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相关概念视频

Polymer Classification: Crystallinity01:21

Polymer Classification: Crystallinity

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Unlike ionic or small covalent molecules, polymers do not form crystalline solids due to the diffusion limitations of their long-chain structures. However, polymers contain microscopic crystalline domains separated by amorphous domains.
Crystalline domains are the regions where polymer chains are aligned in an orderly manner and held together in proximity by intermolecular forces. For example, chains in the crystalline domains of polyethylene and nylon are bound together by van der Waals...
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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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Cationic Chain-Growth Polymerization: Mechanism00:57

Cationic Chain-Growth Polymerization: Mechanism

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The cationic polymerization mechanism consists of three steps: initiation, propagation, and termination. In the initiation step of the polymerization process, the π bond of a monomer gets protonated by the Lewis acid catalyst, which is formed from boron trifluoride and water. The protonation of the π bond generates a carbocation stabilized by the electron‐donating group. In the propagation step, the π bond of the second monomer acts as a nucleophile and attacks the...
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Polymer Classification: Stereospecificity01:26

Polymer Classification: Stereospecificity

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Polymerization generates chiral centers along the entire backbone of a polymer chain. Accordingly, the stereochemistry of the substituent group has a significant effect on polymer properties. Polymers formed from monosubstituted alkene monomers feature chiral carbons at every alternate position in the polymer backbone. Relative to the predominant orientation of substituents at the adjacent chiral carbons, the polymer can exist in three different configurations: isotactic, syndiotactic, and...
2.4K
Intermolecular Forces03:13

Intermolecular Forces

58.2K
Atoms and molecules interact through bonds (or forces): intramolecular and intermolecular. The forces are electrostatic as they arise from interactions (attractive or repulsive) between charged species (permanent, partial, or temporary charges) and exist with varying strengths between ions, polar, nonpolar, and neutral molecules. The different types of intermolecular forces are ion–dipole, dipole–dipole, hydrogen bonds, and dispersion; among these, dipole–dipole, hydrogen...
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电化学界面上的三级固体聚合物电解质:一项计算研究

Alejandro Rivera-Pousa1,2, José Manuel Otero-Mato1,2, Hadrian Montes-Campos1,2,3

  • 1Grupo de Nanomateriais, Fotónica e Materia Branda, Departamento de Física de Partículas, Universidade de Santiago de Compostela, Campus Vida s/n, E-15782 Santiago de Compostela, Spain.

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概括
此摘要是机器生成的。

带有离子液的三元聚合物电解质对电池有很大的前景. 分子动力学模拟显示,界面分层阻碍了Li+的移动性,但特定的离子液体通过促进阴离子迁移来提高性能.

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科学领域:

  • 材料科学 材料科学 材料科学
  • 电化学 电化学 电化学
  • 计算化学的计算化学

背景情况:

  • 聚合物电解质可以提高电池性能,但它们的界面行为需要进一步研究.
  • 了解电极/电解质接口对于推进电池技术至关重要.

研究的目的:

  • 通过使用经典分子动力学 (MD) 模拟,研究三元聚合物电解质在石墨烯样电极接口上的分子行为.
  • 描述这些电解质内的Li+离子的溶解,扩散和聚合物构成.

主要方法:

  • 经典的MD模拟被用来研究三元聚合物电解质 (聚乙烯氧化物),二三甲硫胺和离子液体) 限制在石墨烯样表面之间.
  • 分析包括辐射分布函数,协调数,密度配置和聚合物结构参数 (旋转半径,端到端距离).

主要成果:

  • 在接口处的电解质分层降低了 Li + 垂直于电极的流动性,并为阴离子接触创造了能量障碍.
  • 离子液体的类型和度显著影响接口的结构和动态特性.
  • 一种含有低度罗利基离子液体的电解质表现出卓越的性能,增强了Li+迁移.

结论:

  • 接口结构极大地影响了聚合物电解质中的离子运输.
  • 离子液体的选择和度是优化固体类凝电解质中电极/电解质接口性能的关键因素.
  • 基于的离子液体显示了提高离子电池性能的潜力.