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cond-mat.mtrl-sci2025
Toward Sustainable Polymer Design: A Molecular Dynamics-Informed Machine Learning Approach for Vitrimers
Yiwen Zheng, Agni K. Biswal, Yaqi Guo +5
Vitrimer is an emerging class of sustainable polymers with self-healing capabilities enabled by dynamic covalent adaptive networks. However, their limited molecular diversity const…
cond-mat.mtrl-sci2024
AI-guided inverse design and discovery of recyclable vitrimeric polymers
Yiwen Zheng, Prakash Thakolkaran, Agni K. Biswal +6
Vitrimer is a new, exciting class of sustainable polymers with the ability to heal due to their dynamic covalent adaptive network that can go through associative rearrangement reac…