Xe与富勒烯团簇的高能碰撞

D. Nugawela, S. Stuart, J. Jakowski
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引用次数: 0

摘要

富勒烯活性的一个子集是用高能惰性气体与富勒烯团簇的碰撞实验。我们用经典反应动力学方法报道了在200 keV和400 keV的Xe与(C60)55个富勒烯团簇碰撞后,高达(C60)m, m=2-12的富勒烯低聚物的形成。碰撞后观察到对C60+n (n=1-4)碎片的偏好。碰撞后1ns在C105 ~ C122范围内检测到的峰值序列与实验结果相吻合。根据碰撞后动力学,两个富勒烯之间形成一个交联的二聚体在25 ns后形成花生形状的分子,而线性三聚体在43 ns后变成碳纳米管状结构。在ns时间尺度下,更多有组织的碳分子和大的无定形碳块也作为碰撞产物存在。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Highly Energetic Collisions of Xe with Fullerene Clusters
One subset of the fullerene activities is collision experiments using high energetic inert gases with fullerene clusters. We report on the formation of fullerene oligomers upto (C60)m, m=2-12 following the collisions of 200 keV and 400 keV Xe with (C60)55 fullerene clusters using classical reactive dynamics. A preference for C60+n (n=1-4) fragments was observed after the collision. The sequence of peaks detected in the range C105 - C122 after 1 ns from the collision is comparable with the experimental results. According to the post collisional dynamics, a dimer formed with one cross-link between two fullerenes led to a peanut shaped molecule after 25 ns and a linear trimer has turned into a carbon nanotube like structure after 43 ns. At the ns time scale, more organized carbon molecules as well as big amorphous carbon chunks also remained as collisional products.
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