成果:

  • 通过调整连体分数 (x) 来实现90K (227316K) 的Tc线性微调.
  • 证明增加的配体分数 (x) 强化了结和分子间相互作用.
  • 发现增强的层间相互作用改变了FeN2O2S2联体场和SCO能量屏障,增加了Tc.

结论:

  • 通过分子相互作用的操纵建立了调整SCO材料中的Tc的新途径.
  • 开发的SCO系统在广泛的温度范围内提供可调节的可视化.
  • 这项研究扩大了双稳分子固体的应用潜力.