Органическая макромолекула на графене со структурными дефектами: оценки перехода заряда и энергии адгезии

С. И. Давыдов
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Abstract

The previously proposed model of dengling bonds of an organic macromolecule (MM) adsorbed on an ideal single-layer graphene (SLG) is generalized to the presence of structural defects in SLG: inclusions of two-layer or amorphous graphene. Analytical estimates of the charge transition between MM and the substrate and the adhesion energy are obtained.
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结构缺陷石墨上的有机大分子:电荷和附着力变化评估
先前提出的有机大分子(MM)吸附在理想单层石墨烯(SLG)上的登岭键模型推广到SLG中存在的结构缺陷:两层或非晶石墨烯的夹杂物。得到了MM与衬底之间的电荷跃迁和粘附能的分析估计。
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