中文

石墨烯纳米片的关联电子性质:蔻烯

化学物理 2019-02-15 v2

摘要

We report studies of the correlated excited states of coronene and substituted coronene within the Pariser-Parr-Pople (PPP) correlated π\pi-electron model employing symmetry adapted density matrix renormalization group technique. These polynuclear aromatic hydrocarbons can be considered as graphene nanoflakes. We review their electronic structures utilizing a new symmetry adaptation scheme that exploits electron-hole symmetry, spin-inversion symmetry and end-to-end interchange symmetry. Study of the electronic structures sheds light on the electron correlation effects in these finite-size graphene analogues, which diminishes on going from one-dimensional to higher-dimensional systems, yet is significant within these finite graphene derivatives.

关键词

引用

@article{arxiv.1601.00053,
  title  = {Correlated Electronic Properties of a Graphene Nanoflake: Coronene},
  author = {Suryoday Prodhan and Sumit Mazumdar and S. Ramasesha},
  journal= {arXiv preprint arXiv:1601.00053},
  year   = {2019}
}

备注

10 Pages, 3 figures, 4 Tables