English

Fluorine patterning of graphene: Effects of fluorine content and temperature

Materials Science 2020-07-30 v1

Abstract

In this paper we present a successful approach for the generation of partially fluorinated graphene structures. A computationally simple model optimized on a large DFT dataset quickly and precisely predicts experimentally observed structures. From the analysis of the structural diversity of fluorinated graphene in a wide range of synthesis temperatures, the general structural patterns are identified and the conditions for their achievement are determined. In addition, to facilitate further studies of fluorinated graphene, we present a ready-to-use GenCF code that implements the described structure generator.

Keywords

Cite

@article{arxiv.2007.14765,
  title  = {Fluorine patterning of graphene: Effects of fluorine content and temperature},
  author = {Ruslan D. Yamaletdinov and Yaroslav A. Nikiforov and Lyubov G. Bulusheva and Alexander V. Okotrub},
  journal= {arXiv preprint arXiv:2007.14765},
  year   = {2020}
}