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Updated: May 30, 2025

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材料的未来是无形的吗? 模拟无形材料的挑战和机遇

Ata Madanchi1, Emna Azek2, Karim Zongo3

  • 1Department of Physics, McGill University, Montréal, Québec H3A 2T8, Canada.

ACS physical chemistry Au
|January 27, 2025
PubMed
概括

发现新的无形材料需要计算和实验方法之间的更好的协同作用. 本综述通过讨论用于无形物质模拟的ARTn,RMC和机器学习等技术来弥合差距.

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Polymer Classification: Crystallinity01:21

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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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