English

If graphynes turn into graphene: the thermal stability study

Mesoscale and Nanoscale Physics 2013-10-09 v1

Abstract

The thermal stability of α\alpha-, β\beta-, 6,6,12-graphyne and graphdiyne was studied by a statistic model, which was seriously tested by classical molecular dynamics simulations. By first-principles calculations of related potential energy curves, the model predicts that all the lifetime of free-standing single layer graphynes considered is more than 1044^{44} years at room temperature. When the temperature gets up to 1000 K, they are still very stable, but quickly turn into graphene if the temperature is about 2000 K

Cite

@article{arxiv.1310.2116,
  title  = {If graphynes turn into graphene: the thermal stability study},
  author = {Yi-Guo Xu and Chen Ming and Zheng-Zhe Lin and Fan-Xin Meng and Jun Zhuang and Xi-Jing Ning},
  journal= {arXiv preprint arXiv:1310.2116},
  year   = {2013}
}

Comments

14 pages, 6 figures

R2 v1 2026-06-22T01:42:29.908Z