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Multi-scale development of a terpolymer kinetic hydrate inhibitor: Molecular design, mechanistic insights via DFT/MD, formulation optimization, and high-pressure validation

Author:

Jie Deng,Jingjing Li,Jing Long,Qifang Liu,Tailiang Zhang,Wenmeng Duan,Cunchuan Zheng

Publication:

Journal of Molecular Structure

Publisher:

Elsevier

Date:

25 October 2026

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