Computer modeling of the crystallization process of single-chain ethylene/1-hexene copolymers from dilute solutions

Langevin molecular dynamics (LMD) simulations have been performed to understand the role of the short chain branches (SCB) on the formation of ordered domains by cooling dilute solutions of ethylene/α-olefins copolymer models. Three different long single-chain models (C₂₀₀₀) with 0, 5, and 10 branch...

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