在散装和限制条件下进行的杆状聚合物的同位体转化为内马体的分子模拟

Biao Yan1, Daniel Martínez-Fernández1, Katerina Foteinopoulou1

  • 1Institute for Optoelectronic Systems and Microtechnology (ISOM) and Escuela Técnica Superior de Ingenieros Industriales (ETSII), Universidad Politécnica de Madrid (UPM), José Gutierrez Abascal 2, 28006 Madrid, Spain.

Polymers
|June 27, 2025
PubMed
概括

这项研究使用蒙特卡洛模拟来探索链条长度,刚度和封闭性如何影响硬合体聚合物的相位过渡. 结果精确地确定了在各种条件下的同位素转化为阴性转变的度范围.

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