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HELIUM ADSORPTION ON CARBON NANOTUBE BUNDLES WITH DIFFERENT DIAMETERS: MOLECULAR DYNAMICS SIMULATION

机译:不同直径的碳纳米管捆绑上的氦吸附:分子动力学模拟

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We have used molecular dynamics simulation to study helium adsorption capacity of carbon nanotube bundles with different diameters. Homogeneous carbon nanotube bundles of (8,8), (9,9), (10,10), (11,11), and (12,12) single walled carbon nanotubes have been considered. The results indicate that the exohedral adsorption coverage does not depend on the diameter of carbon nanotubes, while the endohedral adsorption coverage is increased by increasing the diameter.
机译:我们使用的是分子动力学模拟,研究碳纳米管束的氦吸附容量,具有不同的直径。已经考虑了(8,8),(9,9),(10,10),(11,11)和(12,12)单壁碳纳米管的均匀碳纳米管束。结果表明,外壳吸附覆盖率不依赖于碳纳米管的直径,而通过增加直径来增加胚乳吸附覆盖。

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