在同聚合物接口上的线性多块共聚合物的热力学和形态学
Ryan P Collanton1, Christopher J Ellison1, Kevin D Dorfman1
1Department of Chemical Engineering and Materials Science, University of Minnesota-Twin Cities, 421 Washington Ave. SE, Minneapolis, Minnesota 55455, USA.
The Journal of chemical physics
|November 21, 2023
概括
线性多块共聚物可以通过修改接口热力学来使混合塑料废物兼容. 区块的聚合度显著影响接口特性,而不是区块的数量.
科学领域:
- 聚合物科学 聚合物科学
- 材料科学 材料科学 材料科学
- 计算化学计算化学
背景情况:
- 混合塑料废物积累需要有效的兼容化策略.
- 块共聚合物是兼容不混合的聚合物混合物的有希望的候选者.
- 了解共聚合物架构对接口特性的影响至关重要.
研究的目的:
- 调查线性多块共聚合物架构如何影响强分离的同聚合物混合物的接口热力学.
- 为了确定区块数量与区块聚合度对兼容性的相对重要性.
- 为解释兼容器性能建立一个形态框架.
主要方法:
- 使用克雷默-格雷斯特聚合物链的分子动力学模拟.
- 通过像第二个病毒系数这样的参数分析接口热力学.
- 与区块结点分布相关的表面压力 (界面张力减小).
主要成果:
- 接口热力学对区块聚合度比对区块数量更敏感.
- 表面压力和界面上的块结点的空间均性之间存在强烈的相关性.
- 兼容器架构在高负载时对界面张力修改的影响有限.
结论:
- 聚合的区块度是设计有效的多区块共聚合物兼容器的一个关键因素.
- 块结点的空间分布为减少界面张力的机制提供了洞察力.
- 线性多块共聚合物架构为塑料废物兼容提供可调节的特性,块长度是关键参数.
相关概念视频
Characteristics and Nomenclature of Copolymers
2.5K
Copolymers are the products obtained from the polymerization of multiple monomer species. So, in a polymer chain itself, there can be multiple repeating units that come from different monomers. The process of synthesizing a polymer from different monomer species is called copolymerization. When two monomers are involved, the polymer is known as a bipolymer. Polymers with three and four monomers are termed terpolymers and quaterpolymers, respectively. Figure 1 depicts the copolymerization of...
2.5K
Polymer Classification: Architecture
2.7K
Polymers are classified as linear or branched on the basis of their chain architecture. The polymer chains in linear polymers have a long chain-like structure with minimal to no branching at all. Even if a polymer features large substituent groups on the monomer, which appear as branches to the skeleton, it is not considered a branched polymer. A branched polymer contains secondary polymer chains that arise from the main polymer chain. The branching occurs when the polymer growth shifts from...
2.7K
Characteristics and Nomenclature of Homopolymers
3.1K
Polymers that are made up of identical monomer units are called homopolymers. Only one repeating unit is involved in the construction of the homopolymer structure. For example, as depicted in Figure 1, polypropylene is a homopolymer constituted of propylene monomers. Here, the only repeating unit in the polymer chain is propylene.
3.1K
Polymer Classification: Crystallinity
2.9K
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...
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...
2.9K
Polymer Classification: Stereospecificity
2.4K
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
Polymers: Molecular Weight Distribution
3.4K
For any given polymer, the weight average molecular weight (Mw) is higher than, if not equal to, the number average molecular weight (Mn). The only situation in which the weight average molecular weight and the number average molecular weight are equal is when a polymer consists only of chains with equal molecular weight. However, this never happens in a synthetic polymer, since it is difficult to control the polymerization process up to a molecular level with accuracy to a hundred percent.
3.4K


