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Polyethylene thin-film growth via clustre-surface collisions

机译:聚乙烯薄膜通过团簇表面碰撞生长

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Molecular dynamics simulations have been performed to investigate the growth of polyethylene thin films via cluster-surface collisions. The s ubstrate is hydrogen-terminated diamond (111) and a beam of four molecular clusters of ethylene impact the substrate at a velocity o f 18 km/s. The atoms are characterized by a realistic many-body empirical potential fory hydrocarbon systems. The goal of this study is to compare the simulation results to existing experimental data ob5tained under similar reaction conditions to better understand the process by which solid thin hydrocarbon films grow during molecular cluster-surface impacts.
机译:已经进行了分子动力学模拟,以研究通过簇表面碰撞而产生的聚乙烯薄膜的生长。基材是氢封端的金刚石(111),四个乙烯分子簇的束以18 km / s的速度撞击基材。原子的特征是具有现实的多体经验的潜在烃类系统。这项研究的目的是将模拟结果与在类似反应条件下获得的现有实验数据进行比较,以更好地理解分子簇表面撞击过程中固态烃薄膜生长的过程。

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