Simulation of Interaction between C60 Fullerene Molecule and Graphene

被引：2
|
作者：
Rechviashvili, S. Sh. [1 ]
Bukhurova, M. M. [1 ]
机构：
[1] Inst Appl Math & Automat, Nalchik 360000, Russia
来源：
PROTECTION OF METALS AND PHYSICAL CHEMISTRY OF SURFACES | 2017年 / 53卷 / 06期
关键词：
ADSORBATE VIBRATIONS;
D O I：
10.1134/S2070205117060181
中图分类号：
TF [冶金工业];
学科分类号：
0806 ;
摘要：
This work describes equations for the potential and force of interaction between C-60 fullerene molecules with an ideal infinite graphene sheet on the basis of the Lennard-Jones pair potential. The fall of a fullerene molecule on graphene has been numerically simulated. It is demonstrated that fullerene molecule near the graphene surface execute oscillating motion, with its pattern depending on the initial conditions and interaction parameters. The obtained results are of interest for investigation of the adsorption of fullerene molecules on graphene.
引用
收藏
页码：967 / 969
页数：3
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